Ligand source activities (1 row/activity)
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | ||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
AssayType |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
| 2274 | 3173 | 58 | None | -10 | 36 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | ||
| 4917 | 3173 | 58 | None | -10 | 36 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | ||
| 7279 | 3173 | 58 | None | -10 | 36 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL728 | 3173 | 58 | None | -10 | 36 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | ||
| DB00433 | 3173 | 58 | None | -10 | 36 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | ||
| 2470 | 3653 | 50 | None | -38018 | 23 | Human | 5.9 | pAC50 | = | 5.9 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 3300 | 3653 | 50 | None | -38018 | 23 | Human | 5.9 | pAC50 | = | 5.9 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 5265 | 3653 | 50 | None | -38018 | 23 | Human | 5.9 | pAC50 | = | 5.9 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 99 | 3653 | 50 | None | -38018 | 23 | Human | 5.9 | pAC50 | = | 5.9 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL267930 | 3653 | 50 | None | -38018 | 23 | Human | 5.9 | pAC50 | = | 5.9 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 3081361 | 93934 | 123 | None | 1 | 14 | Human | 5.9 | pAC50 | = | 5.9 | Functional | ChEMBL | 474 | 5 | 1 | 5 | 4.4 | COc1cc2/c(=N/c3ccc(Br)cc3F)nc[nH]c2cc1OCC1CCN(C)CC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL24828 | 93934 | 123 | None | 1 | 14 | Human | 5.9 | pAC50 | = | 5.9 | Functional | ChEMBL | 474 | 5 | 1 | 5 | 4.4 | COc1cc2/c(=N/c3ccc(Br)cc3F)nc[nH]c2cc1OCC1CCN(C)CC1 | 10.1038/s41467-023-40064-9 | ||
| 214 | 3860 | 58 | None | -31 | 28 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | ||
| 2740 | 3860 | 58 | None | -31 | 28 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | ||
| 5566 | 3860 | 58 | None | -31 | 28 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | ||
| 66064 | 3860 | 58 | None | -31 | 28 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | ||
| CHEMBL422 | 3860 | 58 | None | -31 | 28 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | ||
| DB00831 | 3860 | 58 | None | -31 | 28 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | ||
| 242 | 470 | 124 | None | -97 | 33 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | ||
| 34 | 470 | 124 | None | -97 | 33 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | ||
| 60795 | 470 | 124 | None | -97 | 33 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1112 | 470 | 124 | None | -97 | 33 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | ||
| DB01238 | 470 | 124 | None | -97 | 33 | Human | 5.7 | pAC50 | = | 5.7 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | ||
| 2393 | 3334 | 82 | None | -2041 | 9 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | ||
| 5078 | 3334 | 82 | None | -2041 | 9 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | ||
| 51 | 3334 | 82 | None | -2041 | 9 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | ||
| CHEMBL905 | 3334 | 82 | None | -2041 | 9 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | ||
| DB00953 | 3334 | 82 | None | -2041 | 9 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | ||
| 3547 | 141373 | 71 | None | -3 | 8 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 291 | 2 | 1 | 4 | 1.2 | O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL38380 | 141373 | 71 | None | -3 | 8 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 291 | 2 | 1 | 4 | 1.2 | O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL541388 | 141373 | 71 | None | -3 | 8 | Human | 4.7 | pAC50 | = | 4.7 | Functional | ChEMBL | 291 | 2 | 1 | 4 | 1.2 | O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 | 10.1038/s41467-023-40064-9 | ||
| 71398 | 106439 | 44 | None | -3235 | 14 | Human | 4.6 | pAC50 | = | 4.6 | Functional | ChEMBL | 302 | 5 | 4 | 4 | 3.6 | C[C@@H](Cc1ccc(O)c(O)c1)[C@H](C)Cc1ccc(O)c(O)c1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL313972 | 106439 | 44 | None | -3235 | 14 | Human | 4.6 | pAC50 | = | 4.6 | Functional | ChEMBL | 302 | 5 | 4 | 4 | 3.6 | C[C@@H](Cc1ccc(O)c(O)c1)[C@H](C)Cc1ccc(O)c(O)c1 | 10.1038/s41467-023-40064-9 | ||
| 68617 | 205527 | 62 | None | -66 | 30 | Human | 4.6 | pAC50 | = | 4.6 | Functional | ChEMBL | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1709 | 205527 | 62 | None | -66 | 30 | Human | 4.6 | pAC50 | = | 4.6 | Functional | ChEMBL | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL809 | 205527 | 62 | None | -66 | 30 | Human | 4.6 | pAC50 | = | 4.6 | Functional | ChEMBL | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1038/s41467-023-40064-9 | ||
| 367 | 3824 | 12 | None | -1548 | 8 | Human | 6.6 | pAC50 | = | 6.6 | Functional | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | ||
| 5487427 | 3824 | 12 | None | -1548 | 8 | Human | 6.6 | pAC50 | = | 6.6 | Functional | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | ||
| 8592 | 3824 | 12 | None | -1548 | 8 | Human | 6.6 | pAC50 | = | 6.6 | Functional | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1900528 | 3824 | 12 | None | -1548 | 8 | Human | 6.6 | pAC50 | = | 6.6 | Functional | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL3305968 | 3824 | 12 | None | -1548 | 8 | Human | 6.6 | pAC50 | = | 6.6 | Functional | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL4650755 | 3824 | 12 | None | -1548 | 8 | Human | 6.6 | pAC50 | = | 6.6 | Functional | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | ||
| DB01409 | 3824 | 12 | None | -1548 | 8 | Human | 6.6 | pAC50 | = | 6.6 | Functional | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | ||
| 168871 | 89130 | 14 | None | -1949 | 13 | Human | 4.6 | pAC50 | = | 4.6 | Functional | ChEMBL | 563 | 4 | 3 | 6 | 2.1 | CC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C[C@@H]4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL2365712 | 89130 | 14 | None | -1949 | 13 | Human | 4.6 | pAC50 | = | 4.6 | Functional | ChEMBL | 563 | 4 | 3 | 6 | 2.1 | CC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C[C@@H]4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 | 10.1038/s41467-023-40064-9 | ||
| 2771 | 195017 | 74 | None | -25 | 16 | Human | 5.6 | pAC50 | = | 5.6 | Functional | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1200781 | 195017 | 74 | None | -25 | 16 | Human | 5.6 | pAC50 | = | 5.6 | Functional | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL549 | 195017 | 74 | None | -25 | 16 | Human | 5.6 | pAC50 | = | 5.6 | Functional | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | ||
| 191 | 403 | 98 | None | -21 | 36 | Human | 6.5 | pAC50 | = | 6.5 | Functional | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | ||
| 201 | 403 | 98 | None | -21 | 36 | Human | 6.5 | pAC50 | = | 6.5 | Functional | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | ||
| 2170 | 403 | 98 | None | -21 | 36 | Human | 6.5 | pAC50 | = | 6.5 | Functional | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1113 | 403 | 98 | None | -21 | 36 | Human | 6.5 | pAC50 | = | 6.5 | Functional | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | ||
| DB00543 | 403 | 98 | None | -21 | 36 | Human | 6.5 | pAC50 | = | 6.5 | Functional | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | ||
| 1400 | 1957 | 70 | None | 1 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Functional | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 3658 | 1957 | 70 | None | 1 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Functional | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 7199 | 1957 | 70 | None | 1 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Functional | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 91513 | 1957 | 70 | None | 1 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Functional | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL896 | 1957 | 70 | None | 1 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Functional | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| DB00557 | 1957 | 70 | None | 1 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Functional | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 146570 | 43454 | 67 | None | 1 | 7 | Human | 5.3 | pAC50 | = | 5.3 | Functional | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1508 | 43454 | 67 | None | 1 | 7 | Human | 5.3 | pAC50 | = | 5.3 | Functional | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | ||
| 1210 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 1213 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 2725 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 33036 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 4411 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 616 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 6976 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 716121 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1201353 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1554789 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| CHEMBL505 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| DB01114 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| DB13679 | 918 | 51 | None | -2 | 22 | Human | 7.3 | pAC50 | = | 7.3 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | ||
| 100 | 3805 | 58 | None | -33 | 38 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | ||
| 2637 | 3805 | 58 | None | -33 | 38 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | ||
| 5452 | 3805 | 58 | None | -33 | 38 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL479 | 3805 | 58 | None | -33 | 38 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | ||
| DB00679 | 3805 | 58 | None | -33 | 38 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | ||
| 16351 | 102730 | 47 | None | -18 | 17 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL304902 | 102730 | 47 | None | -18 | 17 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | ||
| 213 | 3853 | 55 | None | -79 | 22 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | ||
| 2717 | 3853 | 55 | None | -79 | 22 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | ||
| 5533 | 3853 | 55 | None | -79 | 22 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL621 | 3853 | 55 | None | -79 | 22 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | ||
| DB00656 | 3853 | 55 | None | -79 | 22 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | ||
| 4640 | 78266 | 30 | None | -9 | 11 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 379 | 6 | 1 | 4 | 3.9 | COc1cc2[nH]c(C)c(CCN3CCN(c4ccccc4)CC3)c2cc1OC | 10.1038/s41467-023-40064-9 | ||
| CHEMBL2107011 | 78266 | 30 | None | -9 | 11 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 379 | 6 | 1 | 4 | 3.9 | COc1cc2[nH]c(C)c(CCN3CCN(c4ccccc4)CC3)c2cc1OC | 10.1038/s41467-023-40064-9 | ||
| 19861 | 207523 | 50 | None | 3 | 10 | Human | 7.2 | pAC50 | = | 7.2 | Functional | ChEMBL | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL946 | 207523 | 50 | None | 3 | 10 | Human | 7.2 | pAC50 | = | 7.2 | Functional | ChEMBL | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1038/s41467-023-40064-9 | ||
| 2220 | 3134 | 82 | None | -6 | 17 | Human | 7.2 | pAC50 | = | 7.2 | Functional | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | ||
| 27400 | 3134 | 82 | None | -6 | 17 | Human | 7.2 | pAC50 | = | 7.2 | Functional | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | ||
| 93 | 3134 | 82 | None | -6 | 17 | Human | 7.2 | pAC50 | = | 7.2 | Functional | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL294951 | 3134 | 82 | None | -6 | 17 | Human | 7.2 | pAC50 | = | 7.2 | Functional | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | ||
| DB06153 | 3134 | 82 | None | -6 | 17 | Human | 7.2 | pAC50 | = | 7.2 | Functional | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | ||
| 1385580 | 29276 | 76 | None | -18 | 19 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | ||
| 4615 | 29276 | 76 | None | -18 | 19 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL13828 | 29276 | 76 | None | -18 | 19 | Human | 6.2 | pAC50 | = | 6.2 | Functional | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | ||
| 2470 | 3653 | 50 | None | -38018 | 23 | Human | 5.2 | pAC50 | = | 5.2 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 3300 | 3653 | 50 | None | -38018 | 23 | Human | 5.2 | pAC50 | = | 5.2 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 5265 | 3653 | 50 | None | -38018 | 23 | Human | 5.2 | pAC50 | = | 5.2 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 99 | 3653 | 50 | None | -38018 | 23 | Human | 5.2 | pAC50 | = | 5.2 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL267930 | 3653 | 50 | None | -38018 | 23 | Human | 5.2 | pAC50 | = | 5.2 | Functional | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | ||
| 2601 | 3780 | 33 | None | -1288 | 17 | Human | 5.1 | pAC50 | = | 5.1 | Functional | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | ||
| 443951 | 3780 | 33 | None | -1288 | 17 | Human | 5.1 | pAC50 | = | 5.1 | Functional | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | ||
| 56 | 3780 | 33 | None | -1288 | 17 | Human | 5.1 | pAC50 | = | 5.1 | Functional | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | ||
| CHEMBL73151 | 3780 | 33 | None | -1288 | 17 | Human | 5.1 | pAC50 | = | 5.1 | Functional | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | ||
| DB13399 | 3780 | 33 | None | -1288 | 17 | Human | 5.1 | pAC50 | = | 5.1 | Functional | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | ||
| 2218 | 15283 | 23 | None | -3 | 12 | Human | 5.1 | pAC50 | = | 5.1 | Functional | ChEMBL | 322 | 8 | 0 | 2 | 4.4 | CCN(CC)CCCN(c1ccccc1)C1Cc2ccccc2C1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL1213033 | 15283 | 23 | None | -3 | 12 | Human | 5.1 | pAC50 | = | 5.1 | Functional | ChEMBL | 322 | 8 | 0 | 2 | 4.4 | CCN(CC)CCCN(c1ccccc1)C1Cc2ccccc2C1 | 10.1038/s41467-023-40064-9 | ||
| 21722 | 17992 | 31 | None | -1 | 21 | Human | 6.1 | pAC50 | = | 6.1 | Functional | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL126224 | 17992 | 31 | None | -1 | 21 | Human | 6.1 | pAC50 | = | 6.1 | Functional | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | ||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | ||
| 249 | 505 | 81 | None | -4 | 42 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | ||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | ||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 6.0 | pAC50 | = | 6.0 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | ||
| 2333 | 142335 | 97 | None | -7 | 14 | Human | 5.0 | pAC50 | = | 5.0 | Functional | ChEMBL | 422 | 3 | 1 | 3 | 5.5 | CCc1oc2ccccc2c1C(=O)c1cc(Br)c(O)c(Br)c1 | 10.1038/s41467-023-40064-9 | ||
| CHEMBL388590 | 142335 | 97 | None | -7 | 14 | Human | 5.0 | pAC50 | = | 5.0 | Functional | ChEMBL | 422 | 3 | 1 | 3 | 5.5 | CCc1oc2ccccc2c1C(=O)c1cc(Br)c(O)c(Br)c1 | 10.1038/s41467-023-40064-9 | ||
| 10042467 | 1426 | 1 | None | -1 | 2 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | -1 | 2 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | -1 | 2 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 10689833 | 12766 | 0 | None | -4 | 2 | Rat | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 359 | 8 | 1 | 2 | 4.8 | c1ccc(C(CCc2nc(CCN3CCCC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL11879 | 12766 | 0 | None | -4 | 2 | Rat | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 359 | 8 | 1 | 2 | 4.8 | c1ccc(C(CCc2nc(CCN3CCCC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 11791817 | 98303 | 0 | None | -1 | 2 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL274831 | 98303 | 0 | None | -1 | 2 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 10403687 | 2511 | 3 | None | -1 | 2 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | -1 | 2 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | -1 | 2 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1269 | 121 | 41 | None | -354 | 6 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 125 | 2 | 2 | 2 | 0.2 | Cc1c(CCN)nc[nH]1 | 10.1021/jm900526h | ||
| 37463 | 121 | 41 | None | -354 | 6 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 125 | 2 | 2 | 2 | 0.2 | Cc1c(CCN)nc[nH]1 | 10.1021/jm900526h | ||
| CHEMBL275443 | 121 | 41 | None | -354 | 6 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 125 | 2 | 2 | 2 | 0.2 | Cc1c(CCN)nc[nH]1 | 10.1021/jm900526h | ||
| 126688 | 404 | 33 | None | -57 | 2 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 157 | 2 | 2 | 4 | 0.5 | NCCc1sc(nc1C)N | 10.1016/j.bmcl.2010.10.041 | ||
| 4025 | 404 | 33 | None | -57 | 2 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 157 | 2 | 2 | 4 | 0.5 | NCCc1sc(nc1C)N | 10.1016/j.bmcl.2010.10.041 | ||
| CHEMBL293762 | 404 | 33 | None | -57 | 2 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 157 | 2 | 2 | 4 | 0.5 | NCCc1sc(nc1C)N | 10.1016/j.bmcl.2010.10.041 | ||
| 11617365 | 74275 | 0 | None | - | 1 | Guinea pig | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 319 | 7 | 2 | 3 | 3.3 | NCCc1c[nH]c(C(=O)CC(c2ccccc2)c2ccccc2)n1 | 10.1016/j.bmcl.2005.10.030 | ||
| CHEMBL202371 | 74275 | 0 | None | - | 1 | Guinea pig | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 319 | 7 | 2 | 3 | 3.3 | NCCc1c[nH]c(C(=O)CC(c2ccccc2)c2ccccc2)n1 | 10.1016/j.bmcl.2005.10.030 | ||
| 10042467 | 1426 | 1 | None | 1 | 2 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | 1 | 2 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | 1 | 2 | Rat | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 10447834 | 1933 | 4 | None | 2 | 3 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | 2 | 3 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | 2 | 3 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1204 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm900526h | ||
| 1247 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm900526h | ||
| 1375 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm900526h | ||
| 774 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm900526h | ||
| CHEMBL90 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm900526h | ||
| DB05381 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm900526h | ||
| 10447834 | 1933 | 4 | None | 2 | 3 | Guinea pig | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | 2 | 3 | Guinea pig | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | 2 | 3 | Guinea pig | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2005.10.030 | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2005.10.030 | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2005.10.030 | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2005.10.030 | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2005.10.030 | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2005.10.030 | ||
| 1194 | 45 | 3 | None | 50 | 2 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/j.bmcl.2010.10.041 | ||
| 23786499 | 45 | 3 | None | 50 | 2 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/j.bmcl.2010.10.041 | ||
| CHEMBL26116 | 45 | 3 | None | 50 | 2 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/j.bmcl.2010.10.041 | ||
| 1204 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| 1247 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| 1375 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| 774 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| CHEMBL90 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| DB05381 | 1932 | 119 | None | -4 | 10 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| 11791817 | 98303 | 0 | None | -1 | 2 | Guinea pig | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL274831 | 98303 | 0 | None | -1 | 2 | Guinea pig | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 5310982 | 93612 | 4 | None | 3 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2010.10.041 | ||
| CHEMBL24665 | 93612 | 4 | None | 3 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2010.10.041 | ||
| 44267376 | 10221 | 1 | None | - | 1 | Guinea pig | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 277 | 5 | 2 | 2 | 3.1 | NCCc1c[nH]c(C(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL11603 | 10221 | 1 | None | - | 1 | Guinea pig | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 277 | 5 | 2 | 2 | 3.1 | NCCc1c[nH]c(C(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 10689833 | 12766 | 0 | None | 4 | 2 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 359 | 8 | 1 | 2 | 4.8 | c1ccc(C(CCc2nc(CCN3CCCC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL11879 | 12766 | 0 | None | 4 | 2 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 359 | 8 | 1 | 2 | 4.8 | c1ccc(C(CCc2nc(CCN3CCCC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 10688111 | 10040 | 1 | None | 2 | 2 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.3 | CCNCCc1c[nH]c(CCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL11515 | 10040 | 1 | None | 2 | 2 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.3 | CCNCCc1c[nH]c(CCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 10447834 | 1933 | 4 | None | 2 | 3 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | 2 | 3 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | 2 | 3 | Guinea pig | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 11791817 | 98303 | 0 | None | 1 | 2 | Rat | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL274831 | 98303 | 0 | None | 1 | 2 | Rat | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 10685002 | 10160 | 0 | None | - | 1 | Guinea pig | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 291 | 6 | 2 | 2 | 3.3 | NCCc1c[nH]c(CC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL11584 | 10160 | 0 | None | - | 1 | Guinea pig | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 291 | 6 | 2 | 2 | 3.3 | NCCc1c[nH]c(CC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 1204 | 1932 | 119 | None | -4 | 10 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0603318 | ||
| 1247 | 1932 | 119 | None | -4 | 10 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0603318 | ||
| 1375 | 1932 | 119 | None | -4 | 10 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0603318 | ||
| 774 | 1932 | 119 | None | -4 | 10 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0603318 | ||
| CHEMBL90 | 1932 | 119 | None | -4 | 10 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0603318 | ||
| DB05381 | 1932 | 119 | None | -4 | 10 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0603318 | ||
| 10403687 | 2511 | 3 | None | 1 | 2 | Guinea pig | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | 1 | 2 | Guinea pig | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | 1 | 2 | Guinea pig | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 10403687 | 2511 | 3 | None | 1 | 2 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | 1 | 2 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | 1 | 2 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 11846300 | 80266 | 3 | None | 2 | 2 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1021/jm051008s | ||
| CHEMBL213912 | 80266 | 3 | None | 2 | 2 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1021/jm051008s | ||
| 10688111 | 10040 | 1 | None | -2 | 2 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.3 | CCNCCc1c[nH]c(CCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL11515 | 10040 | 1 | None | -2 | 2 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.3 | CCNCCc1c[nH]c(CCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 10403687 | 2511 | 3 | None | 1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | 1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | 1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 91613 | 17987 | 34 | None | 5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 125 | 2 | 2 | 2 | 0.2 | Cc1ncc(CCN)[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| CHEMBL12620 | 17987 | 34 | None | 5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 125 | 2 | 2 | 2 | 0.2 | Cc1ncc(CCN)[nH]1 | 10.1016/j.bmcl.2010.10.041 | ||
| 10042467 | 1426 | 1 | None | -1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | -1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | -1 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 10042467 | 1426 | 1 | None | -1 | 2 | Guinea pig | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | -1 | 2 | Guinea pig | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | -1 | 2 | Guinea pig | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 10447834 | 1933 | 4 | None | -2 | 3 | Rat | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | -2 | 3 | Rat | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | -2 | 3 | Rat | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 11976 | 920 | 59 | None | -9 | 16 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| 667467 | 920 | 59 | None | -9 | 16 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| CHEMBL908 | 920 | 59 | None | -9 | 16 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| DB01239 | 920 | 59 | None | -9 | 16 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| 13623342 | 64347 | 0 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 286 | 5 | 0 | 5 | 1.9 | C=COCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL18123 | 64347 | 0 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 286 | 5 | 0 | 5 | 1.9 | C=COCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 3071006 | 65015 | 1 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 314 | 6 | 0 | 5 | 2.4 | C=CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL18233 | 65015 | 1 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 314 | 6 | 0 | 5 | 2.4 | C=CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 13623366 | 66714 | 0 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 330 | 7 | 0 | 5 | 3.0 | CCCCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL18561 | 66714 | 0 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 330 | 7 | 0 | 5 | 3.0 | CCCCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 3071004 | 167760 | 5 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 288 | 5 | 0 | 5 | 1.8 | CCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL430338 | 167760 | 5 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 288 | 5 | 0 | 5 | 1.8 | CCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 1227 | 2489 | 43 | None | 2 | 14 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 2331 | 2489 | 43 | None | 2 | 14 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 3957 | 2489 | 43 | None | 2 | 14 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 4992 | 2489 | 43 | None | 2 | 14 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| CHEMBL511 | 2489 | 43 | None | 2 | 14 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| DB06691 | 2489 | 43 | None | 2 | 14 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 44458944 | 99060 | 0 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 337 | 3 | 0 | 1 | 5.5 | c1ccc(CN2CCC3C(=C(c4ccccc4)c4ccccc43)C2)cc1 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL280432 | 99060 | 0 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 337 | 3 | 0 | 1 | 5.5 | c1ccc(CN2CCC3C(=C(c4ccccc4)c4ccccc43)C2)cc1 | 10.1016/s0960-894x(00)00199-2 | ||
| 44224259 | 62723 | 5 | None | 30 | 2 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783959 | 62723 | 5 | None | 30 | 2 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 3529324 | 208354 | 1 | None | - | 1 | Guinea pig | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 306 | 6 | 0 | 3 | 3.3 | CC(C)c1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202934 | 208354 | 1 | None | - | 1 | Guinea pig | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 306 | 6 | 0 | 3 | 3.3 | CC(C)c1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL99417 | 208354 | 1 | None | - | 1 | Guinea pig | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 306 | 6 | 0 | 3 | 3.3 | CC(C)c1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| 44126329 | 62718 | 6 | None | -2 | 2 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783954 | 62718 | 6 | None | -2 | 2 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 153996 | 112668 | 2 | None | -57 | 6 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL330366 | 112668 | 2 | None | -57 | 6 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL539021 | 112668 | 2 | None | -57 | 6 | Human | 5.0 | pIC50 | = | 5 | Functional | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 44126270 | 199151 | 6 | None | 10 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 320 | 4 | 0 | 3 | 3.9 | COc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589389 | 199151 | 6 | None | 10 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 320 | 4 | 0 | 3 | 3.9 | COc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 3071008 | 98749 | 2 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 274 | 5 | 1 | 5 | 1.5 | CCOCCn1c(N2CCNCC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL278053 | 98749 | 2 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 274 | 5 | 1 | 5 | 1.5 | CCOCCn1c(N2CCNCC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 54585846 | 62727 | 5 | None | 38 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 3.7 | Cc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cn1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783963 | 62727 | 5 | None | 38 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 3.7 | Cc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cn1 | 10.1016/j.bmcl.2009.04.128 | ||
| 44126269 | 201484 | 5 | None | 2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 318 | 3 | 0 | 2 | 4.5 | Cc1ccc(CCn2c3c(c4cc(C)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL605081 | 201484 | 5 | None | 2 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 318 | 3 | 0 | 2 | 4.5 | Cc1ccc(CCn2c3c(c4cc(C)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| 1210 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 1213 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 2725 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 33036 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 4411 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 616 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 6976 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 716121 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| CHEMBL1201353 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| CHEMBL1554789 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| CHEMBL505 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| DB01114 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| DB13679 | 918 | 51 | None | 2 | 22 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00157a010 | ||
| 3071000 | 98656 | 1 | None | - | 1 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 298 | 5 | 0 | 5 | 1.4 | C#CCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL277311 | 98656 | 1 | None | - | 1 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 298 | 5 | 0 | 5 | 1.4 | C#CCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 54582939 | 62721 | 6 | None | 8 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 369 | 3 | 0 | 3 | 4.0 | CN1CCc2c(c3cc(Br)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783957 | 62721 | 6 | None | 8 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 369 | 3 | 0 | 3 | 4.0 | CN1CCc2c(c3cc(Br)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54579957 | 62728 | 5 | None | 36 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783964 | 62728 | 5 | None | 36 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54580942 | 62731 | 9 | None | 13 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783967 | 62731 | 9 | None | 13 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 4440380 | 4255 | 3 | None | - | 1 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL100487 | 4255 | 3 | None | - | 1 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202938 | 4255 | 3 | None | - | 1 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| 10234086 | 111634 | 0 | None | -6 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL328511 | 111634 | 0 | None | -6 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10097-X | ||
| 10190770 | 208015 | 0 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL330430 | 208015 | 0 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL97357 | 208015 | 0 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 54585848 | 62734 | 6 | None | 5 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 316 | 3 | 0 | 4 | 3.1 | CN1CCc2c(c3cc(C#N)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783971 | 62734 | 6 | None | 5 | 2 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 316 | 3 | 0 | 4 | 3.1 | CN1CCc2c(c3cc(C#N)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 13623354 | 98980 | 0 | None | - | 1 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 4 | 0 | 5 | 1.4 | COCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL279872 | 98980 | 0 | None | - | 1 | Guinea pig | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 274 | 4 | 0 | 5 | 1.4 | COCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 46225000 | 199115 | 5 | None | 9 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 308 | 3 | 0 | 2 | 4.0 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589148 | 199115 | 5 | None | 9 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 308 | 3 | 0 | 2 | 4.0 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 13623347 | 61054 | 0 | None | - | 1 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 286 | 4 | 0 | 4 | 3.1 | CCCC(C)n1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17635 | 61054 | 0 | None | - | 1 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 286 | 4 | 0 | 4 | 3.1 | CCCC(C)n1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 13623346 | 98945 | 0 | None | - | 1 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 286 | 4 | 0 | 4 | 2.8 | CC(C)CCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL279621 | 98945 | 0 | None | - | 1 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 286 | 4 | 0 | 4 | 2.8 | CC(C)CCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 42631003 | 199618 | 13 | None | 2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 304 | 3 | 0 | 2 | 4.2 | Cc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL592752 | 199618 | 13 | None | 2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 304 | 3 | 0 | 2 | 4.2 | Cc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 13623371 | 65205 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 378 | 7 | 0 | 5 | 3.8 | CCOCCn1c(N2CCCN(Cc3ccccc3)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL18255 | 65205 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 378 | 7 | 0 | 5 | 3.8 | CCOCCn1c(N2CCCN(Cc3ccccc3)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 13623360 | 98808 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 330 | 8 | 0 | 5 | 3.0 | CCCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL278504 | 98808 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 330 | 8 | 0 | 5 | 3.0 | CCCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| 13623338 | 63348 | 0 | None | - | 1 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 314 | 7 | 0 | 4 | 3.8 | CCCCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17946 | 63348 | 0 | None | - | 1 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 314 | 7 | 0 | 4 | 3.8 | CCCCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 46224879 | 201547 | 3 | None | -1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 302 | 2 | 0 | 2 | 4.6 | Cc1ccc2c(c1)c1c(n2/C=C\c2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL605405 | 201547 | 3 | None | -1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 302 | 2 | 0 | 2 | 4.6 | Cc1ccc2c(c1)c1c(n2/C=C\c2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 9832306 | 112724 | 0 | None | 2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL330367 | 112724 | 0 | None | 2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL330462 | 112724 | 0 | None | 2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10097-X | ||
| 197033 | 199152 | 64 | None | 1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589390 | 199152 | 64 | None | 1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 1227 | 2489 | 43 | None | 2 | 14 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 2331 | 2489 | 43 | None | 2 | 14 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 3957 | 2489 | 43 | None | 2 | 14 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 4992 | 2489 | 43 | None | 2 | 14 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| CHEMBL511 | 2489 | 43 | None | 2 | 14 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| DB06691 | 2489 | 43 | None | 2 | 14 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1038/nchembio714 | ||
| 197033 | 199152 | 64 | None | 1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589390 | 199152 | 64 | None | 1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 197033 | 199152 | 64 | None | 1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL589390 | 199152 | 64 | None | 1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54582940 | 62722 | 5 | None | 1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 359 | 3 | 0 | 3 | 4.3 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783958 | 62722 | 5 | None | 1 | 2 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 359 | 3 | 0 | 3 | 4.3 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 13623367 | 60379 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 316 | 6 | 0 | 5 | 2.6 | CCOCCn1c(N2CCCN(CC)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17474 | 60379 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 316 | 6 | 0 | 5 | 2.6 | CCOCCn1c(N2CCCN(CC)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 13623359 | 64562 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 316 | 7 | 0 | 5 | 2.6 | CCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL18151 | 64562 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 316 | 7 | 0 | 5 | 2.6 | CCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| 3071032 | 65039 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 316 | 6 | 0 | 5 | 2.6 | CCCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL18234 | 65039 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 316 | 6 | 0 | 5 | 2.6 | CCCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 621659 | 62729 | 10 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783965 | 62729 | 10 | None | -2 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 197033 | 199152 | 64 | None | 1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL589390 | 199152 | 64 | None | 1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 319 | 3 | 0 | 3 | 3.9 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 44458903 | 90646 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 275 | 2 | 0 | 1 | 4.3 | CCN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL23897 | 90646 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 275 | 2 | 0 | 1 | 4.3 | CCN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1016/s0960-894x(00)00199-2 | ||
| 2773189 | 59739 | 3 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 306 | 3 | 0 | 4 | 2.8 | CN1CCN(c2nc3ccccc3n2Cc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL17246 | 59739 | 3 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 306 | 3 | 0 | 4 | 2.8 | CN1CCN(c2nc3ccccc3n2Cc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| 3071002 | 63017 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 300 | 6 | 0 | 5 | 2.0 | C=CCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17876 | 63017 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 300 | 6 | 0 | 5 | 2.0 | C=CCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 145990794 | 166800 | 0 | None | -28 | 6 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 437 | 6 | 0 | 5 | 3.8 | O=C1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C(=O)N1CCCCN1CCN(c2cccc3sccc23)CC1 | 10.1016/j.ejmech.2017.12.099 | ||
| CHEMBL4284346 | 166800 | 0 | None | -28 | 6 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 437 | 6 | 0 | 5 | 3.8 | O=C1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C(=O)N1CCCCN1CCN(c2cccc3sccc23)CC1 | 10.1016/j.ejmech.2017.12.099 | ||
| 4919 | 206234 | 23 | None | -263 | 5 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1021/jm300671m | ||
| CHEMBL86715 | 206234 | 23 | None | -263 | 5 | Human | 4.8 | pIC50 | = | 4.8 | Functional | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1021/jm300671m | ||
| 13623352 | 60006 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 288 | 5 | 0 | 5 | 2.2 | CCCOCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17349 | 60006 | 0 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 288 | 5 | 0 | 5 | 2.2 | CCCOCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 3071010 | 63919 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 302 | 6 | 0 | 5 | 2.2 | CCOCCn1c(N2CCN(CC)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL18060 | 63919 | 1 | None | - | 1 | Guinea pig | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 302 | 6 | 0 | 5 | 2.2 | CCOCCn1c(N2CCN(CC)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 46224877 | 200701 | 5 | None | 74 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 288 | 2 | 0 | 2 | 4.3 | CN1CCc2c(c3ccccc3n2/C=C\c2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL599913 | 200701 | 5 | None | 74 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 288 | 2 | 0 | 2 | 4.3 | CN1CCc2c(c3ccccc3n2/C=C\c2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 54586812 | 62717 | 5 | None | 12 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783953 | 62717 | 5 | None | 12 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 13623336 | 60496 | 0 | None | - | 1 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 286 | 5 | 0 | 4 | 3.0 | CCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17555 | 60496 | 0 | None | - | 1 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 286 | 5 | 0 | 4 | 3.0 | CCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 13623350 | 63112 | 0 | None | - | 1 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 304 | 5 | 0 | 5 | 2.5 | CCSCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17893 | 63112 | 0 | None | - | 1 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 304 | 5 | 0 | 5 | 2.5 | CCSCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 145983928 | 166412 | 0 | None | -53 | 6 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 435 | 6 | 0 | 5 | 3.6 | O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCCCN1CCN(c2cccc3sccc23)CC1 | 10.1016/j.ejmech.2017.12.099 | ||
| CHEMBL4277101 | 166412 | 0 | None | -53 | 6 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 435 | 6 | 0 | 5 | 3.6 | O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCCCN1CCN(c2cccc3sccc23)CC1 | 10.1016/j.ejmech.2017.12.099 | ||
| 3071014 | 98085 | 1 | None | - | 1 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 302 | 6 | 0 | 5 | 2.2 | CCCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL273320 | 98085 | 1 | None | - | 1 | Guinea pig | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 302 | 6 | 0 | 5 | 2.2 | CCCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 126624 | 208290 | 10 | None | - | 1 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 264 | 5 | 0 | 3 | 2.2 | CN(C)CCCN1C(=O)CSC1c1ccccc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202936 | 208290 | 10 | None | - | 1 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 264 | 5 | 0 | 3 | 2.2 | CN(C)CCCN1C(=O)CSC1c1ccccc1 | 10.1021/jm00093a025 | ||
| CHEMBL98989 | 208290 | 10 | None | - | 1 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 264 | 5 | 0 | 3 | 2.2 | CN(C)CCCN1C(=O)CSC1c1ccccc1 | 10.1021/jm00093a025 | ||
| 10123138 | 108526 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL317524 | 108526 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL320002 | 108526 | 0 | None | -1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 2861271 | 4254 | 9 | None | - | 1 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1ccc(Cl)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL100486 | 4254 | 9 | None | - | 1 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1ccc(Cl)cc1 | 10.1021/jm00093a025 | ||
| 46224878 | 199469 | 0 | None | 2 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 290 | 2 | 0 | 2 | 4.0 | CN1CCC2C(C1)c1ccccc1N2/C=C/c1ccccc1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL591568 | 199469 | 0 | None | 2 | 2 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 290 | 2 | 0 | 2 | 4.0 | CN1CCC2C(C1)c1ccccc1N2/C=C/c1ccccc1 | 10.1016/j.bmcl.2009.11.037 | ||
| 54585847 | 62732 | 6 | None | 29 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 359 | 3 | 0 | 3 | 4.3 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783968 | 62732 | 6 | None | 29 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 359 | 3 | 0 | 3 | 4.3 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 198539 | 99231 | 3 | None | - | 1 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 259 | 1 | 0 | 1 | 3.8 | CN1CC=C2C(=C(c3ccccc3)c3ccccc32)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL281638 | 99231 | 3 | None | - | 1 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 259 | 1 | 0 | 1 | 3.8 | CN1CC=C2C(=C(c3ccccc3)c3ccccc32)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| 2860026 | 108376 | 7 | None | - | 1 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1cccc(Cl)c1 | 10.1021/jm00093a025 | ||
| CHEMBL319829 | 108376 | 7 | None | - | 1 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1cccc(Cl)c1 | 10.1021/jm00093a025 | ||
| 7430452 | 99478 | 2 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 309 | 4 | 1 | 3 | 3.1 | CCN1CC[C@@](O)(c2ccccc2)[C@H](C(=O)c2ccccc2)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL283169 | 99478 | 2 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 309 | 4 | 1 | 3 | 3.1 | CCN1CC[C@@](O)(c2ccccc2)[C@H](C(=O)c2ccccc2)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| 2861590 | 107260 | 7 | None | - | 1 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1ccc(Br)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202937 | 107260 | 7 | None | - | 1 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1ccc(Br)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL316951 | 107260 | 7 | None | - | 1 | Guinea pig | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1ccc(Br)cc1 | 10.1021/jm00093a025 | ||
| 10212223 | 208140 | 0 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL431458 | 208140 | 0 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL98079 | 208140 | 0 | None | -2 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 10190056 | 111438 | 0 | None | 1 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL327497 | 111438 | 0 | None | 1 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
| 13623341 | 62120 | 0 | None | - | 1 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 320 | 4 | 0 | 4 | 3.0 | CN1CCN(c2nc3ccccc3n2CCc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL17763 | 62120 | 0 | None | - | 1 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 320 | 4 | 0 | 4 | 3.0 | CN1CCN(c2nc3ccccc3n2CCc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| 2872050 | 208226 | 3 | None | - | 1 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1ccc(F)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202939 | 208226 | 3 | None | - | 1 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1ccc(F)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL98605 | 208226 | 3 | None | - | 1 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1ccc(F)cc1 | 10.1021/jm00093a025 | ||
| 2284 | 3182 | 33 | None | -3 | 34 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | ||
| 4926 | 3182 | 33 | None | -3 | 34 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | ||
| 7281 | 3182 | 33 | None | -3 | 34 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | ||
| CHEMBL564 | 3182 | 33 | None | -3 | 34 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | ||
| DB00420 | 3182 | 33 | None | -3 | 34 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | ||
| 9984168 | 98289 | 9 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 288 | 5 | 1 | 5 | 1.9 | CCOCCn1c(N2CCCNCC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL274747 | 98289 | 9 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 288 | 5 | 1 | 5 | 1.9 | CCOCCn1c(N2CCCNCC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 14984033 | 208178 | 1 | None | - | 1 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202941 | 208178 | 1 | None | - | 1 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL98334 | 208178 | 1 | None | - | 1 | Guinea pig | 4.6 | pIC50 | = | 4.6 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| 145993117 | 166921 | 0 | None | -204 | 6 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 427 | 7 | 0 | 5 | 4.4 | CCC1(C)CC(=O)N(CCCCN2CCN(c3cccc4sccc34)CC2)C(=O)C1 | 10.1016/j.ejmech.2017.12.099 | ||
| CHEMBL4286717 | 166921 | 0 | None | -204 | 6 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 427 | 7 | 0 | 5 | 4.4 | CCC1(C)CC(=O)N(CCCCN2CCN(c3cccc4sccc34)CC2)C(=O)C1 | 10.1016/j.ejmech.2017.12.099 | ||
| 708981 | 88792 | 2 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 295 | 3 | 1 | 3 | 2.7 | CN1CC[C@@](O)(c2ccccc2)[C@H](C(=O)c2ccccc2)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL23638 | 88792 | 2 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 295 | 3 | 1 | 3 | 2.7 | CN1CC[C@@](O)(c2ccccc2)[C@H](C(=O)c2ccccc2)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| 13623337 | 98802 | 0 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 300 | 6 | 0 | 4 | 3.4 | CCCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL278457 | 98802 | 0 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 300 | 6 | 0 | 4 | 3.4 | CCCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 15585276 | 61966 | 0 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 364 | 7 | 0 | 5 | 3.4 | CCOCCn1c(N2CCN(Cc3ccccc3)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17742 | 61966 | 0 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 364 | 7 | 0 | 5 | 3.4 | CCOCCn1c(N2CCN(Cc3ccccc3)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 54582000 | 62736 | 5 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 388 | 4 | 0 | 4 | 4.0 | Cc1ccc2c(c1)c1c(n2CCc2cccnc2)CCN(C2CCN(C)CC2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783974 | 62736 | 5 | None | - | 1 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 388 | 4 | 0 | 4 | 4.0 | Cc1ccc2c(c1)c1c(n2CCc2cccnc2)CCN(C2CCN(C)CC2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 162910 | 84621 | 6 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2C(=C(c3ccccc3)c3ccccc32)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL22215 | 84621 | 6 | None | - | 1 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2C(=C(c3ccccc3)c3ccccc32)C1 | 10.1016/s0960-894x(00)00199-2 | ||
| 15542879 | 112824 | 0 | None | -2 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL330719 | 112824 | 0 | None | -2 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 13623357 | 63379 | 0 | None | - | 1 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 287 | 5 | 1 | 5 | 1.4 | CCNCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17959 | 63379 | 0 | None | - | 1 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 287 | 5 | 1 | 5 | 1.4 | CCNCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 10168749 | 207621 | 0 | None | -3 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL95127 | 207621 | 0 | None | -3 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 1227 | 2489 | 43 | None | 2 | 14 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | ||
| 2331 | 2489 | 43 | None | 2 | 14 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | ||
| 3957 | 2489 | 43 | None | 2 | 14 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | ||
| 4992 | 2489 | 43 | None | 2 | 14 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | ||
| CHEMBL511 | 2489 | 43 | None | 2 | 14 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | ||
| DB06691 | 2489 | 43 | None | 2 | 14 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | ||
| 44126326 | 199619 | 7 | None | 32 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 322 | 3 | 0 | 2 | 4.3 | Cc1ccc2c(c1)c1c(n2CCc2ccc(F)cc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL592753 | 199619 | 7 | None | 32 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 322 | 3 | 0 | 2 | 4.3 | Cc1ccc2c(c1)c1c(n2CCc2ccc(F)cc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 13623361 | 64645 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 344 | 9 | 0 | 5 | 3.4 | CCCCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL18181 | 64645 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 344 | 9 | 0 | 5 | 3.4 | CCCCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| 145993493 | 167357 | 0 | None | -38 | 6 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 439 | 6 | 0 | 5 | 4.5 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2cccc3sccc23)CC1 | 10.1016/j.ejmech.2017.12.099 | ||
| CHEMBL4294617 | 167357 | 0 | None | -38 | 6 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 439 | 6 | 0 | 5 | 4.5 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2cccc3sccc23)CC1 | 10.1016/j.ejmech.2017.12.099 | ||
| 9918576 | 207337 | 0 | None | -2 | 3 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL93556 | 207337 | 0 | None | -2 | 3 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10097-X | ||
| 44126328 | 201105 | 5 | None | 74 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 322 | 3 | 0 | 2 | 4.3 | Cc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL603049 | 201105 | 5 | None | 74 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 322 | 3 | 0 | 2 | 4.3 | Cc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| 13623363 | 99036 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 378 | 8 | 0 | 5 | 3.4 | CCOCCn1c(N2CCN(CCc3ccccc3)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL280255 | 99036 | 0 | None | - | 1 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 378 | 8 | 0 | 5 | 3.4 | CCOCCn1c(N2CCN(CCc3ccccc3)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 14984031 | 208373 | 1 | None | - | 1 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1cccc(F)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202933 | 208373 | 1 | None | - | 1 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1cccc(F)c1 | 10.1021/jm00093a025 | ||
| CHEMBL99529 | 208373 | 1 | None | - | 1 | Guinea pig | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1cccc(F)c1 | 10.1021/jm00093a025 | ||
| 44126330 | 62724 | 5 | None | -2 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2cccnc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783960 | 62724 | 5 | None | -2 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2cccnc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 46225027 | 199117 | 5 | None | 74 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 338 | 4 | 0 | 3 | 4.0 | COc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589150 | 199117 | 5 | None | 74 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 338 | 4 | 0 | 3 | 4.0 | COc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| 54583938 | 62733 | 0 | None | 1 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 306 | 3 | 0 | 4 | 3.0 | Cc1ccc2c(c1)c1c(n2CCc2cnccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783970 | 62733 | 0 | None | 1 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 306 | 3 | 0 | 4 | 3.0 | Cc1ccc2c(c1)c1c(n2CCc2cnccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 2773179 | 98717 | 5 | None | - | 1 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 230 | 1 | 0 | 4 | 1.3 | CN1CCN(c2nc3ccccc3n2C)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL277749 | 98717 | 5 | None | - | 1 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 230 | 1 | 0 | 4 | 1.3 | CN1CCN(c2nc3ccccc3n2C)CC1 | 10.1021/jm00157a010 | ||
| 46224877 | 200701 | 5 | None | 74 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 288 | 2 | 0 | 2 | 4.3 | CN1CCc2c(c3ccccc3n2/C=C\c2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL599913 | 200701 | 5 | None | 74 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 288 | 2 | 0 | 2 | 4.3 | CN1CCc2c(c3ccccc3n2/C=C\c2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(00)00199-2 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(00)00199-2 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(00)00199-2 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(00)00199-2 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(00)00199-2 | ||
| 10123040 | 161095 | 0 | None | -7 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL411691 | 161095 | 0 | None | -7 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL537027 | 161095 | 0 | None | -7 | 2 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 46224878 | 199469 | 0 | None | 2 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 290 | 2 | 0 | 2 | 4.0 | CN1CCC2C(C1)c1ccccc1N2/C=C/c1ccccc1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL591568 | 199469 | 0 | None | 2 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 290 | 2 | 0 | 2 | 4.0 | CN1CCC2C(C1)c1ccccc1N2/C=C/c1ccccc1 | 10.1016/j.bmcl.2009.11.037 | ||
| 46225002 | 199494 | 5 | None | 602 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 376 | 3 | 0 | 2 | 5.0 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccc(C(F)(F)F)cc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL591803 | 199494 | 5 | None | 602 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 376 | 3 | 0 | 2 | 5.0 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccc(C(F)(F)F)cc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 11291 | 98796 | 25 | None | 223 | 3 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL278398 | 98796 | 25 | None | 223 | 3 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1016/s0960-894x(00)00199-2 | ||
| 10233656 | 207851 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL96442 | 207851 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 13623343 | 98501 | 0 | None | - | 1 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 316 | 7 | 0 | 5 | 2.6 | CCCCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL276070 | 98501 | 0 | None | - | 1 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 316 | 7 | 0 | 5 | 2.6 | CCCCOCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 13623334 | 63923 | 0 | None | - | 1 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 258 | 3 | 0 | 4 | 2.2 | CCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL18062 | 63923 | 0 | None | - | 1 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 258 | 3 | 0 | 4 | 2.2 | CCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 10122529 | 109556 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL322194 | 109556 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
| 54581997 | 62730 | 6 | None | 11 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 321 | 4 | 0 | 4 | 3.3 | COc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783966 | 62730 | 6 | None | 11 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 321 | 4 | 0 | 4 | 3.3 | COc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 621659 | 62729 | 10 | None | -2 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783965 | 62729 | 10 | None | -2 | 2 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 10123040 | 161095 | 0 | None | -7 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL411691 | 161095 | 0 | None | -7 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL537027 | 161095 | 0 | None | -7 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 730 | 13 | 1 | 9 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10212725 | 98169 | 0 | None | 1 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 790 | 15 | 1 | 11 | 6.6 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL273915 | 98169 | 0 | None | 1 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 790 | 15 | 1 | 11 | 6.6 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(C(=O)O)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 46225000 | 199115 | 5 | None | 9 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 308 | 3 | 0 | 2 | 4.0 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589148 | 199115 | 5 | None | 9 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 308 | 3 | 0 | 2 | 4.0 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 42631003 | 199618 | 13 | None | 2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 304 | 3 | 0 | 2 | 4.2 | Cc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL592752 | 199618 | 13 | None | 2 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 304 | 3 | 0 | 2 | 4.2 | Cc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 14984030 | 107330 | 1 | None | - | 1 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 279 | 5 | 1 | 4 | 1.8 | CN(C)CCCN1C(=O)CSC1c1ccc(N)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202935 | 107330 | 1 | None | - | 1 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 279 | 5 | 1 | 4 | 1.8 | CN(C)CCCN1C(=O)CSC1c1ccc(N)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL317518 | 107330 | 1 | None | - | 1 | Guinea pig | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 279 | 5 | 1 | 4 | 1.8 | CN(C)CCCN1C(=O)CSC1c1ccc(N)cc1 | 10.1021/jm00093a025 | ||
| 44224259 | 62723 | 5 | None | 30 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783959 | 62723 | 5 | None | 30 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 13623358 | 98738 | 1 | None | - | 1 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 260 | 3 | 1 | 5 | 0.8 | CN1CCN(c2nc3ccccc3n2CCO)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL277956 | 98738 | 1 | None | - | 1 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 260 | 3 | 1 | 5 | 0.8 | CN1CCN(c2nc3ccccc3n2CCO)CC1 | 10.1021/jm00157a010 | ||
| 15542881 | 112591 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL330172 | 112591 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 145966333 | 164060 | 0 | None | -346 | 6 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 424 | 8 | 1 | 6 | 3.6 | CNC(=O)c1cc(OCCCCN2CCN(c3cccc4sccc34)CC2)ccn1 | 10.1016/j.bmcl.2018.01.038 | ||
| CHEMBL4209188 | 164060 | 0 | None | -346 | 6 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 424 | 8 | 1 | 6 | 3.6 | CNC(=O)c1cc(OCCCCN2CCN(c3cccc4sccc34)CC2)ccn1 | 10.1016/j.bmcl.2018.01.038 | ||
| 13623355 | 64344 | 0 | None | - | 1 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 304 | 6 | 1 | 6 | 0.8 | CN1CCN(c2nc3ccccc3n2CCOCCO)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL18122 | 64344 | 0 | None | - | 1 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 304 | 6 | 1 | 6 | 0.8 | CN1CCN(c2nc3ccccc3n2CCOCCO)CC1 | 10.1021/jm00157a010 | ||
| 242 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2017.12.099 | ||
| 34 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2017.12.099 | ||
| 60795 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2017.12.099 | ||
| CHEMBL1112 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2017.12.099 | ||
| DB01238 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2017.12.099 | ||
| 242 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2018.01.038 | ||
| 34 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2018.01.038 | ||
| 60795 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2018.01.038 | ||
| CHEMBL1112 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2018.01.038 | ||
| DB01238 | 470 | 124 | None | -97 | 33 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2018.01.038 | ||
| 13623339 | 63295 | 0 | None | - | 1 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 356 | 10 | 0 | 4 | 4.9 | CCCCCCCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17931 | 63295 | 0 | None | - | 1 | Guinea pig | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 356 | 10 | 0 | 4 | 4.9 | CCCCCCCCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 13623356 | 62492 | 0 | None | - | 1 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 350 | 6 | 0 | 5 | 3.0 | CN1CCN(c2nc3ccccc3n2CCOCc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL17808 | 62492 | 0 | None | - | 1 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 350 | 6 | 0 | 5 | 3.0 | CN1CCN(c2nc3ccccc3n2CCOCc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| 10283825 | 96693 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL264007 | 96693 | 0 | None | -1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 10147107 | 207620 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL431850 | 207620 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL95125 | 207620 | 0 | None | -3 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 145964299 | 164132 | 0 | None | -489 | 6 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 426 | 8 | 1 | 6 | 3.8 | CNC(=O)c1cc(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)ccn1 | 10.1016/j.bmcl.2018.01.038 | ||
| CHEMBL4210030 | 164132 | 0 | None | -489 | 6 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 426 | 8 | 1 | 6 | 3.8 | CNC(=O)c1cc(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)ccn1 | 10.1016/j.bmcl.2018.01.038 | ||
| 44327909 | 112358 | 0 | None | -37 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 706 | 14 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL329450 | 112358 | 0 | None | -37 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 706 | 14 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 736282 | 78142 | 12 | None | -3 | 2 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 337 | 6 | 1 | 3 | 4.2 | CN1[C@H](CC(=O)c2ccccc2)CCC[C@@H]1C[C@H](O)c1ccccc1 | 10.1021/jm300671m | ||
| CHEMBL2103769 | 78142 | 12 | None | -3 | 2 | Human | 4.4 | pIC50 | = | 4.4 | Functional | ChEMBL | 337 | 6 | 1 | 3 | 4.2 | CN1[C@H](CC(=O)c2ccccc2)CCC[C@@H]1C[C@H](O)c1ccccc1 | 10.1021/jm300671m | ||
| 2389 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2017.12.099 | ||
| 5073 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2017.12.099 | ||
| 96 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2017.12.099 | ||
| CHEMBL85 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2017.12.099 | ||
| DB00734 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2017.12.099 | ||
| 2389 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2018.01.038 | ||
| 5073 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2018.01.038 | ||
| 96 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2018.01.038 | ||
| CHEMBL85 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2018.01.038 | ||
| DB00734 | 3331 | 118 | None | -234 | 29 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2018.01.038 | ||
| 1227 | 2489 | 43 | None | 2 | 14 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | ||
| 2331 | 2489 | 43 | None | 2 | 14 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | ||
| 3957 | 2489 | 43 | None | 2 | 14 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | ||
| 4992 | 2489 | 43 | None | 2 | 14 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | ||
| CHEMBL511 | 2489 | 43 | None | 2 | 14 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | ||
| DB06691 | 2489 | 43 | None | 2 | 14 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | ||
| 75201901 | 166425 | 19 | None | -208 | 4 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 356 | 3 | 0 | 6 | 4.9 | Cc1cc(Oc2nccc3occc23)ccc1-c1c(C)ncc2nccn12 | 10.1021/acs.jmedchem.8b01622 | ||
| CHEMBL4277264 | 166425 | 19 | None | -208 | 4 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 356 | 3 | 0 | 6 | 4.9 | Cc1cc(Oc2nccc3occc23)ccc1-c1c(C)ncc2nccn12 | 10.1021/acs.jmedchem.8b01622 | ||
| 54582938 | 62719 | 6 | None | 1 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 321 | 4 | 0 | 4 | 3.3 | COc1ccc2c(c1)c1c(n2CCc2ccccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783955 | 62719 | 6 | None | 1 | 2 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 321 | 4 | 0 | 4 | 3.3 | COc1ccc2c(c1)c1c(n2CCc2ccccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54580942 | 62731 | 9 | None | 13 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783967 | 62731 | 9 | None | 13 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 10315027 | 98929 | 0 | None | - | 1 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 337 | 3 | 0 | 1 | 5.5 | c1ccc(CN2CCC3=C(C2)C(c2ccccc2)c2ccccc23)cc1 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL279454 | 98929 | 0 | None | - | 1 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 337 | 3 | 0 | 1 | 5.5 | c1ccc(CN2CCC3=C(C2)C(c2ccccc2)c2ccccc23)cc1 | 10.1016/s0960-894x(00)00199-2 | ||
| 15542673 | 207564 | 0 | None | -1 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL94834 | 207564 | 0 | None | -1 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 10305888 | 207555 | 0 | None | 1 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 750 | 14 | 1 | 9 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCC(=O)O)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL94788 | 207555 | 0 | None | 1 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 750 | 14 | 1 | 9 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCC(=O)O)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 44328321 | 167788 | 0 | None | 1 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 788 | 17 | 1 | 10 | 7.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL430471 | 167788 | 0 | None | 1 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 788 | 17 | 1 | 10 | 7.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10305069 | 207850 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 656 | 12 | 1 | 9 | 5.4 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL96441 | 207850 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 656 | 12 | 1 | 9 | 5.4 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10234086 | 111634 | 0 | None | -6 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL328511 | 111634 | 0 | None | -6 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 744 | 13 | 0 | 10 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccccc5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| 13623335 | 98801 | 0 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 272 | 4 | 0 | 4 | 2.6 | CCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL278456 | 98801 | 0 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 272 | 4 | 0 | 4 | 2.6 | CCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 10121390 | 112739 | 0 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL330499 | 112739 | 0 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 10190413 | 207329 | 0 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL410270 | 207329 | 0 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL93519 | 207329 | 0 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
| 54579957 | 62728 | 5 | None | 36 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783964 | 62728 | 5 | None | 36 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccncc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 44126329 | 62718 | 6 | None | -2 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783954 | 62718 | 6 | None | -2 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2ccccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 44126330 | 62724 | 5 | None | -2 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2cccnc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783960 | 62724 | 5 | None | -2 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 305 | 3 | 0 | 3 | 3.6 | Cc1ccc2c(c1)c1c(n2CCc2cccnc2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 13623348 | 59042 | 0 | None | - | 1 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 300 | 5 | 0 | 4 | 3.2 | CCCC(C)Cn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL16939 | 59042 | 0 | None | - | 1 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 300 | 5 | 0 | 4 | 3.2 | CCCC(C)Cn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 10423703 | 107295 | 0 | None | - | 1 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202942 | 107295 | 0 | None | - | 1 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL317171 | 107295 | 0 | None | - | 1 | Guinea pig | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| 10300214 | 84199 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 492 | 9 | 2 | 5 | 5.0 | O=C(Nc1ccccc1OCC(O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)C1CCC1 | 10.1016/j.bmcl.2012.09.113 | ||
| CHEMBL2208416 | 84199 | 0 | None | - | 1 | Human | 5.3 | pIC50 | = | 5.3 | Functional | ChEMBL | 492 | 9 | 2 | 5 | 5.0 | O=C(Nc1ccccc1OCC(O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)C1CCC1 | 10.1016/j.bmcl.2012.09.113 | ||
| 15830914 | 98906 | 0 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 245 | 1 | 1 | 1 | 3.5 | C1=C2C(=C(c3ccccc3)c3ccccc32)CNC1 | 10.1016/s0960-894x(00)00199-2 | ||
| CHEMBL279297 | 98906 | 0 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 245 | 1 | 1 | 1 | 3.5 | C1=C2C(=C(c3ccccc3)c3ccccc32)CNC1 | 10.1016/s0960-894x(00)00199-2 | ||
| 13623351 | 61156 | 0 | None | - | 1 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 318 | 6 | 0 | 5 | 2.9 | CCSCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17655 | 61156 | 0 | None | - | 1 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 318 | 6 | 0 | 5 | 2.9 | CCSCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 54582940 | 62722 | 5 | None | 1 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 359 | 3 | 0 | 3 | 4.3 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783958 | 62722 | 5 | None | 1 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 359 | 3 | 0 | 3 | 4.3 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 2600 | 3779 | 74 | None | 4 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(97)10097-X | ||
| 2608 | 3779 | 74 | None | 4 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(97)10097-X | ||
| 5405 | 3779 | 74 | None | 4 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL17157 | 3779 | 74 | None | 4 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(97)10097-X | ||
| DB00342 | 3779 | 74 | None | 4 | 32 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(97)10097-X | ||
| 10917690 | 207605 | 1 | None | -3 | 4 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL95051 | 207605 | 1 | None | -3 | 4 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10097-X | ||
| 44328320 | 207601 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 802 | 17 | 0 | 11 | 7.5 | COC(=O)c1ccccc1OCCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL95029 | 207601 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 802 | 17 | 0 | 11 | 7.5 | COC(=O)c1ccccc1OCCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| 10147218 | 107466 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 778 | 15 | 0 | 10 | 7.5 | CCOC(=O)CCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL318369 | 107466 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 778 | 15 | 0 | 10 | 7.5 | CCOC(=O)CCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| 10169609 | 207645 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 804 | 15 | 0 | 12 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccc(OC)c(OC)c5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL95243 | 207645 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 804 | 15 | 0 | 12 | 6.7 | COC(=O)c1ccc(Cn2c(C(=O)C3CCN(CCC4(c5ccc(OC)c(OC)c5)CCN(C(=O)c5cc(OC)c(OC)c(OC)c5)C4)CC3)nc3ccccc32)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| 3219 | 199795 | 60 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 302 | 5 | 0 | 5 | 2.2 | CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL594 | 199795 | 60 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 302 | 5 | 0 | 5 | 2.2 | CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 44328188 | 111526 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 728 | 16 | 0 | 11 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(OC)c(OC)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL327888 | 111526 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 728 | 16 | 0 | 11 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(OC)c(OC)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| 15542880 | 207506 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 705 | 12 | 0 | 9 | 6.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL94480 | 207506 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 705 | 12 | 0 | 9 | 6.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10284042 | 207986 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 777 | 13 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCN4CCOCC4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL97240 | 207986 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 777 | 13 | 0 | 10 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCN4CCOCC4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10121390 | 112739 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL330499 | 112739 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 596 | 10 | 1 | 7 | 5.4 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10190413 | 207329 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL410270 | 207329 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL93519 | 207329 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 717 | 13 | 0 | 10 | 6.3 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| 15542673 | 207564 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL94834 | 207564 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(C(F)(F)F)cc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 15542869 | 207609 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 720 | 15 | 0 | 10 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOCc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL95076 | 207609 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 720 | 15 | 0 | 10 | 6.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCOCc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10283825 | 96693 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL264007 | 96693 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 740 | 12 | 0 | 8 | 7.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(F)cc3F)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10147107 | 207620 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL431850 | 207620 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL95125 | 207620 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 755 | 12 | 0 | 9 | 7.6 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 15542881 | 112591 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL330172 | 112591 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4cccnc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 15542679 | 108527 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 664 | 10 | 1 | 7 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL320003 | 108527 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 664 | 10 | 1 | 7 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5[nH]4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10122529 | 109556 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL322194 | 109556 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 668 | 14 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| 10233656 | 207851 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL96442 | 207851 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 18333241 | 207793 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 736 | 14 | 0 | 9 | 7.2 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL96141 | 207793 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 736 | 14 | 0 | 9 | 7.2 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(Cl)c(Cl)c4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| 9918576 | 207337 | 0 | None | -2 | 3 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL93556 | 207337 | 0 | None | -2 | 3 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10168749 | 207621 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL95127 | 207621 | 0 | None | -3 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 676 | 12 | 0 | 9 | 6.5 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccco4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 15542879 | 112824 | 0 | None | -2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL330719 | 112824 | 0 | None | -2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 687 | 12 | 0 | 9 | 6.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccncc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10190770 | 208015 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL330430 | 208015 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL97357 | 208015 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 772 | 12 | 0 | 8 | 8.3 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10190638 | 207542 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL94726 | 207542 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1ccc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10283765 | 108087 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 730 | 12 | 0 | 8 | 7.4 | CC(C)Oc1cccc(CC(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL319535 | 108087 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 730 | 12 | 0 | 8 | 7.4 | CC(C)Oc1cccc(CC(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)c1 | 10.1016/S0960-894X(97)10098-1 | ||
| 18333379 | 207575 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 686 | 15 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(F)cc4)CCN(Cc4cc(OC)c(OC)c(OC)c4)C3=O)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL94906 | 207575 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 686 | 15 | 0 | 9 | 5.9 | CCOCCn1c(C(=O)C2CCN(CCC3(c4ccc(F)cc4)CCN(Cc4cc(OC)c(OC)c(OC)c4)C3=O)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10098-1 | ||
| 10190056 | 111438 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL327497 | 111438 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 674 | 11 | 0 | 7 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3ccccc3)C2)cc1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10212223 | 208140 | 0 | None | -2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL431458 | 208140 | 0 | None | -2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL98079 | 208140 | 0 | None | -2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 704 | 12 | 0 | 8 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 15542874 | 112169 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 786 | 12 | 0 | 8 | 8.7 | COc1cc(C(=O)N2CCCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL329055 | 112169 | 0 | None | 1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 786 | 12 | 0 | 8 | 8.7 | COc1cc(C(=O)N2CCCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 10123138 | 108526 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL317524 | 108526 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL320002 | 108526 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 748 | 12 | 0 | 10 | 6.7 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc4c(c3)OCO4)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10098-1 | ||
| 9832306 | 112724 | 0 | None | 2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL330367 | 112724 | 0 | None | 2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL330462 | 112724 | 0 | None | 2 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 806 | 17 | 0 | 10 | 8.2 | CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC | 10.1016/S0960-894X(97)10098-1 | ||
| 15542871 | 207855 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 726 | 9 | 0 | 7 | 8.0 | O=C(c1nc2ccccc2n1Cc1ccc(F)cc1)C1CCN(CCC2(c3ccc4c(c3)OCO4)CCN(C(=O)c3ccc(Cl)cc3Cl)C2)CC1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL96466 | 207855 | 0 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 726 | 9 | 0 | 7 | 8.0 | O=C(c1nc2ccccc2n1Cc1ccc(F)cc1)C1CCN(CCC2(c3ccc4c(c3)OCO4)CCN(C(=O)c3ccc(Cl)cc3Cl)C2)CC1 | 10.1016/S0960-894X(97)10098-1 | ||
| 3071016 | 98578 | 1 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 336 | 5 | 0 | 5 | 2.9 | CN1CCN(c2nc3ccccc3n2CCOc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL276735 | 98578 | 1 | None | - | 1 | Guinea pig | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 336 | 5 | 0 | 5 | 2.9 | CN1CCN(c2nc3ccccc3n2CCOc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| 14984032 | 208341 | 1 | None | - | 1 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1cccc(Br)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202932 | 208341 | 1 | None | - | 1 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1cccc(Br)c1 | 10.1021/jm00093a025 | ||
| CHEMBL99350 | 208341 | 1 | None | - | 1 | Guinea pig | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1cccc(Br)c1 | 10.1021/jm00093a025 | ||
| 54579956 | 62720 | 5 | None | 3 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783956 | 62720 | 5 | None | 3 | 2 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54586813 | 62725 | 5 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783961 | 62725 | 5 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 44126325 | 199114 | 5 | None | 10 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 334 | 4 | 0 | 3 | 4.2 | COc1ccc(CCn2c3c(c4cc(C)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589147 | 199114 | 5 | None | 10 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 334 | 4 | 0 | 3 | 4.2 | COc1ccc(CCn2c3c(c4cc(C)ccc42)CN(C)CC3)cc1 | 10.1016/j.bmcl.2009.11.037 | ||
| 44126272 | 199150 | 5 | None | 14 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 358 | 3 | 0 | 2 | 4.9 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL589388 | 199150 | 5 | None | 14 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 358 | 3 | 0 | 2 | 4.9 | CN1CCc2c(c3cc(C(F)(F)F)ccc3n2CCc2ccccc2)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 13623349 | 98583 | 0 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 304 | 5 | 0 | 5 | 2.9 | CCCSCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL276774 | 98583 | 0 | None | - | 1 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 304 | 5 | 0 | 5 | 2.9 | CCCSCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 16082828 | 80260 | 0 | None | -398 | 3 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 275 | 6 | 2 | 2 | 3.3 | Clc1ccc(CNCC[C@@H]2C[C@H]2c2c[nH]cn2)cc1 | 10.1021/jm0603318 | ||
| CHEMBL213886 | 80260 | 0 | None | -398 | 3 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 275 | 6 | 2 | 2 | 3.3 | Clc1ccc(CNCC[C@@H]2C[C@H]2c2c[nH]cn2)cc1 | 10.1021/jm0603318 | ||
| 10917690 | 207605 | 1 | None | -3 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL95051 | 207605 | 1 | None | -3 | 4 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| 44328187 | 208139 | 0 | None | -1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 456 | 7 | 0 | 5 | 5.6 | COc1ccc(CCN2CCC(=Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| CHEMBL98076 | 208139 | 0 | None | -1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 456 | 7 | 0 | 5 | 5.6 | COc1ccc(CCN2CCC(=Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1016/S0960-894X(97)10098-1 | ||
| 13623370 | 98391 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 358 | 9 | 0 | 5 | 3.8 | CCCCCN1CCCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL275383 | 98391 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 358 | 9 | 0 | 5 | 3.8 | CCCCCN1CCCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| 46224879 | 201547 | 3 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 302 | 2 | 0 | 2 | 4.6 | Cc1ccc2c(c1)c1c(n2/C=C\c2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL605405 | 201547 | 3 | None | -1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 302 | 2 | 0 | 2 | 4.6 | Cc1ccc2c(c1)c1c(n2/C=C\c2ccccc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 54581998 | 62735 | 3 | None | 5 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 368 | 4 | 0 | 4 | 4.3 | CN1CCc2c(c3cc(-c4cccnc4)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783972 | 62735 | 3 | None | 5 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 368 | 4 | 0 | 4 | 4.3 | CN1CCc2c(c3cc(-c4cccnc4)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54585846 | 62727 | 5 | None | 38 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 3.7 | Cc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cn1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783963 | 62727 | 5 | None | 38 | 2 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 3.7 | Cc1ccc(CCn2c3c(c4cc(F)ccc42)CN(C)CC3)cn1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54583939 | 62737 | 5 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 388 | 4 | 0 | 4 | 4.0 | Cc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C2CCN(C)CC2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783975 | 62737 | 5 | None | - | 1 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 388 | 4 | 0 | 4 | 4.0 | Cc1ccc2c(c1)c1c(n2CCc2ccncc2)CCN(C2CCN(C)CC2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 13623340 | 59041 | 0 | None | - | 1 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 292 | 2 | 0 | 4 | 2.8 | CN1CCN(c2nc3ccccc3n2-c2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL16938 | 59041 | 0 | None | - | 1 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 292 | 2 | 0 | 4 | 2.8 | CN1CCN(c2nc3ccccc3n2-c2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| 54583938 | 62733 | 0 | None | 1 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 306 | 3 | 0 | 4 | 3.0 | Cc1ccc2c(c1)c1c(n2CCc2cnccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783970 | 62733 | 0 | None | 1 | 2 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 306 | 3 | 0 | 4 | 3.0 | Cc1ccc2c(c1)c1c(n2CCc2cnccn2)CCN(C)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 13623369 | 62393 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 344 | 8 | 0 | 5 | 3.4 | CCCCN1CCCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL17795 | 62393 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 344 | 8 | 0 | 5 | 3.4 | CCCCN1CCCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| 13623368 | 162246 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 330 | 7 | 0 | 5 | 3.0 | CCCN1CCCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL416357 | 162246 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 330 | 7 | 0 | 5 | 3.0 | CCCN1CCCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| 13623362 | 98083 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 358 | 10 | 0 | 5 | 3.8 | CCCCCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL273315 | 98083 | 0 | None | - | 1 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 358 | 10 | 0 | 5 | 3.8 | CCCCCCN1CCN(c2nc3ccccc3n2CCOCC)CC1 | 10.1021/jm00157a010 | ||
| 16082831 | 80346 | 0 | None | -1000 | 3 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 275 | 6 | 2 | 2 | 3.3 | Clc1ccc(CNCC[C@H]2C[C@@H]2c2c[nH]cn2)cc1 | 10.1021/jm0603318 | ||
| CHEMBL214311 | 80346 | 0 | None | -1000 | 3 | Human | 5.1 | pIC50 | = | 5.1 | Functional | ChEMBL | 275 | 6 | 2 | 2 | 3.3 | Clc1ccc(CNCC[C@H]2C[C@@H]2c2c[nH]cn2)cc1 | 10.1021/jm0603318 | ||
| 13623353 | 60498 | 0 | None | - | 1 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 288 | 5 | 0 | 5 | 1.8 | COCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL17556 | 60498 | 0 | None | - | 1 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 288 | 5 | 0 | 5 | 1.8 | COCCCn1c(N2CCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 11976 | 920 | 59 | None | -9 | 16 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| 667467 | 920 | 59 | None | -9 | 16 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| CHEMBL908 | 920 | 59 | None | -9 | 16 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| DB01239 | 920 | 59 | None | -9 | 16 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | ||
| 3071012 | 163290 | 1 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 350 | 5 | 0 | 5 | 3.3 | CN1CCCN(c2nc3ccccc3n2CCOc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| CHEMBL418731 | 163290 | 1 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 350 | 5 | 0 | 5 | 3.3 | CN1CCCN(c2nc3ccccc3n2CCOc2ccccc2)CC1 | 10.1021/jm00157a010 | ||
| 3070998 | 98981 | 1 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 312 | 5 | 0 | 5 | 1.8 | C#CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| CHEMBL279875 | 98981 | 1 | None | - | 1 | Guinea pig | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 312 | 5 | 0 | 5 | 1.8 | C#CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | 10.1021/jm00157a010 | ||
| 145963961 | 164403 | 0 | None | -416 | 6 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 425 | 8 | 1 | 7 | 3.0 | CNC(=O)c1cc(OCCCCN2CCN(c3nsc4ccccc34)CC2)ccn1 | 10.1016/j.bmcl.2018.01.038 | ||
| CHEMBL4213342 | 164403 | 0 | None | -416 | 6 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 425 | 8 | 1 | 7 | 3.0 | CNC(=O)c1cc(OCCCCN2CCN(c3nsc4ccccc34)CC2)ccn1 | 10.1016/j.bmcl.2018.01.038 | ||
| 54586812 | 62717 | 5 | None | 12 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783953 | 62717 | 5 | None | 12 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 291 | 3 | 0 | 3 | 3.3 | CN1CCc2c(c3ccccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54586813 | 62725 | 5 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783961 | 62725 | 5 | None | - | 1 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2cccnc2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 54579956 | 62720 | 5 | None | 3 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| CHEMBL1783956 | 62720 | 5 | None | 3 | 2 | Human | 6.0 | pIC50 | = | 6.0 | Functional | ChEMBL | 309 | 3 | 0 | 3 | 3.4 | CN1CCc2c(c3cc(F)ccc3n2CCc2ccccn2)C1 | 10.1016/j.bmcl.2009.04.128 | ||
| 10212645 | 13289 | 0 | None | -346 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 774 | 16 | 1 | 10 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL1191766 | 13289 | 0 | None | -346 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 774 | 16 | 1 | 10 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL542908 | 13289 | 0 | None | -346 | 2 | Human | 5.0 | pIC50 | = | 5.0 | Functional | ChEMBL | 774 | 16 | 1 | 10 | 7.0 | COc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4CCCOc4ccccc4C(=O)O)CC3)(c3ccccc3)C2)cc(OC)c1OC | 10.1016/S0960-894X(97)10097-X | ||
| 4601 | 206747 | 35 | None | -549 | 19 | Human | 4.0 | pIC50 | = | 4.0 | Functional | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | 10.1021/jm300671m | ||
| CHEMBL1201023 | 206747 | 35 | None | -549 | 19 | Human | 4.0 | pIC50 | = | 4.0 | Functional | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | 10.1021/jm300671m | ||
| CHEMBL900 | 206747 | 35 | None | -549 | 19 | Human | 4.0 | pIC50 | = | 4.0 | Functional | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | 10.1021/jm300671m | ||
| 44126327 | 201653 | 5 | None | 41 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 372 | 3 | 0 | 2 | 5.2 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C(F)(F)F)cc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| CHEMBL606036 | 201653 | 5 | None | 41 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 372 | 3 | 0 | 2 | 5.2 | Cc1ccc2c(c1)c1c(n2CCc2ccc(C(F)(F)F)cc2)CCN(C)C1 | 10.1016/j.bmcl.2009.11.037 | ||
| 10190842 | 107224 | 0 | None | -63 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 788 | 16 | 0 | 11 | 7.1 | COC(=O)c1ccccc1OCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
| CHEMBL316705 | 107224 | 0 | None | -63 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 788 | 16 | 0 | 11 | 7.1 | COC(=O)c1ccccc1OCCCn1c(C(=O)C2CCN(CCC3(c4ccccc4)CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)C3)CC2)nc2ccccc21 | 10.1016/S0960-894X(97)10097-X | ||
| 71461781 | 80469 | 0 | None | - | 0 | Human | 10.4 | pKd | = | 10.4 | Functional | ChEMBL | 409 | 7 | 0 | 4 | 4.9 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146802 | 80469 | 0 | None | - | 0 | Human | 10.4 | pKd | = | 10.4 | Functional | ChEMBL | 409 | 7 | 0 | 4 | 4.9 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 15254720 | 61301 | 0 | None | - | 0 | Human | 10.0 | pKd | = | 10 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL1767136 | 61301 | 0 | None | - | 0 | Human | 10.0 | pKd | = | 10 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71461782 | 80473 | 0 | None | - | 0 | Human | 10.0 | pKd | = | 10 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146806 | 80473 | 0 | None | - | 0 | Human | 10.0 | pKd | = | 10 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 2267 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| 271 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| 7121 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL639 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| DB00972 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| 2267 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| 271 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| 7121 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL639 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| DB00972 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| 2267 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2017.09.020 | ||
| 271 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2017.09.020 | ||
| 7121 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL639 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2017.09.020 | ||
| DB00972 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2017.09.020 | ||
| 24824726 | 161109 | 1 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4060529 | 161109 | 1 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117079 | 161109 | 1 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL5282336 | 161109 | 1 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL5286389 | 161109 | 1 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmcl.2017.09.020 | ||
| 25189511 | 161118 | 0 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 461 | 13 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4059750 | 161118 | 0 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 461 | 13 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117137 | 161118 | 0 | None | - | 0 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 461 | 13 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 2267 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| 271 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| 7121 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| CHEMBL639 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| DB00972 | 559 | 71 | None | 32 | 14 | Human | 9.7 | pKd | = | 9.7 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| 71452871 | 80468 | 0 | None | - | 0 | Human | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146801 | 80468 | 0 | None | - | 0 | Human | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 25190195 | 157912 | 0 | None | - | 0 | Human | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 446 | 9 | 0 | 5 | 5.0 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)C(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4084325 | 157912 | 0 | None | - | 0 | Human | 9.6 | pKd | = | 9.6 | Functional | ChEMBL | 446 | 9 | 0 | 5 | 5.0 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)C(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 71458203 | 80472 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146805 | 80472 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71451044 | 80474 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146807 | 80474 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71458204 | 80476 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146809 | 80476 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 1530 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00161a022 | ||
| 3827 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00161a022 | ||
| 7206 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00161a022 | ||
| CHEMBL534 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00161a022 | ||
| DB00920 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00161a022 | ||
| 1530 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00377a013 | ||
| 3827 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00377a013 | ||
| 7206 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00377a013 | ||
| CHEMBL534 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00377a013 | ||
| DB00920 | 2182 | 50 | None | - | 25 | Guinea pig | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00377a013 | ||
| 25190192 | 160995 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 418 | 10 | 0 | 5 | 4.2 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4098917 | 160995 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 418 | 10 | 0 | 5 | 4.2 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4116155 | 160995 | 0 | None | - | 0 | Human | 9.5 | pKd | = | 9.5 | Functional | ChEMBL | 418 | 10 | 0 | 5 | 4.2 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(03)00113-6 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(03)00113-6 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(03)00113-6 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(03)00113-6 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/s0960-894x(03)00113-6 | ||
| 25190372 | 160975 | 0 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 433 | 11 | 1 | 5 | 3.8 | CCCCc1cc(OC2CCN(CCCCNS(C)(=O)=O)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4098192 | 160975 | 0 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 433 | 11 | 1 | 5 | 3.8 | CCCCc1cc(OC2CCN(CCCCNS(C)(=O)=O)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4115992 | 160975 | 0 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 433 | 11 | 1 | 5 | 3.8 | CCCCc1cc(OC2CCN(CCCCNS(C)(=O)=O)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 25190194 | 161162 | 0 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)C(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4102287 | 161162 | 0 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)C(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117432 | 161162 | 0 | None | - | 0 | Human | 9.4 | pKd | = | 9.4 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)C(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 71452872 | 80434 | 0 | None | - | 0 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146484 | 80434 | 0 | None | - | 0 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 25164129 | 161160 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 447 | 12 | 1 | 5 | 4.1 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4088036 | 161160 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 447 | 12 | 1 | 5 | 4.1 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117406 | 161160 | 0 | None | - | 1 | Human | 9.3 | pKd | = | 9.3 | Functional | ChEMBL | 447 | 12 | 1 | 5 | 4.1 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 25189509 | 161072 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 461 | 10 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)NC(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4069073 | 161072 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 461 | 10 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)NC(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4116734 | 161072 | 0 | None | - | 0 | Human | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 461 | 10 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)NC(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 44320707 | 106030 | 0 | None | - | 0 | Guinea pig | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 293 | 4 | 1 | 2 | 2.9 | CN(C)CCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL313301 | 106030 | 0 | None | - | 0 | Guinea pig | 9.2 | pKd | = | 9.2 | Functional | ChEMBL | 293 | 4 | 1 | 2 | 2.9 | CN(C)CCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 10403687 | 2511 | 3 | None | 1 | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | 1 | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | 1 | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 25190193 | 161199 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 432 | 11 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)CCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4080880 | 161199 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 432 | 11 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)CCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117740 | 161199 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 432 | 11 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCCS(=O)(=O)CCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 1194 | 45 | 3 | None | - | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/s0960-894x(98)00461-2 | ||
| 23786499 | 45 | 3 | None | - | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL26116 | 45 | 3 | None | - | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/s0960-894x(98)00461-2 | ||
| 44320708 | 206377 | 0 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 295 | 5 | 2 | 2 | 3.4 | FC(F)(F)c1cccc(-c2nc(CCNC3CC3)c[nH]2)c1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL87583 | 206377 | 0 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 295 | 5 | 2 | 2 | 3.4 | FC(F)(F)c1cccc(-c2nc(CCNC3CC3)c[nH]2)c1 | 10.1016/s0960-894x(98)00461-2 | ||
| 44320686 | 206453 | 1 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 279 | 4 | 2 | 2 | 2.6 | CNCCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL88075 | 206453 | 1 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 279 | 4 | 2 | 2 | 2.6 | CNCCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 10042467 | 1426 | 1 | None | -1 | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | -1 | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | -1 | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 10447834 | 1933 | 4 | None | 2 | 3 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | 2 | 3 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | 2 | 3 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 17747460 | 61329 | 12 | None | - | 2 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL1767164 | 61329 | 12 | None | - | 2 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| 71456360 | 80475 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146808 | 80475 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 17747460 | 61329 | 12 | None | - | 2 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL1767164 | 61329 | 12 | None | - | 2 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmcl.2016.11.022 | ||
| 17747460 | 61329 | 12 | None | - | 2 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767164 | 61329 | 12 | None | - | 2 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00161a022 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00161a022 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00161a022 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00161a022 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00161a022 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00161a022 | ||
| 13676700 | 204784 | 0 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 453 | 7 | 1 | 8 | 3.7 | Oc1c2nnnc-2oc2cc(OCCCN3CCN(Cc4ccc(Cl)cc4)CC3)ccc12 | 10.1021/jm00161a022 | ||
| CHEMBL74870 | 204784 | 0 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 453 | 7 | 1 | 8 | 3.7 | Oc1c2nnnc-2oc2cc(OCCCN3CCN(Cc4ccc(Cl)cc4)CC3)ccc12 | 10.1021/jm00161a022 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00377a013 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00377a013 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00377a013 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00377a013 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00377a013 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00377a013 | ||
| 25190374 | 161178 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 475 | 13 | 1 | 5 | 4.8 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4082646 | 161178 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 475 | 13 | 1 | 5 | 4.8 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117608 | 161178 | 0 | None | - | 0 | Human | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 475 | 13 | 1 | 5 | 4.8 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 9993212 | 206207 | 1 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 269 | 4 | 2 | 2 | 2.9 | CNCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL86522 | 206207 | 1 | None | - | 0 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 269 | 4 | 2 | 2 | 2.9 | CNCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/0960-894X(95)00092-8 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/0960-894X(95)00092-8 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/0960-894X(95)00092-8 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/0960-894X(95)00092-8 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/0960-894X(95)00092-8 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/0960-894X(95)00092-8 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/s0960-894x(98)00461-2 | ||
| 5310982 | 93612 | 4 | None | - | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL24665 | 93612 | 4 | None | - | 2 | Guinea pig | 9.1 | pKd | = | 9.1 | Functional | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 9993212 | 206207 | 1 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 269 | 4 | 2 | 2 | 2.9 | CNCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL86522 | 206207 | 1 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 269 | 4 | 2 | 2 | 2.9 | CNCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 10689833 | 12766 | 0 | None | 4 | 2 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 359 | 8 | 1 | 2 | 4.8 | c1ccc(C(CCc2nc(CCN3CCCC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL11879 | 12766 | 0 | None | 4 | 2 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 359 | 8 | 1 | 2 | 4.8 | c1ccc(C(CCc2nc(CCN3CCCC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 10447834 | 1933 | 4 | None | 2 | 3 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | 2 | 3 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | 2 | 3 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 5310982 | 93612 | 4 | None | - | 2 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL24665 | 93612 | 4 | None | - | 2 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 44320686 | 206453 | 1 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 279 | 4 | 2 | 2 | 2.6 | CNCCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL88075 | 206453 | 1 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 279 | 4 | 2 | 2 | 2.6 | CNCCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 24804150 | 80480 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 641 | 14 | 0 | 7 | 7.2 | O=c1c2ccncc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146813 | 80480 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 641 | 14 | 0 | 7 | 7.2 | O=c1c2ccncc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| 25189510 | 156109 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 461 | 13 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCS(=O)(=O)NCCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4063163 | 156109 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 461 | 13 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCS(=O)(=O)NCCC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 25190375 | 161084 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 501 | 12 | 1 | 5 | 5.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C3CCCCC3)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4088039 | 161084 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 501 | 12 | 1 | 5 | 5.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C3CCCCC3)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4116791 | 161084 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 501 | 12 | 1 | 5 | 5.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C3CCCCC3)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 25190431 | 161213 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 461 | 12 | 0 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCN(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4065123 | 161213 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 461 | 12 | 0 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCN(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117871 | 161213 | 0 | None | - | 0 | Human | 9.0 | pKd | = | 9 | Functional | ChEMBL | 461 | 12 | 0 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCN(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 54710796 | 120423 | 0 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 473 | 8 | 1 | 8 | 3.6 | O=c1oc2cc(OCCCN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| CHEMBL35376 | 120423 | 0 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 473 | 8 | 1 | 8 | 3.6 | O=c1oc2cc(OCCCN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00093a025 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00093a025 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00093a025 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00093a025 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00093a025 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm00093a025 | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 9.0 | pKd | = | 9 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 44320685 | 206452 | 0 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 283 | 5 | 2 | 2 | 3.2 | CCNCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL88074 | 206452 | 0 | None | - | 0 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 283 | 5 | 2 | 2 | 3.2 | CCNCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 1227 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2008.09.019 | ||
| 2331 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2008.09.019 | ||
| 3957 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2008.09.019 | ||
| 4992 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2008.09.019 | ||
| CHEMBL511 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2008.09.019 | ||
| DB06691 | 2489 | 43 | None | -2 | 14 | Guinea pig | 9.0 | pKd | = | 9.0 | Functional | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2008.09.019 | ||
| 44320707 | 106030 | 0 | None | - | 0 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 293 | 4 | 1 | 2 | 2.9 | CN(C)CCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL313301 | 106030 | 0 | None | - | 0 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 293 | 4 | 1 | 2 | 2.9 | CN(C)CCc1c[nH]c(-c2cccc(Br)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 10407870 | 106761 | 0 | None | - | 0 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 283 | 4 | 1 | 2 | 3.2 | CN(C)CCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL314438 | 106761 | 0 | None | - | 0 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 283 | 4 | 1 | 2 | 3.2 | CN(C)CCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 25190317 | 161058 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 433 | 11 | 1 | 5 | 3.8 | CCCCc1cc(OC2CCN(CCCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4080166 | 161058 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 433 | 11 | 1 | 5 | 3.8 | CCCCc1cc(OC2CCN(CCCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4116610 | 161058 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 433 | 11 | 1 | 5 | 3.8 | CCCCc1cc(OC2CCN(CCCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 24803638 | 61330 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 636 | 15 | 0 | 7 | 7.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3CCCCc3ccc(OCCCN4CCCCCC4)cc3)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767165 | 61330 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 636 | 15 | 0 | 7 | 7.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3CCCCc3ccc(OCCCN4CCCCCC4)cc3)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| 24803483 | 61332 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 654 | 15 | 0 | 6 | 8.2 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767167 | 61332 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 654 | 15 | 0 | 6 | 8.2 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 1194 | 45 | 3 | None | - | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/s0960-894x(98)00461-2 | ||
| 23786499 | 45 | 3 | None | - | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL26116 | 45 | 3 | None | - | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 10.1016/s0960-894x(98)00461-2 | ||
| 10403687 | 2511 | 3 | None | 1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | 1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | 1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 10042467 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1524 | 2181 | 96 | None | - | 18 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1016/0960-894X(95)00092-8 | ||
| 197 | 2181 | 96 | None | - | 18 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1016/0960-894X(95)00092-8 | ||
| 3822 | 2181 | 96 | None | - | 18 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1016/0960-894X(95)00092-8 | ||
| 88 | 2181 | 96 | None | - | 18 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1016/0960-894X(95)00092-8 | ||
| CHEMBL51 | 2181 | 96 | None | - | 18 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1016/0960-894X(95)00092-8 | ||
| DB12465 | 2181 | 96 | None | - | 18 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1016/0960-894X(95)00092-8 | ||
| 11791817 | 98303 | 0 | None | -1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL274831 | 98303 | 0 | None | -1 | 2 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 25190253 | 161117 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 460 | 10 | 0 | 5 | 5.4 | CCCCc1cc(OC2CCN(CCCCS(=O)(=O)C(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4095759 | 161117 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 460 | 10 | 0 | 5 | 5.4 | CCCCc1cc(OC2CCN(CCCCS(=O)(=O)C(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117136 | 161117 | 0 | None | - | 0 | Human | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 460 | 10 | 0 | 5 | 5.4 | CCCCc1cc(OC2CCN(CCCCS(=O)(=O)C(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 10407870 | 106761 | 0 | None | - | 0 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 283 | 4 | 1 | 2 | 3.2 | CN(C)CCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| CHEMBL314438 | 106761 | 0 | None | - | 0 | Guinea pig | 8.9 | pKd | = | 8.9 | Functional | ChEMBL | 283 | 4 | 1 | 2 | 3.2 | CN(C)CCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1016/s0960-894x(98)00461-2 | ||
| 10688111 | 10040 | 1 | None | 2 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.3 | CCNCCc1c[nH]c(CCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL11515 | 10040 | 1 | None | 2 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.3 | CCNCCc1c[nH]c(CCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 57780020 | 143450 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 600 | 15 | 1 | 6 | 6.6 | CCCCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3898341 | 143450 | 0 | None | - | 0 | Human | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 600 | 15 | 1 | 6 | 6.6 | CCCCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 10447834 | 1933 | 4 | None | 2 | 3 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | 2 | 3 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | 2 | 3 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 13676694 | 103712 | 0 | None | - | 0 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 467 | 7 | 1 | 8 | 4.0 | Cc1c(OCCCN2CCN(Cc3ccc(Cl)cc3)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| CHEMBL308791 | 103712 | 0 | None | - | 0 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 467 | 7 | 1 | 8 | 4.0 | Cc1c(OCCCN2CCN(Cc3ccc(Cl)cc3)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| 10410901 | 119747 | 0 | None | 23 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| CHEMBL347796 | 119747 | 0 | None | 23 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| 10403687 | 2511 | 3 | None | 1 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | 1 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | 1 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 10484346 | 98726 | 0 | None | - | 0 | Guinea pig | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 646 | 22 | 2 | 11 | 5.8 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)CCCCCNc2ccc([N+](=O)[O-])c3nonc23)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL277848 | 98726 | 0 | None | - | 0 | Guinea pig | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 646 | 22 | 2 | 11 | 5.8 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)CCCCCNc2ccc([N+](=O)[O-])c3nonc23)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 25190435 | 158404 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 447 | 9 | 1 | 5 | 4.1 | CCCCc1cc(OC2CCN(CCS(=O)(=O)NC(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4090136 | 158404 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 447 | 9 | 1 | 5 | 4.1 | CCCCc1cc(OC2CCN(CCS(=O)(=O)NC(C)(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 25190373 | 161088 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 461 | 12 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4060765 | 161088 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 461 | 12 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4116847 | 161088 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 461 | 12 | 1 | 5 | 4.5 | CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C(C)C)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 25190254 | 161103 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCC(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4068414 | 161103 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCC(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117012 | 161103 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCC(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 3529324 | 208354 | 1 | None | - | 1 | Guinea pig | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 306 | 6 | 0 | 3 | 3.3 | CC(C)c1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202934 | 208354 | 1 | None | - | 1 | Guinea pig | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 306 | 6 | 0 | 3 | 3.3 | CC(C)c1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL99417 | 208354 | 1 | None | - | 1 | Guinea pig | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 306 | 6 | 0 | 3 | 3.3 | CC(C)c1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| 57780008 | 149726 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 472 | 9 | 0 | 5 | 5.2 | c1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3947980 | 149726 | 0 | None | - | 0 | Human | 8.0 | pKd | = | 8 | Functional | ChEMBL | 472 | 9 | 0 | 5 | 5.2 | c1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm991056a | ||
| 1204 | 1932 | 119 | None | -9 | 10 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 1247 | 1932 | 119 | None | -9 | 10 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 1375 | 1932 | 119 | None | -9 | 10 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 774 | 1932 | 119 | None | -9 | 10 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| CHEMBL90 | 1932 | 119 | None | -9 | 10 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| DB05381 | 1932 | 119 | None | -9 | 10 | Rat | 8.0 | pKd | = | 8 | Functional | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | ||
| 10364258 | 45769 | 0 | None | -12 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| CHEMBL153067 | 45769 | 0 | None | -12 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| 10042467 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 57402471 | 67876 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 469 | 8 | 1 | 5 | 4.0 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910378 | 67876 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 469 | 8 | 1 | 5 | 4.0 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| 14113352 | 170208 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7 | Functional | ChEMBL | 394 | 10 | 4 | 4 | 3.4 | N=C(NCCCc1c[nH]cn1)NCCSC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL444531 | 170208 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7 | Functional | ChEMBL | 394 | 10 | 4 | 4 | 3.4 | N=C(NCCCc1c[nH]cn1)NCCSC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 14984030 | 107330 | 1 | None | - | 1 | Guinea pig | 6.0 | pKd | = | 6 | Functional | ChEMBL | 279 | 5 | 1 | 4 | 1.8 | CN(C)CCCN1C(=O)CSC1c1ccc(N)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202935 | 107330 | 1 | None | - | 1 | Guinea pig | 6.0 | pKd | = | 6 | Functional | ChEMBL | 279 | 5 | 1 | 4 | 1.8 | CN(C)CCCN1C(=O)CSC1c1ccc(N)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL317518 | 107330 | 1 | None | - | 1 | Guinea pig | 6.0 | pKd | = | 6 | Functional | ChEMBL | 279 | 5 | 1 | 4 | 1.8 | CN(C)CCCN1C(=O)CSC1c1ccc(N)cc1 | 10.1021/jm00093a025 | ||
| 10246247 | 98293 | 0 | None | - | 0 | Guinea pig | 6.0 | pKd | = | 6 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.5 | NCCc1c[nH]c(CCCCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL274767 | 98293 | 0 | None | - | 0 | Guinea pig | 6.0 | pKd | = | 6 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.5 | NCCc1c[nH]c(CCCCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 10684712 | 11392 | 0 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 287 | 8 | 2 | 4 | 3.4 | CCC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL112301 | 11392 | 0 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 287 | 8 | 2 | 4 | 3.4 | CCC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL1180048 | 11392 | 0 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 287 | 8 | 2 | 4 | 3.4 | CCC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 6422121 | 205449 | 1 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 285 | 7 | 2 | 4 | 3.0 | O/N=C(/c1ccc(OCCCc2c[nH]cn2)cc1)C1CC1 | 10.1021/jm000971p | ||
| CHEMBL116270 | 205449 | 1 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 285 | 7 | 2 | 4 | 3.0 | O/N=C(/c1ccc(OCCCc2c[nH]cn2)cc1)C1CC1 | 10.1021/jm000971p | ||
| CHEMBL80348 | 205449 | 1 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 285 | 7 | 2 | 4 | 3.0 | O/N=C(/c1ccc(OCCCc2c[nH]cn2)cc1)C1CC1 | 10.1021/jm000971p | ||
| 2860933 | 208172 | 3 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202929 | 208172 | 3 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL98319 | 208172 | 3 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| 54726349 | 112370 | 0 | None | - | 0 | Guinea pig | 4.0 | pKd | = | 4 | Functional | ChEMBL | 363 | 6 | 1 | 8 | 1.4 | CN1CCN(CCCOc2ccc3c(O)c([N+](=O)[O-])c(=O)oc3c2)CC1 | 10.1021/jm00377a013 | ||
| CHEMBL32953 | 112370 | 0 | None | - | 0 | Guinea pig | 4.0 | pKd | = | 4 | Functional | ChEMBL | 363 | 6 | 1 | 8 | 1.4 | CN1CCN(CCCOc2ccc3c(O)c([N+](=O)[O-])c(=O)oc3c2)CC1 | 10.1021/jm00377a013 | ||
| 10246247 | 98293 | 0 | None | - | 0 | Rat | 6.0 | pKd | = | 6.0 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.5 | NCCc1c[nH]c(CCCCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL274767 | 98293 | 0 | None | - | 0 | Rat | 6.0 | pKd | = | 6.0 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.5 | NCCc1c[nH]c(CCCCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 11779175 | 63166 | 0 | None | - | 1 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 293 | 8 | 2 | 3 | 3.4 | O=C(NCCCC1CCCCC1)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1774600 | 63166 | 0 | None | - | 1 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 293 | 8 | 2 | 3 | 3.4 | O=C(NCCCC1CCCCC1)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1789801 | 63166 | 0 | None | - | 1 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 293 | 8 | 2 | 3 | 3.4 | O=C(NCCCC1CCCCC1)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| 14660374 | 100690 | 0 | None | - | 0 | Guinea pig | 6.0 | pKd | = | 6.0 | Functional | ChEMBL | 394 | 9 | 3 | 3 | 3.6 | CN(CCC(c1ccc(F)cc1)c1ccccn1)C(=N)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| CHEMBL292395 | 100690 | 0 | None | - | 0 | Guinea pig | 6.0 | pKd | = | 6.0 | Functional | ChEMBL | 394 | 9 | 3 | 3 | 3.6 | CN(CCC(c1ccc(F)cc1)c1ccccn1)C(=N)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| 1224 | 1432 | 83 | None | 85 | 22 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | ||
| 3100 | 1432 | 83 | None | 85 | 22 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | ||
| 8980 | 1432 | 83 | None | 85 | 22 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | ||
| 916 | 1432 | 83 | None | 85 | 22 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL657 | 1432 | 83 | None | 85 | 22 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | ||
| DB01075 | 1432 | 83 | None | 85 | 22 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | ||
| 25149611 | 179175 | 0 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 376 | 8 | 4 | 4 | 2.6 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccccc1)c1ccccn1 | 10.1021/jm800841w | ||
| CHEMBL472272 | 179175 | 0 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 376 | 8 | 4 | 4 | 2.6 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccccc1)c1ccccn1 | 10.1021/jm800841w | ||
| 14660410 | 199054 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 396 | 9 | 4 | 4 | 2.1 | N/C(=N\CCC(O)(c1ccc(F)cc1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| CHEMBL58621 | 199054 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 396 | 9 | 4 | 4 | 2.1 | N/C(=N\CCC(O)(c1ccc(F)cc1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| 57398985 | 67883 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 569 | 12 | 2 | 7 | 4.4 | COc1ccc(CN(CCN(C)CC(C)Nc2ccc3[nH]c(C(=O)N4CCN(C)CC4)cc3c2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910385 | 67883 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 569 | 12 | 2 | 7 | 4.4 | COc1ccc(CN(CCN(C)CC(C)Nc2ccc3[nH]c(C(=O)N4CCN(C)CC4)cc3c2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| 54710799 | 96781 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 439 | 8 | 1 | 8 | 3.0 | O=c1oc2cc(OCCCN3CCN(Cc4ccccc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| CHEMBL264756 | 96781 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 439 | 8 | 1 | 8 | 3.0 | O=c1oc2cc(OCCCN3CCN(Cc4ccccc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| 19762600 | 79999 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 370 | 13 | 1 | 5 | 3.5 | COc1ccc(CN(CCN(C)CCCCCCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21278 | 79999 | 0 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 370 | 13 | 1 | 5 | 3.5 | COc1ccc(CN(CCN(C)CCCCCCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 10003410 | 200642 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 440 | 9 | 4 | 3 | 3.8 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(Br)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL59951 | 200642 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 440 | 9 | 4 | 3 | 3.8 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(Br)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 10852834 | 11393 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 315 | 10 | 2 | 4 | 4.2 | CCCCC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL112629 | 11393 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 315 | 10 | 2 | 4 | 4.2 | CCCCC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL1180064 | 11393 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 315 | 10 | 2 | 4 | 4.2 | CCCCC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 10659856 | 11397 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 273 | 7 | 1 | 4 | 2.8 | CO/N=C(\C)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL112753 | 11397 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 273 | 7 | 1 | 4 | 2.8 | CO/N=C(\C)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL1180075 | 11397 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 273 | 7 | 1 | 4 | 2.8 | CO/N=C(\C)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 10828008 | 11410 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 299 | 6 | 1 | 3 | 2.7 | O=C(c1ccc(OCCCc2c[nH]cn2)cc1)N1CCCC1 | 10.1021/jm000971p | ||
| CHEMBL115169 | 11410 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 299 | 6 | 1 | 3 | 2.7 | O=C(c1ccc(OCCCc2c[nH]cn2)cc1)N1CCCC1 | 10.1021/jm000971p | ||
| CHEMBL1180148 | 11410 | 0 | None | - | 0 | Guinea pig | 4.9 | pKd | = | 4.9 | Functional | ChEMBL | 299 | 6 | 1 | 3 | 2.7 | O=C(c1ccc(OCCCc2c[nH]cn2)cc1)N1CCCC1 | 10.1021/jm000971p | ||
| 19762590 | 162263 | 1 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 314 | 9 | 1 | 5 | 2.0 | COc1ccc(CN(CCN(C)CCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL416378 | 162263 | 1 | None | - | 0 | Guinea pig | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | 314 | 9 | 1 | 5 | 2.0 | COc1ccc(CN(CCN(C)CCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 25149335 | 184225 | 0 | None | - | 3 | Guinea pig | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/jm9000693 | ||
| CHEMBL483406 | 184225 | 0 | None | - | 3 | Guinea pig | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/jm9000693 | ||
| 25149335 | 184225 | 0 | None | - | 3 | Guinea pig | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/jm800841w | ||
| CHEMBL483406 | 184225 | 0 | None | - | 3 | Guinea pig | 5.9 | pKd | = | 5.9 | Functional | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/jm800841w | ||
| 52949049 | 10555 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 673 | 17 | 1 | 7 | 7.2 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)CCC2=C3C(C)=CC(C)N3[B-](F)(F)n3c(C)cc(C)c32)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL1169587 | 10555 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 673 | 17 | 1 | 7 | 7.2 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)CCC2=C3C(C)=CC(C)N3[B-](F)(F)n3c(C)cc(C)c32)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 14660389 | 202293 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 393 | 10 | 4 | 2 | 4.0 | N=C(NCCCc1c[nH]cn1)NCCC(Cc1ccccc1)c1ccc(F)cc1 | 10.1021/jm00128a045 | ||
| CHEMBL61022 | 202293 | 0 | None | - | 0 | Guinea pig | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | 393 | 10 | 4 | 2 | 4.0 | N=C(NCCCc1c[nH]cn1)NCCC(Cc1ccccc1)c1ccc(F)cc1 | 10.1021/jm00128a045 | ||
| 44457703 | 99546 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 672 | 13 | 3 | 9 | 5.7 | COc1ccc(CN(CCN(C)CCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL283527 | 99546 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 672 | 13 | 3 | 9 | 5.7 | COc1ccc(CN(CCN(C)CCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 14660348 | 199654 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 376 | 9 | 3 | 3 | 3.2 | Cc1ccc(C(CC/N=C(\N)NCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1021/jm00128a045 | ||
| CHEMBL59294 | 199654 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 376 | 9 | 3 | 3 | 3.2 | Cc1ccc(C(CC/N=C(\N)NCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1021/jm00128a045 | ||
| 13676692 | 105484 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 447 | 7 | 1 | 8 | 3.6 | Cc1ccc(CN2CCN(CCCOc3ccc4c(O)c5nnnc-5oc4c3C)CC2)cc1 | 10.1021/jm00161a022 | ||
| CHEMBL312083 | 105484 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 447 | 7 | 1 | 8 | 3.6 | Cc1ccc(CN2CCN(CCCOc3ccc4c(O)c5nnnc-5oc4c3C)CC2)cc1 | 10.1021/jm00161a022 | ||
| 13676699 | 163768 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 434 | 7 | 1 | 9 | 2.7 | Cc1c(OCCCN2CCN(Cc3ccccn3)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| CHEMBL420567 | 163768 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 434 | 7 | 1 | 9 | 2.7 | Cc1c(OCCCN2CCN(Cc3ccccn3)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| 14660357 | 202702 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1cccc(F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL61675 | 202702 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1cccc(F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 54710801 | 99907 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 459 | 7 | 1 | 8 | 3.3 | O=c1oc2cc(OCCN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| CHEMBL286094 | 99907 | 0 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 459 | 7 | 1 | 8 | 3.3 | O=c1oc2cc(OCCN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| 10825231 | 9630 | 1 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 260 | 6 | 1 | 4 | 2.2 | COC(=O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL112670 | 9630 | 1 | None | - | 0 | Guinea pig | 6.8 | pKd | = | 6.8 | Functional | ChEMBL | 260 | 6 | 1 | 4 | 2.2 | COC(=O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 1278 | 2150 | 84 | None | - | 4 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | ||
| 1279 | 2150 | 84 | None | - | 4 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | ||
| 4908365 | 2150 | 84 | None | - | 4 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL129198 | 2150 | 84 | None | - | 4 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | ||
| 15179507 | 204179 | 0 | None | - | 0 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 729 | 11 | 4 | 6 | 3.7 | N#CN/C(=N\CCNC(=O)c1cc(I)c(N)c(I)c1)NCCCOc1cccc(CN2CCCCC2)c1 | 10.1021/jm00090a013 | ||
| CHEMBL70746 | 204179 | 0 | None | - | 0 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 729 | 11 | 4 | 6 | 3.7 | N#CN/C(=N\CCNC(=O)c1cc(I)c(N)c(I)c1)NCCCOc1cccc(CN2CCCCC2)c1 | 10.1021/jm00090a013 | ||
| 11459067 | 11348 | 0 | None | - | 0 | Guinea pig | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 238 | 11 | 1 | 2 | 3.7 | CCCCCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| CHEMBL1179647 | 11348 | 0 | None | - | 0 | Guinea pig | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 238 | 11 | 1 | 2 | 3.7 | CCCCCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| CHEMBL91523 | 11348 | 0 | None | - | 0 | Guinea pig | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 238 | 11 | 1 | 2 | 3.7 | CCCCCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| 10730975 | 12105 | 0 | None | - | 0 | Guinea pig | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 273 | 6 | 2 | 4 | 2.9 | C/C(=N\O)c1ccc(OCCCc2c[nH]cn2)c(C)c1 | 10.1021/jm000971p | ||
| CHEMBL1183977 | 12105 | 0 | None | - | 0 | Guinea pig | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 273 | 6 | 2 | 4 | 2.9 | C/C(=N\O)c1ccc(OCCCc2c[nH]cn2)c(C)c1 | 10.1021/jm000971p | ||
| CHEMBL326624 | 12105 | 0 | None | - | 0 | Guinea pig | 4.8 | pKd | = | 4.8 | Functional | ChEMBL | 273 | 6 | 2 | 4 | 2.9 | C/C(=N\O)c1ccc(OCCCc2c[nH]cn2)c(C)c1 | 10.1021/jm000971p | ||
| 14660414 | 199072 | 0 | None | - | 0 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 407 | 10 | 3 | 5 | 2.8 | N/C(=N\CCC(c1cccc([N+](=O)[O-])c1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| CHEMBL58750 | 199072 | 0 | None | - | 0 | Guinea pig | 5.8 | pKd | = | 5.8 | Functional | ChEMBL | 407 | 10 | 3 | 5 | 2.8 | N/C(=N\CCC(c1cccc([N+](=O)[O-])c1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| 44457690 | 85526 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 603 | 17 | 1 | 7 | 5.8 | COc1ccc(CN(CCN(C)CCCCCCNS(=O)(=O)c2cccc3c(N(C)C)cccc23)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL22749 | 85526 | 0 | None | - | 0 | Guinea pig | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | 603 | 17 | 1 | 7 | 5.8 | COc1ccc(CN(CCN(C)CCCCCCNS(=O)(=O)c2cccc3c(N(C)C)cccc23)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 25149427 | 185961 | 0 | None | - | 0 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 313 | 8 | 4 | 3 | 2.0 | N=C(NCCCc1c[nH]cn1)NC(=O)CCCc1ccccc1 | 10.1021/jm800841w | ||
| CHEMBL486962 | 185961 | 0 | None | - | 0 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 313 | 8 | 4 | 3 | 2.0 | N=C(NCCCc1c[nH]cn1)NC(=O)CCCc1ccccc1 | 10.1021/jm800841w | ||
| 10423703 | 107295 | 0 | None | - | 1 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202942 | 107295 | 0 | None | - | 1 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL317171 | 107295 | 0 | None | - | 1 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| 14660380 | 198707 | 0 | None | - | 0 | Guinea pig | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(F)cc1)c1cccnc1 | 10.1021/jm00128a045 | ||
| CHEMBL58170 | 198707 | 0 | None | - | 0 | Guinea pig | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(F)cc1)c1cccnc1 | 10.1021/jm00128a045 | ||
| 10342634 | 200019 | 0 | None | - | 0 | Guinea pig | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 429 | 9 | 4 | 2 | 5.0 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00128a045 | ||
| CHEMBL59544 | 200019 | 0 | None | - | 0 | Guinea pig | 6.7 | pKd | = | 6.7 | Functional | ChEMBL | 429 | 9 | 4 | 2 | 5.0 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccc(Cl)c(Cl)c1 | 10.1021/jm00128a045 | ||
| 11436304 | 11337 | 0 | None | - | 0 | Guinea pig | 4.7 | pKd | = | 4.7 | Functional | ChEMBL | 236 | 8 | 1 | 2 | 3.3 | c1nc(CCCOCCCC2CCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL1179594 | 11337 | 0 | None | - | 0 | Guinea pig | 4.7 | pKd | = | 4.7 | Functional | ChEMBL | 236 | 8 | 1 | 2 | 3.3 | c1nc(CCCOCCCC2CCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL88306 | 11337 | 0 | None | - | 0 | Guinea pig | 4.7 | pKd | = | 4.7 | Functional | ChEMBL | 236 | 8 | 1 | 2 | 3.3 | c1nc(CCCOCCCC2CCCC2)c[nH]1 | 10.1021/jm031065q | ||
| 10375442 | 11340 | 0 | None | - | 1 | Guinea pig | 4.7 | pKd | = | 4.7 | Functional | ChEMBL | 196 | 8 | 1 | 2 | 2.5 | CCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| CHEMBL1179604 | 11340 | 0 | None | - | 1 | Guinea pig | 4.7 | pKd | = | 4.7 | Functional | ChEMBL | 196 | 8 | 1 | 2 | 2.5 | CCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| CHEMBL88746 | 11340 | 0 | None | - | 1 | Guinea pig | 4.7 | pKd | = | 4.7 | Functional | ChEMBL | 196 | 8 | 1 | 2 | 2.5 | CCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| 25190258 | 161152 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 419 | 10 | 1 | 5 | 3.4 | CCCCc1cc(OC2CCN(CCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4079248 | 161152 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 419 | 10 | 1 | 5 | 3.4 | CCCCc1cc(OC2CCN(CCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117327 | 161152 | 0 | None | - | 0 | Human | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 419 | 10 | 1 | 5 | 3.4 | CCCCc1cc(OC2CCN(CCNS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 11791817 | 98303 | 0 | None | -1 | 2 | Guinea pig | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL274831 | 98303 | 0 | None | -1 | 2 | Guinea pig | 8.7 | pKd | = | 8.7 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 71449250 | 80471 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccncc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146804 | 80471 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccncc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 57780007 | 146991 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 572 | 13 | 1 | 6 | 5.8 | CCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3926412 | 146991 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 572 | 13 | 1 | 6 | 5.8 | CCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 25190254 | 161103 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCC(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4068414 | 161103 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCC(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117012 | 161103 | 0 | None | - | 0 | Human | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 432 | 10 | 0 | 5 | 4.6 | CCCCc1cc(OC2CCN(CCC(C)S(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 10042467 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 1203 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| CHEMBL11553 | 1426 | 1 | None | -1 | 2 | Guinea pig | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 10.1021/jm991056a | ||
| 57390224 | 67877 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 503 | 8 | 1 | 5 | 4.7 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910379 | 67877 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 503 | 8 | 1 | 5 | 4.7 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| 44457702 | 83169 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 728 | 17 | 3 | 9 | 7.3 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21833 | 83169 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 728 | 17 | 3 | 9 | 7.3 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 25149712 | 178986 | 0 | None | - | 3 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 299 | 7 | 4 | 3 | 1.6 | N=C(NCCCc1c[nH]cn1)NC(=O)CCc1ccccc1 | 10.1021/jm800841w | ||
| CHEMBL470790 | 178986 | 0 | None | - | 3 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 299 | 7 | 4 | 3 | 1.6 | N=C(NCCCc1c[nH]cn1)NC(=O)CCc1ccccc1 | 10.1021/jm800841w | ||
| 11956130 | 185965 | 0 | None | - | 0 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 319 | 7 | 4 | 3 | 2.6 | CC(CC(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1021/jm800841w | ||
| CHEMBL486965 | 185965 | 0 | None | - | 0 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 319 | 7 | 4 | 3 | 2.6 | CC(CC(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1021/jm800841w | ||
| 1221 | 475 | 9 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm00128a045 | ||
| 65895 | 475 | 9 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm00128a045 | ||
| CHEMBL293802 | 475 | 9 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm00128a045 | ||
| 1221 | 475 | 9 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm800841w | ||
| 65895 | 475 | 9 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm800841w | ||
| CHEMBL293802 | 475 | 9 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm800841w | ||
| 19762580 | 80793 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 342 | 11 | 1 | 5 | 2.8 | COc1ccc(CN(CCN(C)CCCCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21520 | 80793 | 0 | None | - | 0 | Guinea pig | 7.7 | pKd | = | 7.7 | Functional | ChEMBL | 342 | 11 | 1 | 5 | 2.8 | COc1ccc(CN(CCN(C)CCCCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 15179508 | 204695 | 0 | None | - | 0 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 588 | 11 | 3 | 5 | 3.5 | N#CN/C(=N\CCNC(=O)c1cccc(I)c1)NCCCOc1cccc(CN2CCCCC2)c1 | 10.1021/jm00090a013 | ||
| CHEMBL73994 | 204695 | 0 | None | - | 0 | Guinea pig | 5.7 | pKd | = | 5.7 | Functional | ChEMBL | 588 | 11 | 3 | 5 | 3.5 | N#CN/C(=N\CCNC(=O)c1cccc(I)c1)NCCCOc1cccc(CN2CCCCC2)c1 | 10.1021/jm00090a013 | ||
| 14660391 | 199053 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 272 | 5 | 3 | 2 | 2.2 | N=C(N)NCCC(c1ccc(F)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL58620 | 199053 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 272 | 5 | 3 | 2 | 2.2 | N=C(N)NCCC(c1ccc(F)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 25149429 | 185964 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 305 | 6 | 4 | 3 | 2.2 | CC(C(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1021/jm800841w | ||
| CHEMBL486964 | 185964 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 305 | 6 | 4 | 3 | 2.2 | CC(C(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1021/jm800841w | ||
| 25149814 | 185324 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 291 | 6 | 4 | 3 | 2.0 | N=C(NCCCc1c[nH]cn1)NC(=O)CC1CCCCC1 | 10.1021/jm800841w | ||
| CHEMBL485958 | 185324 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 291 | 6 | 4 | 3 | 2.0 | N=C(NCCCc1c[nH]cn1)NC(=O)CC1CCCCC1 | 10.1021/jm800841w | ||
| 10022429 | 162789 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 376 | 10 | 4 | 3 | 3.5 | N=C(NCCCc1c[nH]cn1)NCCCC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL417221 | 162789 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 376 | 10 | 4 | 3 | 3.5 | N=C(NCCCc1c[nH]cn1)NCCCC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 11276413 | 12071 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 236 | 7 | 1 | 2 | 3.3 | c1nc(CCCOCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL1183700 | 12071 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 236 | 7 | 1 | 2 | 3.3 | c1nc(CCCOCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL313803 | 12071 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 236 | 7 | 1 | 2 | 3.3 | c1nc(CCCOCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| 54710792 | 126417 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 429 | 5 | 1 | 7 | 3.4 | O=c1oc2cc(CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| CHEMBL36517 | 126417 | 0 | None | - | 0 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 429 | 5 | 1 | 7 | 3.4 | O=c1oc2cc(CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| 2861271 | 4254 | 9 | None | - | 1 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1ccc(Cl)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL100486 | 4254 | 9 | None | - | 1 | Guinea pig | 5.6 | pKd | = | 5.6 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1ccc(Cl)cc1 | 10.1021/jm00093a025 | ||
| 10729993 | 11408 | 1 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 259 | 6 | 2 | 4 | 2.6 | C/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL114085 | 11408 | 1 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 259 | 6 | 2 | 4 | 2.6 | C/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL1180120 | 11408 | 1 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 259 | 6 | 2 | 4 | 2.6 | C/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 10492497 | 12374 | 0 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 273 | 7 | 2 | 4 | 3.0 | CC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL1185539 | 12374 | 0 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 273 | 7 | 2 | 4 | 3.0 | CC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL420124 | 12374 | 0 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 273 | 7 | 2 | 4 | 3.0 | CC/C(=N\O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 44274554 | 83293 | 0 | None | - | 0 | Guinea pig | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 726 | 17 | 4 | 9 | 7.3 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc(=N)cc-4oc4cc(N)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21898 | 83293 | 0 | None | - | 0 | Guinea pig | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 726 | 17 | 4 | 9 | 7.3 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc(=N)cc-4oc4cc(N)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 44457689 | 94149 | 0 | None | - | 0 | Guinea pig | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 728 | 17 | 3 | 9 | 7.3 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL24940 | 94149 | 0 | None | - | 0 | Guinea pig | 7.6 | pKd | = | 7.6 | Functional | ChEMBL | 728 | 17 | 3 | 9 | 7.3 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 14660350 | 199443 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 392 | 10 | 3 | 4 | 2.9 | COc1ccc(C(CC/N=C(\N)NCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1021/jm00128a045 | ||
| CHEMBL59138 | 199443 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 392 | 10 | 3 | 4 | 2.9 | COc1ccc(C(CC/N=C(\N)NCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1021/jm00128a045 | ||
| 164435 | 204542 | 32 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 477 | 11 | 4 | 6 | 2.5 | N#CN/C(=N\CCNC(=O)c1ccc(N)cc1)NCCCOc1cccc(CN2CCCCC2)c1 | 10.1021/jm00090a013 | ||
| CHEMBL72844 | 204542 | 32 | None | - | 0 | Guinea pig | 4.6 | pKd | = | 4.6 | Functional | ChEMBL | 477 | 11 | 4 | 6 | 2.5 | N#CN/C(=N\CCNC(=O)c1ccc(N)cc1)NCCCOc1cccc(CN2CCCCC2)c1 | 10.1021/jm00090a013 | ||
| 3081064 | 200435 | 12 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 398 | 9 | 4 | 3 | 3.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1cc(F)cc(F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL59832 | 200435 | 12 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 398 | 9 | 4 | 3 | 3.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1cc(F)cc(F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 14660355 | 100545 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(C(F)(F)F)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL291396 | 100545 | 0 | None | - | 0 | Guinea pig | 6.6 | pKd | = | 6.6 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(C(F)(F)F)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 14660372 | 199231 | 0 | None | - | 0 | Guinea pig | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccc(Cl)cc1Cl | 10.1021/jm00128a045 | ||
| CHEMBL58999 | 199231 | 0 | None | - | 0 | Guinea pig | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccc(Cl)cc1Cl | 10.1021/jm00128a045 | ||
| 11741669 | 96753 | 0 | None | 39 | 2 | Guinea pig | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| CHEMBL264491 | 96753 | 0 | None | 39 | 2 | Guinea pig | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| 11269875 | 121004 | 0 | None | - | 1 | Guinea pig | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| CHEMBL356449 | 121004 | 0 | None | - | 1 | Guinea pig | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| 44274585 | 82302 | 0 | None | - | 0 | Guinea pig | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 756 | 19 | 3 | 9 | 8.1 | COc1ccc(CN(CCN(C)CCCCCCCCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21721 | 82302 | 0 | None | - | 0 | Guinea pig | 8.5 | pKd | = | 8.5 | Functional | ChEMBL | 756 | 19 | 3 | 9 | 8.1 | COc1ccc(CN(CCN(C)CCCCCCCCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 25190134 | 161144 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 404 | 9 | 0 | 5 | 3.9 | CCCCc1cc(OC2CCN(CCS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4085417 | 161144 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 404 | 9 | 0 | 5 | 3.9 | CCCCc1cc(OC2CCN(CCS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| CHEMBL4117296 | 161144 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 404 | 9 | 0 | 5 | 3.9 | CCCCc1cc(OC2CCN(CCS(=O)(=O)CC)CC2)c2ncccc2c1 | 10.1016/j.bmcl.2017.09.020 | ||
| 2247 | 505 | 81 | None | - | 42 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | ||
| 249 | 505 | 81 | None | - | 42 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | ||
| 2603 | 505 | 81 | None | - | 42 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL296419 | 505 | 81 | None | - | 42 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | ||
| DB00637 | 505 | 81 | None | - | 42 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | ||
| 57393730 | 67884 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 579 | 8 | 2 | 6 | 5.0 | O=C(c1cc2ccccc2[nH]1)N1CCN(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)CC1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910386 | 67884 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 579 | 8 | 2 | 6 | 5.0 | O=C(c1cc2ccccc2[nH]1)N1CCN(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)CC1 | 10.1016/j.bmcl.2011.09.001 | ||
| 71456361 | 80479 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 369 | 4 | 0 | 6 | 2.5 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2nccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146812 | 80479 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 369 | 4 | 0 | 6 | 2.5 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2nccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 24803639 | 61331 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 622 | 14 | 1 | 7 | 6.8 | O=c1c2ccccc2c(Cc2ccc(O)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767166 | 61331 | 0 | None | - | 0 | Human | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 622 | 14 | 1 | 7 | 6.8 | O=c1c2ccccc2c(Cc2ccc(O)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 13676696 | 164073 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 467 | 7 | 1 | 8 | 4.0 | Cc1c(OCCCN2CCN(Cc3cccc(Cl)c3)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| CHEMBL420934 | 164073 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 467 | 7 | 1 | 8 | 4.0 | Cc1c(OCCCN2CCN(Cc3cccc(Cl)c3)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| 13676697 | 204794 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 467 | 7 | 1 | 8 | 4.0 | Cc1c(OCCCN2CCN(Cc3ccccc3Cl)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| CHEMBL74989 | 204794 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 467 | 7 | 1 | 8 | 4.0 | Cc1c(OCCCN2CCN(Cc3ccccc3Cl)CC2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| 54710795 | 99897 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 531 | 10 | 2 | 9 | 3.6 | CCCc1c(OCC(O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc2c(O)c([N+](=O)[O-])c(=O)oc12 | 10.1021/jm00377a013 | ||
| CHEMBL286017 | 99897 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 531 | 10 | 2 | 9 | 3.6 | CCCc1c(OCC(O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc2c(O)c([N+](=O)[O-])c(=O)oc12 | 10.1021/jm00377a013 | ||
| 42625223 | 179925 | 0 | None | - | 3 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 395 | 8 | 4 | 3 | 1.4 | CN(CCC(=O)/N=C(\N)NCCCc1c[nH]cn1)C(=O)c1cc2ccccc2[nH]1 | 10.1021/jm9000693 | ||
| CHEMBL474617 | 179925 | 0 | None | - | 3 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 395 | 8 | 4 | 3 | 1.4 | CN(CCC(=O)/N=C(\N)NCCCc1c[nH]cn1)C(=O)c1cc2ccccc2[nH]1 | 10.1021/jm9000693 | ||
| 44274584 | 80684 | 0 | None | - | 0 | Guinea pig | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 700 | 15 | 3 | 9 | 6.5 | COc1ccc(CN(CCN(C)CCCCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21514 | 80684 | 0 | None | - | 0 | Guinea pig | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 700 | 15 | 3 | 9 | 6.5 | COc1ccc(CN(CCN(C)CCCCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 44274555 | 77008 | 0 | None | - | 0 | Guinea pig | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 782 | 18 | 1 | 9 | 6.0 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc(=[N+](C)C)cc-4oc4cc(N(C)C)ccc34)c(C(=O)[O-])c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL20713 | 77008 | 0 | None | - | 0 | Guinea pig | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 782 | 18 | 1 | 9 | 6.0 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc(=[N+](C)C)cc-4oc4cc(N(C)C)ccc34)c(C(=O)[O-])c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 14660378 | 100647 | 0 | None | - | 0 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 348 | 8 | 4 | 3 | 2.7 | N=C(NCCCc1c[nH]cn1)NCC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL292170 | 100647 | 0 | None | - | 0 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 348 | 8 | 4 | 3 | 2.7 | N=C(NCCCc1c[nH]cn1)NCC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 1226 | 2019 | 20 | None | - | 1 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 321 | 9 | 4 | 4 | 1.2 | NC(=NCCCc1cnc[nH]1)NCCSCc1nc[nH]c1C | 10.1021/jm800841w | ||
| 41376 | 2019 | 20 | None | - | 1 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 321 | 9 | 4 | 4 | 1.2 | NC(=NCCCc1cnc[nH]1)NCCSCc1nc[nH]c1C | 10.1021/jm800841w | ||
| CHEMBL12608 | 2019 | 20 | None | - | 1 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 321 | 9 | 4 | 4 | 1.2 | NC(=NCCCc1cnc[nH]1)NCCSCc1nc[nH]c1C | 10.1021/jm800841w | ||
| 14660384 | 202733 | 0 | None | - | 0 | Guinea pig | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 379 | 9 | 4 | 2 | 3.8 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccc(F)cc1 | 10.1021/jm00128a045 | ||
| CHEMBL61852 | 202733 | 0 | None | - | 0 | Guinea pig | 7.5 | pKd | = | 7.5 | Functional | ChEMBL | 379 | 9 | 4 | 2 | 3.8 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccc(F)cc1 | 10.1021/jm00128a045 | ||
| 14660395 | 202781 | 0 | None | - | 0 | Guinea pig | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 378 | 8 | 4 | 3 | 3.1 | N=C(NC/C=C(\c1ccc(F)cc1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| CHEMBL62147 | 202781 | 0 | None | - | 0 | Guinea pig | 6.5 | pKd | = | 6.5 | Functional | ChEMBL | 378 | 8 | 4 | 3 | 3.1 | N=C(NC/C=C(\c1ccc(F)cc1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| 42625386 | 178353 | 0 | None | - | 4 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 237 | 6 | 3 | 2 | 0.6 | CCCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| CHEMBL465170 | 178353 | 0 | None | - | 4 | Guinea pig | 5.5 | pKd | = | 5.5 | Functional | ChEMBL | 237 | 6 | 3 | 2 | 0.6 | CCCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| 44274553 | 82399 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 828 | 17 | 3 | 9 | 9.7 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc5cc(O)ccc5c4oc4c3ccc3cc(=O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21727 | 82399 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 828 | 17 | 3 | 9 | 9.7 | COc1ccc(CN(CCN(C)CCCCCCNC(=O)c2ccc(-c3c4ccc5cc(O)ccc5c4oc4c3ccc3cc(=O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 14660382 | 198660 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccncc1)c1ccc(F)cc1 | 10.1021/jm00128a045 | ||
| CHEMBL57933 | 198660 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccncc1)c1ccc(F)cc1 | 10.1021/jm00128a045 | ||
| 1199 | 2976 | 0 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 394 | 8 | 3 | 4 | 2.5 | NC(=NCCCc1[nH]cnc1)NC(=O)CC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm800841w | ||
| 25149244 | 2976 | 0 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 394 | 8 | 3 | 4 | 2.5 | NC(=NCCCc1[nH]cnc1)NC(=O)CC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm800841w | ||
| CHEMBL472273 | 2976 | 0 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 394 | 8 | 3 | 4 | 2.5 | NC(=NCCCc1[nH]cnc1)NC(=O)CC(c1ccccn1)c1ccc(cc1)F | 10.1021/jm800841w | ||
| 42626109 | 179768 | 0 | None | - | 2 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 324 | 6 | 4 | 2 | 1.5 | N/C(=N\C(=O)Cc1c[nH]c2ccccc12)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| CHEMBL474447 | 179768 | 0 | None | - | 2 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 324 | 6 | 4 | 2 | 1.5 | N/C(=N\C(=O)Cc1c[nH]c2ccccc12)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| 14660376 | 202568 | 0 | None | - | 0 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 363 | 9 | 4 | 4 | 2.5 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL61185 | 202568 | 0 | None | - | 0 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 363 | 9 | 4 | 4 | 2.5 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 2861590 | 107260 | 7 | None | - | 1 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1ccc(Br)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202937 | 107260 | 7 | None | - | 1 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1ccc(Br)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL316951 | 107260 | 7 | None | - | 1 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1ccc(Br)cc1 | 10.1021/jm00093a025 | ||
| 126624 | 208290 | 10 | None | - | 1 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 264 | 5 | 0 | 3 | 2.2 | CN(C)CCCN1C(=O)CSC1c1ccccc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202936 | 208290 | 10 | None | - | 1 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 264 | 5 | 0 | 3 | 2.2 | CN(C)CCCN1C(=O)CSC1c1ccccc1 | 10.1021/jm00093a025 | ||
| CHEMBL98989 | 208290 | 10 | None | - | 1 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 264 | 5 | 0 | 3 | 2.2 | CN(C)CCCN1C(=O)CSC1c1ccccc1 | 10.1021/jm00093a025 | ||
| 42625221 | 189588 | 0 | None | - | 2 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 338 | 7 | 4 | 2 | 1.9 | N/C(=N\C(=O)CCc1c[nH]c2ccccc12)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| CHEMBL514641 | 189588 | 0 | None | - | 2 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 338 | 7 | 4 | 2 | 1.9 | N/C(=N\C(=O)CCc1c[nH]c2ccccc12)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| 14984033 | 208178 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202941 | 208178 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| CHEMBL98334 | 208178 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 294 | 6 | 0 | 4 | 2.2 | COc1cccc(C2SCC(=O)N2CCCN(C)C)c1 | 10.1021/jm00093a025 | ||
| 14984032 | 208341 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1cccc(Br)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202932 | 208341 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1cccc(Br)c1 | 10.1021/jm00093a025 | ||
| CHEMBL99350 | 208341 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 342 | 5 | 0 | 3 | 3.0 | CN(C)CCCN1C(=O)CSC1c1cccc(Br)c1 | 10.1021/jm00093a025 | ||
| 14984031 | 208373 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1cccc(F)c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202933 | 208373 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1cccc(F)c1 | 10.1021/jm00093a025 | ||
| CHEMBL99529 | 208373 | 1 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1cccc(F)c1 | 10.1021/jm00093a025 | ||
| 2861786 | 208177 | 8 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 309 | 6 | 0 | 5 | 2.1 | CN(C)CCCN1C(=O)CSC1c1cccc([N+](=O)[O-])c1 | 10.1021/jm00093a025 | ||
| CHEMBL1202940 | 208177 | 8 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 309 | 6 | 0 | 5 | 2.1 | CN(C)CCCN1C(=O)CSC1c1cccc([N+](=O)[O-])c1 | 10.1021/jm00093a025 | ||
| CHEMBL98333 | 208177 | 8 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 309 | 6 | 0 | 5 | 2.1 | CN(C)CCCN1C(=O)CSC1c1cccc([N+](=O)[O-])c1 | 10.1021/jm00093a025 | ||
| 10364258 | 45769 | 0 | None | 12 | 2 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| CHEMBL153067 | 45769 | 0 | None | 12 | 2 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| 44274569 | 80841 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 700 | 15 | 3 | 9 | 6.5 | COc1ccc(CN(CCN(C)CCCCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21525 | 80841 | 0 | None | - | 0 | Guinea pig | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 700 | 15 | 3 | 9 | 6.5 | COc1ccc(CN(CCN(C)CCCCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 44274548 | 99186 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 477 | 12 | 1 | 10 | 3.6 | COc1ccc(CN(CCN(C)CCNc2ccc([N+](=O)[O-])c3nonc23)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL281365 | 99186 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 477 | 12 | 1 | 10 | 3.6 | COc1ccc(CN(CCN(C)CCNc2ccc([N+](=O)[O-])c3nonc23)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 57402472 | 67879 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 526 | 11 | 1 | 6 | 4.0 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910381 | 67879 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 526 | 11 | 1 | 6 | 4.0 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| 1200 | 3963 | 2 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 335 | 8 | 4 | 5 | 0.7 | O=C(NC(=NCCCc1cnc[nH]1)N)CSCc1nc[nH]c1C | 10.1021/jm800841w | ||
| 25149519 | 3963 | 2 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 335 | 8 | 4 | 5 | 0.7 | O=C(NC(=NCCCc1cnc[nH]1)N)CSCc1nc[nH]c1C | 10.1021/jm800841w | ||
| CHEMBL513056 | 3963 | 2 | None | - | 0 | Guinea pig | 5.4 | pKd | = | 5.4 | Functional | ChEMBL | 335 | 8 | 4 | 5 | 0.7 | O=C(NC(=NCCCc1cnc[nH]1)N)CSCc1nc[nH]c1C | 10.1021/jm800841w | ||
| 14660370 | 163245 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1cc(Cl)cc(Cl)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL418508 | 163245 | 0 | None | - | 0 | Guinea pig | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1cc(Cl)cc(Cl)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 14660363 | 202678 | 0 | None | - | 0 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccccc1F | 10.1021/jm00128a045 | ||
| CHEMBL61523 | 202678 | 0 | None | - | 0 | Guinea pig | 6.4 | pKd | = | 6.4 | Functional | ChEMBL | 380 | 9 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccccc1F | 10.1021/jm00128a045 | ||
| 14660411 | 199714 | 0 | None | - | 0 | Guinea pig | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 368 | 9 | 4 | 4 | 3.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1cccs1 | 10.1021/jm00128a045 | ||
| CHEMBL59339 | 199714 | 0 | None | - | 0 | Guinea pig | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 368 | 9 | 4 | 4 | 3.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1cccs1 | 10.1021/jm00128a045 | ||
| 14660345 | 199093 | 0 | None | - | 0 | Guinea pig | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 394 | 10 | 4 | 3 | 3.6 | N=C(NCCCc1c[nH]cn1)NCCCC(c1ccc(F)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL58869 | 199093 | 0 | None | - | 0 | Guinea pig | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | 394 | 10 | 4 | 3 | 3.6 | N=C(NCCCc1c[nH]cn1)NCCCC(c1ccc(F)cc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 25149613 | 179200 | 0 | None | - | 2 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 382 | 8 | 4 | 5 | 2.7 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccccc1)c1nccs1 | 10.1021/jm800841w | ||
| CHEMBL472441 | 179200 | 0 | None | - | 2 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 382 | 8 | 4 | 5 | 2.7 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccccc1)c1nccs1 | 10.1021/jm800841w | ||
| 25149246 | 189476 | 0 | None | - | 0 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 418 | 8 | 4 | 5 | 2.9 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccc(F)c(F)c1)c1nccs1 | 10.1021/jm800841w | ||
| CHEMBL513755 | 189476 | 0 | None | - | 0 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 418 | 8 | 4 | 5 | 2.9 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccc(F)c(F)c1)c1nccs1 | 10.1021/jm800841w | ||
| 54587323 | 63116 | 0 | None | - | 1 | Guinea pig | 4.3 | pKd | = | 4.3 | Functional | ChEMBL | 277 | 7 | 2 | 3 | 3.0 | O=C(NCCC1=CCCCC1)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1774596 | 63116 | 0 | None | - | 1 | Guinea pig | 4.3 | pKd | = | 4.3 | Functional | ChEMBL | 277 | 7 | 2 | 3 | 3.0 | O=C(NCCC1=CCCCC1)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1789341 | 63116 | 0 | None | - | 1 | Guinea pig | 4.3 | pKd | = | 4.3 | Functional | ChEMBL | 277 | 7 | 2 | 3 | 3.0 | O=C(NCCC1=CCCCC1)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| 134136763 | 142848 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 500 | 11 | 0 | 5 | 6.0 | c1cnc2c(N3CCN(CCCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3893197 | 142848 | 0 | None | - | 0 | Human | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 500 | 11 | 0 | 5 | 6.0 | c1cnc2c(N3CCN(CCCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 54710793 | 108821 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 489 | 8 | 2 | 9 | 2.6 | O=c1oc2cc(OCC(O)CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| CHEMBL32097 | 108821 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 489 | 8 | 2 | 9 | 2.6 | O=c1oc2cc(OCC(O)CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc2c(O)c1[N+](=O)[O-] | 10.1021/jm00377a013 | ||
| 44274583 | 98727 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 756 | 19 | 3 | 9 | 8.1 | COc1ccc(CN(CCN(C)CCCCCCCCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL277850 | 98727 | 0 | None | - | 0 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 756 | 19 | 3 | 9 | 8.1 | COc1ccc(CN(CCN(C)CCCCCCCCNC(=O)c2ccc(C(=O)O)c(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 4440380 | 4255 | 3 | None | - | 1 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL100487 | 4255 | 3 | None | - | 1 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202938 | 4255 | 3 | None | - | 1 | Guinea pig | 8.3 | pKd | = | 8.3 | Functional | ChEMBL | 278 | 5 | 0 | 3 | 2.5 | Cc1ccc(C2SCC(=O)N2CCCN(C)C)cc1 | 10.1021/jm00093a025 | ||
| 11791817 | 98303 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| CHEMBL274831 | 98303 | 0 | None | -1 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 345 | 9 | 2 | 2 | 4.5 | c1ccc(C(CCc2nc(CCNC3CC3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm991056a | ||
| 10083274 | 11394 | 0 | None | - | 0 | Guinea pig | 4.3 | pKd | = | 4.3 | Functional | ChEMBL | 246 | 6 | 2 | 3 | 2.5 | CC(O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL112676 | 11394 | 0 | None | - | 0 | Guinea pig | 4.3 | pKd | = | 4.3 | Functional | ChEMBL | 246 | 6 | 2 | 3 | 2.5 | CC(O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL1180069 | 11394 | 0 | None | - | 0 | Guinea pig | 4.3 | pKd | = | 4.3 | Functional | ChEMBL | 246 | 6 | 2 | 3 | 2.5 | CC(O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 14660365 | 199987 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 396 | 9 | 4 | 3 | 3.7 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccccc1Cl | 10.1021/jm00128a045 | ||
| CHEMBL59521 | 199987 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 396 | 9 | 4 | 3 | 3.7 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccn1)c1ccccc1Cl | 10.1021/jm00128a045 | ||
| 42625303 | 180766 | 0 | None | - | 6 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 223 | 5 | 3 | 2 | 0.2 | CCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| CHEMBL475621 | 180766 | 0 | None | - | 6 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 223 | 5 | 3 | 2 | 0.2 | CCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| 25149431 | 185437 | 0 | None | - | 0 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 277 | 5 | 4 | 3 | 1.6 | N=C(NCCCc1c[nH]cn1)NC(=O)C1CCCCC1 | 10.1021/jm800841w | ||
| CHEMBL486153 | 185437 | 0 | None | - | 0 | Guinea pig | 5.3 | pKd | = | 5.3 | Functional | ChEMBL | 277 | 5 | 4 | 3 | 1.6 | N=C(NCCCc1c[nH]cn1)NC(=O)C1CCCCC1 | 10.1021/jm800841w | ||
| 14660361 | 201502 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1cccc(C(F)(F)F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL60515 | 201502 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1cccc(C(F)(F)F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 25149811 | 185962 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 327 | 9 | 4 | 3 | 2.4 | N=C(NCCCc1c[nH]cn1)NC(=O)CCCCc1ccccc1 | 10.1021/jm800841w | ||
| CHEMBL486963 | 185962 | 0 | None | - | 0 | Guinea pig | 6.3 | pKd | = | 6.3 | Functional | ChEMBL | 327 | 9 | 4 | 3 | 2.4 | N=C(NCCCc1c[nH]cn1)NC(=O)CCCCc1ccccc1 | 10.1021/jm800841w | ||
| 25149425 | 188206 | 0 | None | - | 0 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 285 | 6 | 4 | 3 | 1.2 | N=C(NCCCc1c[nH]cn1)NC(=O)Cc1ccccc1 | 10.1021/jm800841w | ||
| CHEMBL499092 | 188206 | 0 | None | - | 0 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 285 | 6 | 4 | 3 | 1.2 | N=C(NCCCc1c[nH]cn1)NC(=O)Cc1ccccc1 | 10.1021/jm800841w | ||
| 10410901 | 119747 | 0 | None | -23 | 2 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| CHEMBL347796 | 119747 | 0 | None | -23 | 2 | Rat | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| 23582308 | 145864 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 634 | 14 | 1 | 6 | 6.9 | O=C(O)CCc1ccc2cc(Cc3ccccc3)cc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3917428 | 145864 | 0 | None | - | 0 | Human | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 634 | 14 | 1 | 6 | 6.9 | O=C(O)CCc1ccc2cc(Cc3ccccc3)cc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| 153224 | 202827 | 27 | None | - | 0 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 271 | 7 | 1 | 4 | 2.3 | CNCCN(Cc1ccc(OC)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL624 | 202827 | 27 | None | - | 0 | Guinea pig | 8.2 | pKd | = | 8.2 | Functional | ChEMBL | 271 | 7 | 1 | 4 | 2.3 | CNCCN(Cc1ccc(OC)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00113-6 | ||
| 25149433 | 185976 | 3 | None | - | 0 | Guinea pig | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 305 | 7 | 4 | 3 | 2.3 | N=C(NCCCc1c[nH]cn1)NC(=O)CCC1CCCCC1 | 10.1021/jm800841w | ||
| CHEMBL486974 | 185976 | 3 | None | - | 0 | Guinea pig | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 305 | 7 | 4 | 3 | 2.3 | N=C(NCCCc1c[nH]cn1)NC(=O)CCC1CCCCC1 | 10.1021/jm800841w | ||
| 13676693 | 103001 | 0 | None | - | 0 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 463 | 8 | 1 | 9 | 3.3 | COc1ccc(CN2CCN(CCCOc3ccc4c(O)c5nnnc-5oc4c3C)CC2)cc1 | 10.1021/jm00161a022 | ||
| CHEMBL306807 | 103001 | 0 | None | - | 0 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 463 | 8 | 1 | 9 | 3.3 | COc1ccc(CN2CCN(CCCOc3ccc4c(O)c5nnnc-5oc4c3C)CC2)cc1 | 10.1021/jm00161a022 | ||
| 2860026 | 108376 | 7 | None | - | 1 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1cccc(Cl)c1 | 10.1021/jm00093a025 | ||
| CHEMBL319829 | 108376 | 7 | None | - | 1 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 298 | 5 | 0 | 3 | 2.9 | CN(C)CCCN1C(=O)CSC1c1cccc(Cl)c1 | 10.1021/jm00093a025 | ||
| 2861042 | 111583 | 8 | None | - | 0 | Guinea pig | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 309 | 6 | 0 | 5 | 2.1 | CN(C)CCCN1C(=O)CSC1c1ccc([N+](=O)[O-])cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202943 | 111583 | 8 | None | - | 0 | Guinea pig | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 309 | 6 | 0 | 5 | 2.1 | CN(C)CCCN1C(=O)CSC1c1ccc([N+](=O)[O-])cc1 | 10.1021/jm00093a025 | ||
| CHEMBL328201 | 111583 | 8 | None | - | 0 | Guinea pig | 5.2 | pKd | = | 5.2 | Functional | ChEMBL | 309 | 6 | 0 | 5 | 2.1 | CN(C)CCCN1C(=O)CSC1c1ccc([N+](=O)[O-])cc1 | 10.1021/jm00093a025 | ||
| 11356502 | 11338 | 0 | None | - | 0 | Guinea pig | 4.2 | pKd | = | 4.2 | Functional | ChEMBL | 222 | 6 | 1 | 2 | 3.3 | c1nc(COCCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL1179596 | 11338 | 0 | None | - | 0 | Guinea pig | 4.2 | pKd | = | 4.2 | Functional | ChEMBL | 222 | 6 | 1 | 2 | 3.3 | c1nc(COCCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL88362 | 11338 | 0 | None | - | 0 | Guinea pig | 4.2 | pKd | = | 4.2 | Functional | ChEMBL | 222 | 6 | 1 | 2 | 3.3 | c1nc(COCCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| 14660412 | 202206 | 0 | None | - | 0 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 378 | 9 | 4 | 4 | 2.6 | N/C(=N\CCC(c1ccc(O)cc1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| CHEMBL60972 | 202206 | 0 | None | - | 0 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 378 | 9 | 4 | 4 | 2.6 | N/C(=N\CCC(c1ccc(O)cc1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| 44457674 | 84311 | 0 | None | - | 0 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 672 | 13 | 3 | 9 | 5.7 | COc1ccc(CN(CCN(C)CCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL22152 | 84311 | 0 | None | - | 0 | Guinea pig | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 672 | 13 | 3 | 9 | 5.7 | COc1ccc(CN(CCN(C)CCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 57391869 | 63120 | 0 | None | - | 1 | Guinea pig | 4.2 | pKd | = | 4.2 | Functional | ChEMBL | 223 | 6 | 2 | 3 | 1.6 | CC=CCNC(=O)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1774589 | 63120 | 0 | None | - | 1 | Guinea pig | 4.2 | pKd | = | 4.2 | Functional | ChEMBL | 223 | 6 | 2 | 3 | 1.6 | CC=CCNC(=O)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1789349 | 63120 | 0 | None | - | 1 | Guinea pig | 4.2 | pKd | = | 4.2 | Functional | ChEMBL | 223 | 6 | 2 | 3 | 1.6 | CC=CCNC(=O)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| 57400700 | 67878 | 0 | None | - | 0 | Guinea pig | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 470 | 8 | 1 | 6 | 3.4 | COc1ccc(CN(CCN2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910380 | 67878 | 0 | None | - | 0 | Guinea pig | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 470 | 8 | 1 | 6 | 3.4 | COc1ccc(CN(CCN2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| 57397301 | 67880 | 0 | None | - | 0 | Guinea pig | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 560 | 11 | 1 | 6 | 4.6 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910382 | 67880 | 0 | None | - | 0 | Guinea pig | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 560 | 11 | 1 | 6 | 4.6 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| 145961372 | 161607 | 0 | None | - | 1 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 311 | 7 | 0 | 2 | 5.3 | c1ccc2c(OCCCCCN3CCCCCC3)cccc2c1 | 10.1016/j.bmc.2018.04.023 | ||
| CHEMBL4129589 | 161607 | 0 | None | - | 1 | Guinea pig | 6.2 | pKd | = | 6.2 | Functional | ChEMBL | 311 | 7 | 0 | 2 | 5.3 | c1ccc2c(OCCCCCN3CCCCCC3)cccc2c1 | 10.1016/j.bmc.2018.04.023 | ||
| 2200 | 20203 | 61 | None | - | 12 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2018.04.023 | ||
| CHEMBL1256819 | 20203 | 61 | None | - | 12 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2018.04.023 | ||
| CHEMBL1305 | 20203 | 61 | None | - | 12 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2018.04.023 | ||
| 42625224 | 180764 | 0 | None | - | 1 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 395 | 9 | 5 | 3 | 1.5 | N/C(=N\C(=O)CCCNC(=O)c1cc2ccccc2[nH]1)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| CHEMBL475620 | 180764 | 0 | None | - | 1 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 395 | 9 | 5 | 3 | 1.5 | N/C(=N\C(=O)CCCNC(=O)c1cc2ccccc2[nH]1)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| 25149521 | 179052 | 0 | None | - | 2 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 375 | 8 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccccc1)c1ccccc1 | 10.1021/jm800841w | ||
| CHEMBL471413 | 179052 | 0 | None | - | 2 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 375 | 8 | 4 | 3 | 3.2 | N=C(NCCCc1c[nH]cn1)NC(=O)CC(c1ccccc1)c1ccccc1 | 10.1021/jm800841w | ||
| 25149515 | 185830 | 0 | None | - | 0 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 319 | 8 | 4 | 3 | 2.7 | N=C(NCCCc1c[nH]cn1)NC(=O)CCCC1CCCCC1 | 10.1021/jm800841w | ||
| CHEMBL486746 | 185830 | 0 | None | - | 0 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 319 | 8 | 4 | 3 | 2.7 | N=C(NCCCc1c[nH]cn1)NC(=O)CCCC1CCCCC1 | 10.1021/jm800841w | ||
| 1219 | 737 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 396 | 9 | 3 | 3 | 3.5 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)Cl | 10.1021/jm00128a045 | ||
| 14660352 | 737 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 396 | 9 | 3 | 3 | 3.5 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)Cl | 10.1021/jm00128a045 | ||
| CHEMBL304239 | 737 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 396 | 9 | 3 | 3 | 3.5 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)Cl | 10.1021/jm00128a045 | ||
| 42625304 | 179100 | 0 | None | - | 4 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 237 | 5 | 3 | 2 | 0.4 | CC(C)C(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| CHEMBL471724 | 179100 | 0 | None | - | 4 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 237 | 5 | 3 | 2 | 0.4 | CC(C)C(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| 10094258 | 199070 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(Cl)c(Cl)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL58740 | 199070 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 430 | 9 | 4 | 3 | 4.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(Cl)c(Cl)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 13676703 | 204605 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 469 | 10 | 1 | 8 | 4.2 | Cc1c(OCCCN(C)CCN(C)Cc2ccc(Cl)cc2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| CHEMBL73265 | 204605 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 469 | 10 | 1 | 8 | 4.2 | Cc1c(OCCCN(C)CCN(C)Cc2ccc(Cl)cc2)ccc2c(O)c3nnnc-3oc12 | 10.1021/jm00161a022 | ||
| 2872050 | 208226 | 3 | None | - | 1 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1ccc(F)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL1202939 | 208226 | 3 | None | - | 1 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1ccc(F)cc1 | 10.1021/jm00093a025 | ||
| CHEMBL98605 | 208226 | 3 | None | - | 1 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 282 | 5 | 0 | 3 | 2.4 | CN(C)CCCN1C(=O)CSC1c1ccc(F)cc1 | 10.1021/jm00093a025 | ||
| 11345716 | 11344 | 0 | None | - | 0 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 250 | 8 | 1 | 2 | 3.7 | c1nc(CCCOCCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL1179627 | 11344 | 0 | None | - | 0 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 250 | 8 | 1 | 2 | 3.7 | c1nc(CCCOCCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| CHEMBL89999 | 11344 | 0 | None | - | 0 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 250 | 8 | 1 | 2 | 3.7 | c1nc(CCCOCCCC2CCCCC2)c[nH]1 | 10.1021/jm031065q | ||
| 11413171 | 12110 | 0 | None | - | 1 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 210 | 9 | 1 | 2 | 2.9 | CCCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| CHEMBL1184057 | 12110 | 0 | None | - | 1 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 210 | 9 | 1 | 2 | 2.9 | CCCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| CHEMBL330688 | 12110 | 0 | None | - | 1 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 210 | 9 | 1 | 2 | 2.9 | CCCCCCOCCCc1c[nH]cn1 | 10.1021/jm031065q | ||
| 54584376 | 63168 | 0 | None | - | 1 | Guinea pig | 4.1 | pKd | = | 4.1 | Functional | ChEMBL | 237 | 7 | 2 | 3 | 2.0 | CC/C=C\CNC(=O)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1774592 | 63168 | 0 | None | - | 1 | Guinea pig | 4.1 | pKd | = | 4.1 | Functional | ChEMBL | 237 | 7 | 2 | 3 | 2.0 | CC/C=C\CNC(=O)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| CHEMBL1789809 | 63168 | 0 | None | - | 1 | Guinea pig | 4.1 | pKd | = | 4.1 | Functional | ChEMBL | 237 | 7 | 2 | 3 | 2.0 | CC/C=C\CNC(=O)OCCCc1c[nH]cn1 | 10.1016/j.bmc.2011.03.046 | ||
| 10635074 | 11404 | 0 | None | - | 0 | Guinea pig | 4.1 | pKd | = | 4.1 | Functional | ChEMBL | 260 | 6 | 3 | 4 | 1.0 | NNC(=O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL113404 | 11404 | 0 | None | - | 0 | Guinea pig | 4.1 | pKd | = | 4.1 | Functional | ChEMBL | 260 | 6 | 3 | 4 | 1.0 | NNC(=O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| CHEMBL1180094 | 11404 | 0 | None | - | 0 | Guinea pig | 4.1 | pKd | = | 4.1 | Functional | ChEMBL | 260 | 6 | 3 | 4 | 1.0 | NNC(=O)c1ccc(OCCCc2c[nH]cn2)cc1 | 10.1021/jm000971p | ||
| 57390225 | 67882 | 0 | None | - | 0 | Guinea pig | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 469 | 9 | 2 | 5 | 4.1 | COc1ccc(CN(CCN[C@H]2CCN(C(=O)c3cc4ccccc4[nH]3)C2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| CHEMBL1910384 | 67882 | 0 | None | - | 0 | Guinea pig | 8.1 | pKd | = | 8.1 | Functional | ChEMBL | 469 | 9 | 2 | 5 | 4.1 | COc1ccc(CN(CCN[C@H]2CCN(C(=O)c3cc4ccccc4[nH]3)C2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | ||
| 10246247 | 98293 | 0 | None | - | 0 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.5 | NCCc1c[nH]c(CCCCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| CHEMBL274767 | 98293 | 0 | None | - | 0 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 333 | 9 | 2 | 2 | 4.5 | NCCc1c[nH]c(CCCCC(c2ccccc2)c2ccccc2)n1 | 10.1021/jm991056a | ||
| 3081063 | 201509 | 22 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 398 | 9 | 4 | 3 | 3.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(F)c(F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL60519 | 201509 | 22 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 398 | 9 | 4 | 3 | 3.4 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccc(F)c(F)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 14660416 | 200729 | 1 | None | - | 0 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 377 | 9 | 4 | 4 | 2.4 | N/C(=N\CCC(c1cccc(N)c1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| CHEMBL60006 | 200729 | 1 | None | - | 0 | Guinea pig | 6.1 | pKd | = | 6.1 | Functional | ChEMBL | 377 | 9 | 4 | 4 | 2.4 | N/C(=N\CCC(c1cccc(N)c1)c1ccccn1)NCCCc1c[nH]cn1 | 10.1021/jm00128a045 | ||
| 42625384 | 169773 | 0 | None | - | 4 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 209 | 4 | 3 | 2 | -0.2 | CC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| CHEMBL443896 | 169773 | 0 | None | - | 4 | Guinea pig | 5.1 | pKd | = | 5.1 | Functional | ChEMBL | 209 | 4 | 3 | 2 | -0.2 | CC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | ||
| 14660359 | 199129 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 396 | 9 | 4 | 3 | 3.7 | N=C(NCCCc1c[nH]cn1)NCCC(c1cccc(Cl)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL58922 | 199129 | 0 | None | - | 0 | Guinea pig | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 396 | 9 | 4 | 3 | 3.7 | N=C(NCCCc1c[nH]cn1)NCCC(c1cccc(Cl)c1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 10447834 | 1933 | 4 | None | -2 | 3 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 4026 | 1933 | 4 | None | -2 | 3 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275507 | 1933 | 4 | None | -2 | 3 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 10447834 | 1933 | 4 | None | -2 | 3 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | ||
| 4026 | 1933 | 4 | None | -2 | 3 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | ||
| CHEMBL275507 | 1933 | 4 | None | -2 | 3 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | ||
| 11741669 | 96753 | 0 | None | -39 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| CHEMBL264491 | 96753 | 0 | None | -39 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | ||
| 10403687 | 2511 | 3 | None | -1 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 1205 | 2511 | 3 | None | -1 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| CHEMBL275035 | 2511 | 3 | None | -1 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm991056a | ||
| 10403687 | 2511 | 3 | None | -1 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | ||
| 1205 | 2511 | 3 | None | -1 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | ||
| CHEMBL275035 | 2511 | 3 | None | -1 | 2 | Rat | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | ||
| 44274460 | 82411 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 398 | 15 | 1 | 5 | 4.3 | COc1ccc(CN(CCN(C)CCCCCCCCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| CHEMBL21735 | 82411 | 0 | None | - | 0 | Guinea pig | 8.0 | pKd | = | 8.0 | Functional | ChEMBL | 398 | 15 | 1 | 5 | 4.3 | COc1ccc(CN(CCN(C)CCCCCCCCN)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00113-6 | ||
| 11726167 | 199657 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 362 | 9 | 4 | 3 | 3.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| CHEMBL59295 | 199657 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 362 | 9 | 4 | 3 | 3.1 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccccn1 | 10.1021/jm00128a045 | ||
| 14660386 | 202780 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 395 | 9 | 4 | 2 | 4.3 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccc(Cl)cc1 | 10.1021/jm00128a045 | ||
| CHEMBL62142 | 202780 | 0 | None | - | 0 | Guinea pig | 7.0 | pKd | = | 7.0 | Functional | ChEMBL | 395 | 9 | 4 | 2 | 4.3 | N=C(NCCCc1c[nH]cn1)NCCC(c1ccccc1)c1ccc(Cl)cc1 | 10.1021/jm00128a045 | ||
| 1201 | 3964 | 1 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 361 | 7 | 3 | 3 | 2.6 | O=C(CC(c1ccccc1)c1ccccc1)NC(=NCCc1cnc[nH]1)N | 10.1021/jm800841w | ||
| 25150700 | 3964 | 1 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 361 | 7 | 3 | 3 | 2.6 | O=C(CC(c1ccccc1)c1ccccc1)NC(=NCCc1cnc[nH]1)N | 10.1021/jm800841w | ||
| CHEMBL499301 | 3964 | 1 | None | - | 0 | Guinea pig | 5.0 | pKd | = | 5.0 | Functional | ChEMBL | 361 | 7 | 3 | 3 | 2.6 | O=C(CC(c1ccccc1)c1ccccc1)NC(=NCCc1cnc[nH]1)N | 10.1021/jm800841w | ||
| 52937526 | 61302 | 0 | None | - | 0 | Human | 10.0 | pKi | = | 10 | Functional | ChEMBL | 363 | 5 | 0 | 5 | 3.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767137 | 61302 | 0 | None | - | 0 | Human | 10.0 | pKi | = | 10 | Functional | ChEMBL | 363 | 5 | 0 | 5 | 3.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| 1530 | 2182 | 50 | None | 3 | 25 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm100856p | ||
| 3827 | 2182 | 50 | None | 3 | 25 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm100856p | ||
| 7206 | 2182 | 50 | None | 3 | 25 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm100856p | ||
| CHEMBL534 | 2182 | 50 | None | 3 | 25 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm100856p | ||
| DB00920 | 2182 | 50 | None | 3 | 25 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm100856p | ||
| 15254720 | 61301 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767136 | 61301 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 52937527 | 61303 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 349 | 4 | 1 | 5 | 2.8 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(O)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767138 | 61303 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 349 | 4 | 1 | 5 | 2.8 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(O)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 15254720 | 61301 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL1767136 | 61301 | 0 | None | - | 0 | Human | 9.8 | pKi | = | 9.8 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 52937631 | 61307 | 0 | None | - | 0 | Human | 9.7 | pKi | = | 9.7 | Functional | ChEMBL | 347 | 4 | 0 | 4 | 3.4 | Cc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767141 | 61307 | 0 | None | - | 0 | Human | 9.7 | pKi | = | 9.7 | Functional | ChEMBL | 347 | 4 | 0 | 4 | 3.4 | Cc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| 71452871 | 80468 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146801 | 80468 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 203096 | 61299 | 3 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 341 | 5 | 0 | 4 | 3.2 | CN(C)CCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767134 | 61299 | 3 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 341 | 5 | 0 | 4 | 3.2 | CN(C)CCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 52937732 | 61314 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 369 | 4 | 0 | 4 | 3.4 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(F)c(F)c2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767149 | 61314 | 0 | None | - | 0 | Human | 9.6 | pKi | = | 9.6 | Functional | ChEMBL | 369 | 4 | 0 | 4 | 3.4 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(F)c(F)c2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 71458204 | 80476 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146809 | 80476 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 52937630 | 61306 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 351 | 4 | 0 | 4 | 3.2 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(F)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767140 | 61306 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 351 | 4 | 0 | 4 | 3.2 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(F)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 52937830 | 61319 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767154 | 61319 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 71458203 | 80472 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146805 | 80472 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71452872 | 80434 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146484 | 80434 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71461782 | 80473 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146806 | 80473 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 46861860 | 7491 | 1 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 4.0 | CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1087089 | 7491 | 1 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 4.0 | CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 52937728 | 61310 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 351 | 4 | 0 | 4 | 3.2 | CN1CCC[C@@H]1Cn1nc(Cc2cccc(F)c2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767145 | 61310 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 351 | 4 | 0 | 4 | 3.2 | CN1CCC[C@@H]1Cn1nc(Cc2cccc(F)c2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 71456359 | 80470 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 411 | 7 | 0 | 5 | 3.8 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146803 | 80470 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 411 | 7 | 0 | 5 | 3.8 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71458205 | 80478 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146811 | 80478 | 0 | None | - | 0 | Human | 9.3 | pKi | = | 9.3 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71451044 | 80474 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146807 | 80474 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 71454639 | 80477 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146810 | 80477 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 410 | 7 | 0 | 5 | 4.3 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 49864841 | 15731 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 266 | 1 | 1 | 4 | 1.6 | C1=C(N2CCNCC2)c2nccn2Cc2ccccc21 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222552 | 15731 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 266 | 1 | 1 | 4 | 1.6 | C1=C(N2CCNCC2)c2nccn2Cc2ccccc21 | 10.1016/j.bmcl.2010.07.029 | ||
| 71449250 | 80471 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccncc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146804 | 80471 | 0 | None | - | 0 | Human | 9.2 | pKi | = | 9.2 | Functional | ChEMBL | 368 | 4 | 0 | 5 | 3.1 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccncc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 52937731 | 61313 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 347 | 4 | 0 | 4 | 3.4 | Cc1cccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)c1 | 10.1021/jm1013874 | ||
| CHEMBL1767148 | 61313 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 347 | 4 | 0 | 4 | 3.4 | Cc1cccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)c1 | 10.1021/jm1013874 | ||
| 46861858 | 8562 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 335 | 5 | 0 | 4 | 3.9 | CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1094510 | 8562 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 335 | 5 | 0 | 4 | 3.9 | CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57402315 | 69712 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 311 | 3 | 1 | 4 | 2.9 | Fc1ccc(Cn2c([C@H]3CNCCO3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935442 | 69712 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 311 | 3 | 1 | 4 | 2.9 | Fc1ccc(Cn2c([C@H]3CNCCO3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 46888857 | 8712 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 4.0 | CN1CCC[C@@H](c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1095819 | 8712 | 0 | None | - | 0 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 323 | 3 | 0 | 3 | 4.0 | CN1CCC[C@@H](c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 71461781 | 80469 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9.0 | Functional | ChEMBL | 409 | 7 | 0 | 4 | 4.9 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146802 | 80469 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9.0 | Functional | ChEMBL | 409 | 7 | 0 | 4 | 4.9 | CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 57398830 | 69706 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 353 | 5 | 1 | 4 | 3.4 | OCCN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935436 | 69706 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 353 | 5 | 1 | 4 | 3.4 | OCCN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57400501 | 69708 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 321 | 5 | 1 | 4 | 3.6 | c1ccc(OCCn2c(C3CCCNC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935438 | 69708 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 321 | 5 | 1 | 4 | 3.6 | c1ccc(OCCn2c(C3CCCNC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57395287 | 69711 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 307 | 3 | 1 | 4 | 3.1 | Cc1ccc(Cn2c([C@H]3CNCCO3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935441 | 69711 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 307 | 3 | 1 | 4 | 3.1 | Cc1ccc(Cn2c([C@H]3CNCCO3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 71456360 | 80475 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146808 | 80475 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 412 | 7 | 0 | 6 | 3.1 | COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 52937222 | 61321 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 367 | 3 | 0 | 4 | 3.9 | CN1CCC(n2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)CC1 | 10.1021/jm1013874 | ||
| CHEMBL1767156 | 61321 | 0 | None | - | 0 | Human | 9.0 | pKi | = | 9 | Functional | ChEMBL | 367 | 3 | 0 | 4 | 3.9 | CN1CCC(n2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)CC1 | 10.1021/jm1013874 | ||
| 57404030 | 69707 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 309 | 3 | 1 | 3 | 3.7 | Fc1ccc(Cn2c([C@@H]3CCCNC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935437 | 69707 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 309 | 3 | 1 | 3 | 3.7 | Fc1ccc(Cn2c([C@@H]3CCCNC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 2267 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| 271 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| 7121 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL639 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| DB00972 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmc.2012.08.032 | ||
| 2267 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| 271 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| 7121 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL639 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| DB00972 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1016/j.bmcl.2016.11.022 | ||
| 2267 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| 271 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| 7121 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| CHEMBL639 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| DB00972 | 559 | 71 | None | 32 | 14 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/jm1013874 | ||
| 71456361 | 80479 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 369 | 4 | 0 | 6 | 2.5 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2nccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146812 | 80479 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 369 | 4 | 0 | 6 | 2.5 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2nccnc2c1=O | 10.1016/j.bmc.2012.08.032 | ||
| 57400503 | 69714 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 323 | 3 | 1 | 4 | 3.8 | Cc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935444 | 69714 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 323 | 3 | 1 | 4 | 3.8 | Cc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57397056 | 69716 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 327 | 3 | 1 | 4 | 3.6 | Fc1ccc(Cn2c([C@H]3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935446 | 69716 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 327 | 3 | 1 | 4 | 3.6 | Fc1ccc(Cn2c([C@H]3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57400505 | 69717 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 339 | 4 | 1 | 5 | 3.5 | COc1ccc(Cn2c([C@H]3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935447 | 69717 | 0 | None | - | 0 | Human | 8.9 | pKi | = | 8.9 | Functional | ChEMBL | 339 | 4 | 1 | 5 | 3.5 | COc1ccc(Cn2c([C@H]3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57400503 | 69714 | 0 | None | - | 0 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 323 | 3 | 1 | 4 | 3.8 | Cc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935444 | 69714 | 0 | None | - | 0 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 323 | 3 | 1 | 4 | 3.8 | Cc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 52937729 | 61311 | 0 | None | - | 0 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2cccc(Cl)c2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767146 | 61311 | 0 | None | - | 0 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.7 | CN1CCC[C@@H]1Cn1nc(Cc2cccc(Cl)c2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 52937829 | 61318 | 0 | None | - | 0 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 313 | 6 | 0 | 4 | 3.2 | CCCCCc1nn(C[C@H]2CCCN2C)c(=O)c2ccccc12 | 10.1021/jm1013874 | ||
| CHEMBL1767153 | 61318 | 0 | None | - | 0 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 313 | 6 | 0 | 4 | 3.2 | CCCCCc1nn(C[C@H]2CCCN2C)c(=O)c2ccccc12 | 10.1021/jm1013874 | ||
| 57400502 | 69713 | 0 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 321 | 3 | 1 | 4 | 3.4 | Cc1ccc(Cn2c(C3CNCCO3)nc3ccccc32)cc1C | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935443 | 69713 | 0 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 321 | 3 | 1 | 4 | 3.4 | Cc1ccc(Cn2c(C3CNCCO3)nc3ccccc32)cc1C | 10.1016/j.bmcl.2011.10.115 | ||
| 52937730 | 61312 | 0 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 363 | 5 | 0 | 5 | 3.1 | COc1cccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)c1 | 10.1021/jm1013874 | ||
| CHEMBL1767147 | 61312 | 0 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 363 | 5 | 0 | 5 | 3.1 | COc1cccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)c1 | 10.1021/jm1013874 | ||
| 52945978 | 18796 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 335 | 4 | 2 | 2 | 3.7 | O=C(O)CCNC1CC[C@]2(Cc3ccccc3Cc3ccccc32)C1 | 10.1021/jm100856p | ||
| CHEMBL1278114 | 18796 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 335 | 4 | 2 | 2 | 3.7 | O=C(O)CCNC1CC[C@]2(Cc3ccccc3Cc3ccccc32)C1 | 10.1021/jm100856p | ||
| 17747460 | 61329 | 12 | None | - | 2 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL1767164 | 61329 | 12 | None | - | 2 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| 17747460 | 61329 | 12 | None | - | 2 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL1767164 | 61329 | 12 | None | - | 2 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmcl.2016.11.022 | ||
| 52937018 | 61300 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 355 | 6 | 0 | 4 | 3.6 | CN(C)CCCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767135 | 61300 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 355 | 6 | 0 | 4 | 3.6 | CN(C)CCCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 17747460 | 61329 | 12 | None | - | 2 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767164 | 61329 | 12 | None | - | 2 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 49836636 | 18677 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 375 | 2 | 1 | 3 | 4.5 | O=C(O)C1=CCCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277125 | 18677 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 375 | 2 | 1 | 3 | 4.5 | O=C(O)C1=CCCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 49836522 | 18795 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 376 | 2 | 2 | 3 | 3.0 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CCN1 | 10.1021/jm100856p | ||
| CHEMBL1278113 | 18795 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 376 | 2 | 2 | 3 | 3.0 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CCN1 | 10.1021/jm100856p | ||
| 11648990 | 95646 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 498 | 6 | 0 | 8 | 5.4 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6onc(C)c6cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL257946 | 95646 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 498 | 6 | 0 | 8 | 5.4 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6onc(C)c6cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 185 | 4006 | 60 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | 10.1021/jm100856p | ||
| 5311271 | 4006 | 60 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | 10.1021/jm100856p | ||
| CHEMBL74355 | 4006 | 60 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | 10.1021/jm100856p | ||
| DB16351 | 4006 | 60 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | 10.1021/jm100856p | ||
| 49836740 | 18704 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 425 | 2 | 1 | 4 | 4.9 | O=C(O)C1CCN(C2CCC3(C2)C(=O)c2cc(Cl)ccc2Oc2ccccc23)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277401 | 18704 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 425 | 2 | 1 | 4 | 4.9 | O=C(O)C1CCN(C2CCC3(C2)C(=O)c2cc(Cl)ccc2Oc2ccccc23)CC1 | 10.1021/jm100856p | ||
| 44454458 | 95125 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 618 | 6 | 0 | 8 | 7.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6nc(C(C)(C)C)oc6c(Br)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL255566 | 95125 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 618 | 6 | 0 | 8 | 7.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6nc(C(C)(C)C)oc6c(Br)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 44454382 | 95582 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 517 | 6 | 0 | 8 | 5.2 | Cc1ccc2c(-c3nnc(SCCCN4CCc5nc6ccc(Cl)cn6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL257716 | 95582 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 517 | 6 | 0 | 8 | 5.2 | Cc1ccc2c(-c3nnc(SCCCN4CCc5nc6ccc(Cl)cn6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 11642163 | 97505 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 522 | 6 | 0 | 9 | 5.3 | Cc1nc(C)c(-c2nnc(SCCCN3CCc4ccc5oc(C(F)(F)F)nc5c4CC3)n2C)s1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL270376 | 97505 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 522 | 6 | 0 | 9 | 5.3 | Cc1nc(C)c(-c2nnc(SCCCN3CCc4ccc5oc(C(F)(F)F)nc5c4CC3)n2C)s1 | 10.1016/j.bmcl.2007.12.042 | ||
| 11663526 | 97752 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 514 | 6 | 0 | 8 | 5.8 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6nc(C)sc6cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL271632 | 97752 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 514 | 6 | 0 | 8 | 5.8 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6nc(C)sc6cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 44454223 | 97974 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 542 | 6 | 0 | 8 | 4.7 | CC(=O)N1CCOc2cc3c(cc21)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL272702 | 97974 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 542 | 6 | 0 | 8 | 4.7 | CC(=O)N1CCOc2cc3c(cc21)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| 11527195 | 98058 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 590 | 6 | 0 | 8 | 6.5 | Cc1ccc2c(-c3nnc(SCCC(C)N4CCc5cc6nc(C)oc6c(Br)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL273165 | 98058 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 590 | 6 | 0 | 8 | 6.5 | Cc1ccc2c(-c3nnc(SCCC(C)N4CCc5cc6nc(C)oc6c(Br)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 11721190 | 155274 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 578 | 7 | 0 | 10 | 5.8 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6oc(-c7cc(C)nn7C)nc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL402853 | 155274 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 578 | 7 | 0 | 10 | 5.8 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6oc(-c7cc(C)nn7C)nc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 134143913 | 150330 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 497 | 9 | 0 | 6 | 5.1 | N#Cc1ccc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2ncccc12 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3953018 | 150330 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 497 | 9 | 0 | 6 | 5.1 | N#Cc1ccc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2ncccc12 | 10.1016/j.bmcl.2016.11.022 | ||
| 57393573 | 69709 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 406 | 7 | 0 | 5 | 3.4 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935439 | 69709 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 406 | 7 | 0 | 5 | 3.4 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 49836525 | 18807 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | CC1(C(=O)O)CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1278202 | 18807 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | CC1(C(=O)O)CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 57780020 | 143450 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 600 | 15 | 1 | 6 | 6.6 | CCCCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3898341 | 143450 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 600 | 15 | 1 | 6 | 6.6 | CCCCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 57780017 | 148118 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 544 | 12 | 1 | 6 | 5.3 | O=C(O)CCc1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3935303 | 148118 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 544 | 12 | 1 | 6 | 5.3 | O=C(O)CCc1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| 49834051 | 15747 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 364 | 3 | 1 | 5 | 2.2 | O=C(O)C1CC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)C1 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222626 | 15747 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 364 | 3 | 1 | 5 | 2.2 | O=C(O)C1CC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)C1 | 10.1016/j.bmcl.2010.07.029 | ||
| 24803639 | 61331 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 622 | 14 | 1 | 7 | 6.8 | O=c1c2ccccc2c(Cc2ccc(O)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767166 | 61331 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 622 | 14 | 1 | 7 | 6.8 | O=c1c2ccccc2c(Cc2ccc(O)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 24803483 | 61332 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 654 | 15 | 0 | 6 | 8.2 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767167 | 61332 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 654 | 15 | 0 | 6 | 8.2 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 49836738 | 18694 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 377 | 2 | 1 | 3 | 4.6 | O=C(O)[C@@H]1CCCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277311 | 18694 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 377 | 2 | 1 | 3 | 4.6 | O=C(O)[C@@H]1CCCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 11591601 | 155333 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 512 | 7 | 0 | 8 | 5.6 | CCc1noc2cc3c(cc12)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL403181 | 155333 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 512 | 7 | 0 | 8 | 5.6 | CCc1noc2cc3c(cc12)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| 49833882 | 15760 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 392 | 3 | 1 | 5 | 3.0 | O=C(O)C1CCC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222692 | 15760 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 392 | 3 | 1 | 5 | 3.0 | O=C(O)C1CCC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| 49833886 | 15778 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 396 | 5 | 1 | 6 | 2.5 | COc1cnc2n1Cc1ccccc1C=C2N1CCN(CC(C)(C)C(=O)O)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222764 | 15778 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 396 | 5 | 1 | 6 | 2.5 | COc1cnc2n1Cc1ccccc1C=C2N1CCN(CC(C)(C)C(=O)O)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| 11657494 | 95509 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 644 | 7 | 0 | 8 | 7.2 | Cc1ccc2c(-c3nnc(SCCCCN4CCc5cc6nc(C(F)(F)F)oc6c(Br)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL257369 | 95509 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 644 | 7 | 0 | 8 | 7.2 | Cc1ccc2c(-c3nnc(SCCCCN4CCc5cc6nc(C(F)(F)F)oc6c(Br)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 11641641 | 97507 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 487 | 6 | 0 | 7 | 5.2 | Cn1c(SCCCN2CCc3ccc4oc(C(F)(F)F)nc4c3CC2)nnc1-c1ccccc1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL270387 | 97507 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 487 | 6 | 0 | 7 | 5.2 | Cn1c(SCCCN2CCc3ccc4oc(C(F)(F)F)nc4c3CC2)nnc1-c1ccccc1 | 10.1016/j.bmcl.2007.12.042 | ||
| 24749507 | 14008 | 4 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 421 | 7 | 0 | 4 | 3.4 | O=C(c1ccccc1)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL1197067 | 14008 | 4 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 421 | 7 | 0 | 4 | 3.4 | O=C(c1ccccc1)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL559206 | 14008 | 4 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 421 | 7 | 0 | 4 | 3.4 | O=C(c1ccccc1)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| 57397055 | 69705 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 390 | 5 | 0 | 5 | 4.6 | Fc1ccc(Cn2c(C3CCCN(Cc4ncco4)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935435 | 69705 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 390 | 5 | 0 | 5 | 4.6 | Fc1ccc(Cn2c(C3CCCN(Cc4ncco4)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 49836294 | 18779 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 387 | 2 | 0 | 3 | 4.4 | COC(=O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1278020 | 18779 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 387 | 2 | 0 | 3 | 4.4 | COC(=O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 49836524 | 18806 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 361 | 2 | 1 | 2 | 4.0 | O=C(O)C1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1278201 | 18806 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 361 | 2 | 1 | 2 | 4.0 | O=C(O)C1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 134136763 | 142848 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 500 | 11 | 0 | 5 | 6.0 | c1cnc2c(N3CCN(CCCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3893197 | 142848 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 500 | 11 | 0 | 5 | 6.0 | c1cnc2c(N3CCN(CCCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 57780007 | 146991 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 572 | 13 | 1 | 6 | 5.8 | CCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3926412 | 146991 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 572 | 13 | 1 | 6 | 5.8 | CCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 24803797 | 61080 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 626 | 11 | 0 | 6 | 7.6 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(CCc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| CHEMBL1765111 | 61080 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 626 | 11 | 0 | 6 | 7.6 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(CCc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| 24803798 | 61325 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 640 | 12 | 0 | 6 | 7.9 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(CCCc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| CHEMBL1767160 | 61325 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 640 | 12 | 0 | 6 | 7.9 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(CCCc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| 49836737 | 18685 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 395 | 2 | 1 | 3 | 4.7 | O=C(O)C1(F)CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277217 | 18685 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 395 | 2 | 1 | 3 | 4.7 | O=C(O)C1(F)CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49836189 | 18780 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1278021 | 18780 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 44454309 | 97639 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 514 | 6 | 1 | 8 | 4.3 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)OCC(=O)N6)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL271066 | 97639 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 514 | 6 | 1 | 8 | 4.3 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)OCC(=O)N6)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 11568714 | 95307 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 454 | 6 | 0 | 9 | 4.3 | Cc1nc2cc3c(cc2s1)CCN(CCCSc1nnc(-c2ocnc2C)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL256471 | 95307 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 454 | 6 | 0 | 9 | 4.3 | Cc1nc2cc3c(cc2s1)CCN(CCCSc1nnc(-c2ocnc2C)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| 11606378 | 95315 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 548 | 7 | 0 | 8 | 6.2 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6nc(C(C)(F)F)oc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL256488 | 95315 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 548 | 7 | 0 | 8 | 6.2 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6nc(C(C)(F)F)oc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 11533473 | 97551 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 503 | 6 | 0 | 9 | 4.3 | Cc1cnc(-c2nnc(SCCCN3CCc4ccc5oc(C(F)(F)F)nc5c4CC3)n2C)cn1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL270602 | 97551 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 503 | 6 | 0 | 9 | 4.3 | Cc1cnc(-c2nnc(SCCCN3CCc4ccc5oc(C(F)(F)F)nc5c4CC3)n2C)cn1 | 10.1016/j.bmcl.2007.12.042 | ||
| 44454401 | 155140 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 554 | 6 | 0 | 8 | 6.7 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6nc(C(C)(C)C)oc6c(C)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL402087 | 155140 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 554 | 6 | 0 | 8 | 6.7 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6nc(C(C)(C)C)oc6c(C)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 11504077 | 168829 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 488 | 7 | 0 | 9 | 4.6 | Cc1ncoc1-c1nnc(SCCCN2CCc3ccc4oc(C(C)(F)F)nc4c3CC2)n1C | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL437792 | 168829 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 488 | 7 | 0 | 9 | 4.6 | Cc1ncoc1-c1nnc(SCCCN2CCc3ccc4oc(C(C)(F)F)nc4c3CC2)n1C | 10.1016/j.bmcl.2007.12.042 | ||
| 52937733 | 61315 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 393 | 6 | 0 | 6 | 3.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1OC | 10.1021/jm1013874 | ||
| CHEMBL1767150 | 61315 | 0 | None | - | 0 | Human | 5.8 | pKi | = | 5.8 | Functional | ChEMBL | 393 | 6 | 0 | 6 | 3.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1OC | 10.1021/jm1013874 | ||
| 57391843 | 69704 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 436 | 5 | 0 | 5 | 3.3 | O=C(CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1)N1CCOCC1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935434 | 69704 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 436 | 5 | 0 | 5 | 3.3 | O=C(CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1)N1CCOCC1 | 10.1016/j.bmcl.2011.10.115 | ||
| 24804150 | 80480 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 641 | 14 | 0 | 7 | 7.2 | O=c1c2ccncc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| CHEMBL2146813 | 80480 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 641 | 14 | 0 | 7 | 7.2 | O=c1c2ccncc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1016/j.bmc.2012.08.032 | ||
| 49836412 | 18724 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | O=C(O)[C@@H]1CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277584 | 18724 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | O=C(O)[C@@H]1CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 49836295 | 18766 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277935 | 18766 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 57780008 | 149726 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 472 | 9 | 0 | 5 | 5.2 | c1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3947980 | 149726 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 472 | 9 | 0 | 5 | 5.2 | c1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 49864886 | 15745 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 2.6 | CC1CN(C2=Cc3ccccc3Cn3ccnc32)CC(C)N1CCC(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222624 | 15745 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 2.6 | CC1CN(C2=Cc3ccccc3Cn3ccnc32)CC(C)N1CCC(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| 24803799 | 61326 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 654 | 13 | 0 | 6 | 8.3 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(CCCCc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| CHEMBL1767161 | 61326 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 654 | 13 | 0 | 6 | 8.3 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(CCCCc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| 49836635 | 18667 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 359 | 2 | 1 | 2 | 4.0 | O=C(O)C=C1CN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277035 | 18667 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 359 | 2 | 1 | 2 | 4.0 | O=C(O)C=C1CN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 49836741 | 18713 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 425 | 2 | 1 | 4 | 4.8 | O=C(O)C1CCN(C2CCC3(C2)C(=O)c2cc(F)ccc2Sc2ccccc23)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277491 | 18713 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 425 | 2 | 1 | 4 | 4.8 | O=C(O)C1CCN(C2CCC3(C2)C(=O)c2cc(F)ccc2Sc2ccccc23)CC1 | 10.1021/jm100856p | ||
| 49836842 | 18714 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 425 | 2 | 1 | 4 | 4.9 | O=C(O)[C@@H]1CCCN(C2CCC3(C2)C(=O)c2cc(Cl)ccc2Oc2ccccc23)C1 | 10.1021/jm100856p | ||
| CHEMBL1277492 | 18714 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 425 | 2 | 1 | 4 | 4.9 | O=C(O)[C@@H]1CCCN(C2CCC3(C2)C(=O)c2cc(Cl)ccc2Oc2ccccc23)C1 | 10.1021/jm100856p | ||
| 57780016 | 150297 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 542 | 11 | 1 | 6 | 5.3 | O=C(O)/C=C/c1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3952802 | 150297 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 542 | 11 | 1 | 6 | 5.3 | O=C(O)/C=C/c1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| 11585248 | 95314 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 604 | 8 | 0 | 8 | 6.8 | CCc1nc2cc3c(c(Br)c2o1)CCN(CCCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL256482 | 95314 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 604 | 8 | 0 | 8 | 6.8 | CCc1nc2cc3c(c(Br)c2o1)CCN(CCCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| 11669953 | 95540 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 468 | 6 | 0 | 9 | 2.7 | Cc1ncoc1-c1nnc(SCCCN2CCc3cc4c(cc3CC2)N(C)C(=O)CO4)n1C | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL257534 | 95540 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 468 | 6 | 0 | 9 | 2.7 | Cc1ncoc1-c1nnc(SCCCN2CCc3cc4c(cc3CC2)N(C)C(=O)CO4)n1C | 10.1016/j.bmcl.2007.12.066 | ||
| 44454278 | 95541 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 454 | 6 | 1 | 9 | 2.7 | Cc1ncoc1-c1nnc(SCCCN2CCc3cc4c(cc3CC2)OCC(=O)N4)n1C | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL257536 | 95541 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 454 | 6 | 1 | 9 | 2.7 | Cc1ncoc1-c1nnc(SCCCN2CCc3cc4c(cc3CC2)OCC(=O)N4)n1C | 10.1016/j.bmcl.2007.12.066 | ||
| 11621352 | 97633 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 602 | 7 | 0 | 8 | 6.7 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6oc(C(F)(F)C(F)(F)F)nc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL271034 | 97633 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 602 | 7 | 0 | 8 | 6.7 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6oc(C(F)(F)C(F)(F)F)nc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 11677768 | 155574 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 502 | 6 | 0 | 8 | 4.9 | Cc1ccc(-c2nnc(SCCCN3CCc4ccc5oc(C(F)(F)F)nc5c4CC3)n2C)cn1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL404404 | 155574 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 502 | 6 | 0 | 8 | 4.9 | Cc1ccc(-c2nnc(SCCCN3CCc4ccc5oc(C(F)(F)F)nc5c4CC3)n2C)cn1 | 10.1016/j.bmcl.2007.12.042 | ||
| 44454353 | 156421 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 483 | 6 | 0 | 8 | 4.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5nc6ccccn6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL406678 | 156421 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 483 | 6 | 0 | 8 | 4.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5nc6ccccn6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 15986135 | 12329 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 457 | 7 | 0 | 4 | 3.7 | O=C(c1ccc(F)cc1F)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL1185220 | 12329 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 457 | 7 | 0 | 4 | 3.7 | O=C(c1ccc(F)cc1F)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL398812 | 12329 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 457 | 7 | 0 | 4 | 3.7 | O=C(c1ccc(F)cc1F)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| 15986915 | 12774 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 455 | 7 | 0 | 4 | 4.1 | O=C(c1ccc(Cl)cc1)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL1187963 | 12774 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 455 | 7 | 0 | 4 | 4.1 | O=C(c1ccc(Cl)cc1)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL534512 | 12774 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 455 | 7 | 0 | 4 | 4.1 | O=C(c1ccc(Cl)cc1)N1CCN(c2ccc(OCCCN3CCCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| 24749508 | 12789 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 446 | 7 | 0 | 5 | 3.3 | N#Cc1ccc(C(=O)N2CCN(c3ccc(OCCCN4CCCCC4)cc3)C(=O)C2)cc1 | 10.1021/jm0708228 | ||
| CHEMBL1188060 | 12789 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 446 | 7 | 0 | 5 | 3.3 | N#Cc1ccc(C(=O)N2CCN(c3ccc(OCCCN4CCCCC4)cc3)C(=O)C2)cc1 | 10.1021/jm0708228 | ||
| CHEMBL534958 | 12789 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 446 | 7 | 0 | 5 | 3.3 | N#Cc1ccc(C(=O)N2CCN(c3ccc(OCCCN4CCCCC4)cc3)C(=O)C2)cc1 | 10.1021/jm0708228 | ||
| 15986914 | 12858 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 435 | 7 | 0 | 4 | 3.7 | Cc1ccc(C(=O)N2CCN(c3ccc(OCCCN4CCCCC4)cc3)C(=O)C2)cc1 | 10.1021/jm0708228 | ||
| CHEMBL1188657 | 12858 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 435 | 7 | 0 | 4 | 3.7 | Cc1ccc(C(=O)N2CCN(c3ccc(OCCCN4CCCCC4)cc3)C(=O)C2)cc1 | 10.1021/jm0708228 | ||
| CHEMBL536991 | 12858 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 435 | 7 | 0 | 4 | 3.7 | Cc1ccc(C(=O)N2CCN(c3ccc(OCCCN4CCCCC4)cc3)C(=O)C2)cc1 | 10.1021/jm0708228 | ||
| 15987452 | 91433 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 443 | 7 | 0 | 4 | 3.3 | O=C(c1ccc(F)cc1F)N1CCN(c2ccc(OCCCN3CCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL240352 | 91433 | 0 | None | - | 0 | Human | 5.7 | pKi | = | 5.7 | Functional | ChEMBL | 443 | 7 | 0 | 4 | 3.3 | O=C(c1ccc(F)cc1F)N1CCN(c2ccc(OCCCN3CCCC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| 1524 | 2181 | 96 | None | -47 | 18 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm300338m | ||
| 197 | 2181 | 96 | None | -47 | 18 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm300338m | ||
| 3822 | 2181 | 96 | None | -47 | 18 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm300338m | ||
| 88 | 2181 | 96 | None | -47 | 18 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm300338m | ||
| CHEMBL51 | 2181 | 96 | None | -47 | 18 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm300338m | ||
| DB12465 | 2181 | 96 | None | -47 | 18 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/jm300338m | ||
| 45358442 | 61323 | 0 | None | - | 0 | Human | 8.6 | pKi | = | 8.6 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCCC(n2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)C1 | 10.1021/jm1013874 | ||
| CHEMBL1767158 | 61323 | 0 | None | - | 0 | Human | 8.6 | pKi | = | 8.6 | Functional | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCCC(n2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)C1 | 10.1021/jm1013874 | ||
| 53359025 | 62353 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 339 | 5 | 1 | 3 | 2.5 | O=C(CCCN1C2C3C4CC5C6C4C2C6C1(O)C53)c1ccc(F)cc1 | 10.1016/j.bmcl.2011.04.098 | ||
| CHEMBL1779058 | 62353 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 339 | 5 | 1 | 3 | 2.5 | O=C(CCCN1C2C3C4CC5C6C4C2C6C1(O)C53)c1ccc(F)cc1 | 10.1016/j.bmcl.2011.04.098 | ||
| 57404031 | 69710 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 402 | 7 | 0 | 6 | 4.5 | c1ccc(OCCn2c(C3CCCN(Cc4ncco4)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935440 | 69710 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 402 | 7 | 0 | 6 | 4.5 | c1ccc(OCCn2c(C3CCCN(Cc4ncco4)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 49836411 | 18725 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 389 | 3 | 1 | 2 | 4.8 | O=C(O)CC1CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277585 | 18725 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 389 | 3 | 1 | 2 | 4.8 | O=C(O)CC1CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49836295 | 18766 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277935 | 18766 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 49836187 | 18797 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 335 | 4 | 2 | 2 | 3.7 | O=C(O)CCNC1CC[C@@]2(Cc3ccccc3Cc3ccccc32)C1 | 10.1021/jm100856p | ||
| CHEMBL1278115 | 18797 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 335 | 4 | 2 | 2 | 3.7 | O=C(O)CCNC1CC[C@@]2(Cc3ccccc3Cc3ccccc32)C1 | 10.1021/jm100856p | ||
| 23582308 | 145864 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 634 | 14 | 1 | 6 | 6.9 | O=C(O)CCc1ccc2cc(Cc3ccccc3)cc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3917428 | 145864 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 634 | 14 | 1 | 6 | 6.9 | O=C(O)CCc1ccc2cc(Cc3ccccc3)cc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| 46933089 | 15733 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 2.5 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3ccnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222554 | 15733 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 2.5 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3ccnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| 49834051 | 15747 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 364 | 3 | 1 | 5 | 2.2 | O=C(O)C1CC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)C1 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222626 | 15747 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 364 | 3 | 1 | 5 | 2.2 | O=C(O)C1CC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)C1 | 10.1016/j.bmcl.2010.07.029 | ||
| 24803482 | 61333 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767168 | 61333 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 11627879 | 95347 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 528 | 6 | 0 | 8 | 4.3 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)N(C)C(=O)CO6)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL256652 | 95347 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 528 | 6 | 0 | 8 | 4.3 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)N(C)C(=O)CO6)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 11577158 | 97807 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 514 | 6 | 0 | 8 | 5.8 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6nc(C)sc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL271909 | 97807 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 514 | 6 | 0 | 8 | 5.8 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6nc(C)sc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 134143679 | 145902 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 516 | 10 | 1 | 6 | 4.9 | O=C(O)c1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3917794 | 145902 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 516 | 10 | 1 | 6 | 4.9 | O=C(O)c1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1 | 10.1016/j.bmcl.2016.11.022 | ||
| 44454120 | 95172 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 438 | 6 | 0 | 9 | 3.8 | Cc1nc2cc3c(cc2o1)CCN(CCCSc1nnc(-c2ocnc2C)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL255827 | 95172 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 438 | 6 | 0 | 9 | 3.8 | Cc1nc2cc3c(cc2o1)CCN(CCCSc1nnc(-c2ocnc2C)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| 11548755 | 97655 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 580 | 7 | 0 | 8 | 6.8 | Cc1ccc2c(-c3nnc(SCCCCN4CCc5cc6nc(C(F)(F)F)oc6c(C)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL271097 | 97655 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 580 | 7 | 0 | 8 | 6.8 | Cc1ccc2c(-c3nnc(SCCCCN4CCc5cc6nc(C(F)(F)F)oc6c(C)c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 44454443 | 97763 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 449 | 6 | 0 | 9 | 3.6 | Cc1cnc(-c2nnc(SCCCN3CCc4ccc5c(C)noc5c4CC3)n2C)cn1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL271702 | 97763 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 449 | 6 | 0 | 9 | 3.6 | Cc1cnc(-c2nnc(SCCCN3CCc4ccc5c(C)noc5c4CC3)n2C)cn1 | 10.1016/j.bmcl.2007.12.042 | ||
| 11641596 | 97798 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 484 | 6 | 0 | 8 | 5.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6ncoc6cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL271844 | 97798 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 484 | 6 | 0 | 8 | 5.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6ncoc6cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 15986645 | 12870 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 451 | 5 | 0 | 4 | 3.7 | O=C(c1ccc(F)cc1)N1CCN(c2ccc(OC3CCN(C4CCC4)CC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL1188742 | 12870 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 451 | 5 | 0 | 4 | 3.7 | O=C(c1ccc(F)cc1)N1CCN(c2ccc(OC3CCN(C4CCC4)CC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| CHEMBL537219 | 12870 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 451 | 5 | 0 | 4 | 3.7 | O=C(c1ccc(F)cc1)N1CCN(c2ccc(OC3CCN(C4CCC4)CC3)cc2)C(=O)C1 | 10.1021/jm0708228 | ||
| 44250284 | 195222 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 436 | 6 | 0 | 5 | 4.6 | CN(CC1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL550818 | 195222 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 436 | 6 | 0 | 5 | 4.6 | CN(CC1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2011.10.115 | ||
| 52944115 | 18798 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 291 | 1 | 0 | 1 | 4.2 | CN(C)C1CC[C@]2(Cc3ccccc3Cc3ccccc32)C1 | 10.1021/jm100856p | ||
| CHEMBL1278116 | 18798 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 291 | 1 | 0 | 1 | 4.2 | CN(C)C1CC[C@]2(Cc3ccccc3Cc3ccccc32)C1 | 10.1021/jm100856p | ||
| 49836526 | 18648 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 375 | 3 | 1 | 2 | 4.4 | O=C(O)CC1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1276859 | 18648 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 375 | 3 | 1 | 2 | 4.4 | O=C(O)CC1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 49836528 | 18658 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.0 | O=C(O)[C@]12C[C@H]1CN(C1CC[C@]3(Cc4ccccc4Cc4ccccc43)C1)C2 | 10.1021/jm100856p | ||
| CHEMBL1276947 | 18658 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.0 | O=C(O)[C@]12C[C@H]1CN(C1CC[C@]3(Cc4ccccc4Cc4ccccc43)C1)C2 | 10.1021/jm100856p | ||
| 49834052 | 15746 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 350 | 4 | 1 | 5 | 2.0 | C=C(CN1CCN(C2=Cc3ccccc3Cn3ccnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222625 | 15746 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 350 | 4 | 1 | 5 | 2.0 | C=C(CN1CCN(C2=Cc3ccccc3Cn3ccnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| 52937828 | 61317 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 347 | 5 | 0 | 4 | 3.3 | CN1CCC[C@@H]1Cn1nc(CCc2ccccc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767152 | 61317 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 347 | 5 | 0 | 4 | 3.3 | CN1CCC[C@@H]1Cn1nc(CCc2ccccc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 49836634 | 18666 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 361 | 3 | 1 | 2 | 4.0 | O=C(O)CC1CN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277034 | 18666 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 361 | 3 | 1 | 2 | 4.0 | O=C(O)CC1CN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 44454434 | 97907 | 0 | None | - | 0 | Human | 5.5 | pKi | = | 5.5 | Functional | ChEMBL | 512 | 6 | 0 | 7 | 4.5 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)C(=O)N(C)C6)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL272480 | 97907 | 0 | None | - | 0 | Human | 5.5 | pKi | = | 5.5 | Functional | ChEMBL | 512 | 6 | 0 | 7 | 4.5 | Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)C(=O)N(C)C6)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.066 | ||
| 57400502 | 69713 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 321 | 3 | 1 | 4 | 3.4 | Cc1ccc(Cn2c(C3CNCCO3)nc3ccccc32)cc1C | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935443 | 69713 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 321 | 3 | 1 | 4 | 3.4 | Cc1ccc(Cn2c(C3CNCCO3)nc3ccccc32)cc1C | 10.1016/j.bmcl.2011.10.115 | ||
| 49836527 | 18649 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 3.9 | O=C(O)[C@@H]1[C@H]2CN(C3CCC4(Cc5ccccc5Cc5ccccc54)C3)C[C@H]21 | 10.1021/jm100856p | ||
| CHEMBL1276860 | 18649 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 3.9 | O=C(O)[C@@H]1[C@H]2CN(C3CCC4(Cc5ccccc5Cc5ccccc54)C3)C[C@H]21 | 10.1021/jm100856p | ||
| 49836410 | 18735 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 393 | 2 | 1 | 2 | 4.5 | O=C(O)C1(F)CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277678 | 18735 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 393 | 2 | 1 | 2 | 4.5 | O=C(O)C1(F)CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49836298 | 18753 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277854 | 18753 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49836296 | 18754 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 391 | 2 | 1 | 2 | 4.5 | O=C(O)C1=CCCN(C2CCC3(Cc4cc(F)ccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277855 | 18754 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 391 | 2 | 1 | 2 | 4.5 | O=C(O)C1=CCCN(C2CCC3(Cc4cc(F)ccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 57780018 | 144553 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 544 | 12 | 1 | 6 | 5.3 | O=C(O)CCc1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3907368 | 144553 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 544 | 12 | 1 | 6 | 5.3 | O=C(O)CCc1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 49833883 | 15761 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 394 | 4 | 1 | 5 | 3.1 | Cc1nc2n(c1C)Cc1ccccc1C=C2N1CCN(CC(C)(C)C(=O)O)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222693 | 15761 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 394 | 4 | 1 | 5 | 3.1 | Cc1nc2n(c1C)Cc1ccccc1C=C2N1CCN(CC(C)(C)C(=O)O)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| 46933090 | 15776 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 400 | 4 | 1 | 5 | 3.1 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3c(Cl)cnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222762 | 15776 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 400 | 4 | 1 | 5 | 3.1 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3c(Cl)cnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| 49834053 | 15777 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 384 | 4 | 1 | 5 | 2.6 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3cc(F)nc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222763 | 15777 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 384 | 4 | 1 | 5 | 2.6 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3cc(F)nc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| 24803316 | 61327 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 600 | 15 | 1 | 6 | 6.9 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1CCNCCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767162 | 61327 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 600 | 15 | 1 | 6 | 6.9 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1CCNCCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm1013874 | ||
| 24803480 | 61328 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 614 | 15 | 0 | 6 | 7.2 | CN(CCCCc1ccc(OCCCN2CCCCCC2)cc1)CCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767163 | 61328 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 614 | 15 | 0 | 6 | 7.2 | CN(CCCCc1ccc(OCCCN2CCCCCC2)cc1)CCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 11548239 | 95299 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 528 | 7 | 0 | 8 | 6.1 | CCc1nc2ccc3c(c2s1)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL256442 | 95299 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 528 | 7 | 0 | 8 | 6.1 | CCc1nc2ccc3c(c2s1)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.042 | ||
| 134150412 | 152102 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 516 | 10 | 1 | 6 | 4.9 | O=C(O)c1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3967709 | 152102 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 516 | 10 | 1 | 6 | 4.9 | O=C(O)c1cnc2c(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 52937632 | 61308 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 389 | 4 | 0 | 4 | 4.4 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(C(C)(C)C)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767142 | 61308 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 389 | 4 | 0 | 4 | 4.4 | CN1CCC[C@@H]1Cn1nc(Cc2ccc(C(C)(C)C)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 11497679 | 155564 | 0 | None | - | 0 | Human | 5.4 | pKi | = | 5.4 | Functional | ChEMBL | 552 | 6 | 0 | 8 | 6.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6nc(C(F)(F)F)oc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL404363 | 155564 | 0 | None | - | 0 | Human | 5.4 | pKi | = | 5.4 | Functional | ChEMBL | 552 | 6 | 0 | 8 | 6.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6nc(C(F)(F)F)oc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 57400504 | 69715 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 327 | 3 | 1 | 4 | 3.6 | Fc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935445 | 69715 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 327 | 3 | 1 | 4 | 3.6 | Fc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57402314 | 69703 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 434 | 5 | 0 | 4 | 4.4 | O=C(CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935433 | 69703 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 434 | 5 | 0 | 4 | 4.4 | O=C(CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57393573 | 69709 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 406 | 7 | 0 | 5 | 3.4 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935439 | 69709 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 406 | 7 | 0 | 5 | 3.4 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 16681693 | 82572 | 1 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 487 | 5 | 1 | 5 | 3.6 | Cc1ccc(C(=O)N2CCC(=CC(=O)N[C@@H]3CCN(Cc4ccc5cc(F)ccc5c4)C3)CC2)nn1 | 10.1021/jm300682j | ||
| CHEMBL2178580 | 82572 | 1 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 487 | 5 | 1 | 5 | 3.6 | Cc1ccc(C(=O)N2CCC(=CC(=O)N[C@@H]3CCN(Cc4ccc5cc(F)ccc5c4)C3)CC2)nn1 | 10.1021/jm300682j | ||
| 52937629 | 61304 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 377 | 6 | 0 | 5 | 3.5 | CCOc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767139 | 61304 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 377 | 6 | 0 | 5 | 3.5 | CCOc1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| 57395286 | 69701 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 394 | 5 | 0 | 4 | 3.5 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935431 | 69701 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 394 | 5 | 0 | 4 | 3.5 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 49836637 | 18678 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 375 | 2 | 1 | 3 | 4.5 | O=C(O)C1=CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277126 | 18678 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 375 | 2 | 1 | 3 | 4.5 | O=C(O)C1=CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 25184832 | 18695 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 349 | 2 | 1 | 3 | 3.8 | O=C(O)C1CN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1277312 | 18695 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 349 | 2 | 1 | 3 | 3.8 | O=C(O)C1CN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 49836409 | 18736 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 391 | 2 | 2 | 3 | 3.5 | O=C(O)C1(O)CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277679 | 18736 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 391 | 2 | 2 | 3 | 3.5 | O=C(O)C1(O)CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49836300 | 18743 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 389 | 2 | 1 | 2 | 4.8 | CC1(C(=O)O)CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277769 | 18743 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 389 | 2 | 1 | 2 | 4.8 | CC1(C(=O)O)CCN(C2CCC3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49836299 | 18744 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | O=C(O)C1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277770 | 18744 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | O=C(O)C1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49834050 | 15732 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 338 | 4 | 1 | 5 | 1.8 | O=C(O)CCN1CCN(C2=Cc3ccccc3Cn3ccnc32)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222553 | 15732 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 338 | 4 | 1 | 5 | 1.8 | O=C(O)CCN1CCN(C2=Cc3ccccc3Cn3ccnc32)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| 49864885 | 15744 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 380 | 4 | 1 | 5 | 2.9 | CC(C)(CN1CCCN(C2=Cc3ccccc3Cn3ccnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222623 | 15744 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 380 | 4 | 1 | 5 | 2.9 | CC(C)(CN1CCCN(C2=Cc3ccccc3Cn3ccnc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| 49833884 | 15762 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 380 | 4 | 1 | 5 | 2.8 | Cc1cn2c(n1)C(N1CCN(CC(C)(C)C(=O)O)CC1)=Cc1ccccc1C2 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222694 | 15762 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 380 | 4 | 1 | 5 | 2.8 | Cc1cn2c(n1)C(N1CCN(CC(C)(C)C(=O)O)CC1)=Cc1ccccc1C2 | 10.1016/j.bmcl.2010.07.029 | ||
| 24803641 | 61324 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 612 | 10 | 0 | 6 | 7.5 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(Cc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| CHEMBL1767159 | 61324 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 612 | 10 | 0 | 6 | 7.5 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C1CCCN(Cc2ccc(OCCCN3CCCCCC3)cc2)CC1 | 10.1021/jm1013874 | ||
| 11497680 | 97852 | 7 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 552 | 6 | 0 | 8 | 6.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6oc(C(F)(F)F)nc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL272150 | 97852 | 7 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 552 | 6 | 0 | 8 | 6.1 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc6oc(C(F)(F)F)nc6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 11519133 | 169423 | 0 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 512 | 7 | 0 | 8 | 5.6 | CCc1nc2c3c(ccc2o1)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL442456 | 169423 | 0 | None | - | 0 | Human | 6.3 | pKi | = | 6.3 | Functional | ChEMBL | 512 | 7 | 0 | 8 | 5.6 | CCc1nc2c3c(ccc2o1)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.042 | ||
| 57398829 | 69702 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 422 | 7 | 0 | 4 | 4.3 | CCN(CC)C(=O)CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935432 | 69702 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 422 | 7 | 0 | 4 | 4.3 | CCN(CC)C(=O)CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 49836633 | 18659 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 347 | 2 | 1 | 2 | 3.6 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1276948 | 18659 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 347 | 2 | 1 | 2 | 3.6 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 52937119 | 61320 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.6 | CN1CCC(Cn2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)C1 | 10.1021/jm1013874 | ||
| CHEMBL1767155 | 61320 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 367 | 4 | 0 | 4 | 3.6 | CN1CCC(Cn2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)C1 | 10.1021/jm1013874 | ||
| 45272895 | 195657 | 18 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 389 | 4 | 0 | 5 | 4.6 | Cc1cnn(C2CCN(c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)c1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL556450 | 195657 | 18 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 389 | 4 | 0 | 5 | 4.6 | Cc1cnn(C2CCN(c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)c1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57400503 | 69714 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 323 | 3 | 1 | 4 | 3.8 | Cc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935444 | 69714 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 323 | 3 | 1 | 4 | 3.8 | Cc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 49836414 | 18794 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 377 | 2 | 1 | 3 | 3.4 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CCO1 | 10.1021/jm100856p | ||
| CHEMBL1278112 | 18794 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 377 | 2 | 1 | 3 | 3.4 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CCO1 | 10.1021/jm100856p | ||
| 49833882 | 15760 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 392 | 3 | 1 | 5 | 3.0 | O=C(O)C1CCC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222692 | 15760 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 392 | 3 | 1 | 5 | 3.0 | O=C(O)C1CCC(N2CCN(C3=Cc4ccccc4Cn4ccnc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.029 | ||
| 52937223 | 61322 | 23 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 381 | 5 | 0 | 4 | 4.1 | CN1CCCC1CCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767157 | 61322 | 23 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 381 | 5 | 0 | 4 | 4.1 | CN1CCCC1CCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 143 | 3515 | 51 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 438 | 5 | 1 | 4 | 4.8 | N#Cc1ccc2c(c1)CCN(C2)CC[C@@H]1CC[C@H](CC1)NC(=O)c1ccnc2c1cccc2 | 10.1016/j.bmcl.2007.12.042 | ||
| 143 | 3515 | 51 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 438 | 5 | 1 | 4 | 4.8 | N#Cc1ccc2c(c1)CCN(C2)CC[C@@H]1CC[C@H](CC1)NC(=O)c1ccnc2c1cccc2 | 10.1016/j.bmcl.2007.12.066 | ||
| 5311096 | 3515 | 51 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 438 | 5 | 1 | 4 | 4.8 | N#Cc1ccc2c(c1)CCN(C2)CC[C@@H]1CC[C@H](CC1)NC(=O)c1ccnc2c1cccc2 | 10.1016/j.bmcl.2007.12.042 | ||
| 5311096 | 3515 | 51 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 438 | 5 | 1 | 4 | 4.8 | N#Cc1ccc2c(c1)CCN(C2)CC[C@@H]1CC[C@H](CC1)NC(=O)c1ccnc2c1cccc2 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL85606 | 3515 | 51 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 438 | 5 | 1 | 4 | 4.8 | N#Cc1ccc2c(c1)CCN(C2)CC[C@@H]1CC[C@H](CC1)NC(=O)c1ccnc2c1cccc2 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL85606 | 3515 | 51 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 438 | 5 | 1 | 4 | 4.8 | N#Cc1ccc2c(c1)CCN(C2)CC[C@@H]1CC[C@H](CC1)NC(=O)c1ccnc2c1cccc2 | 10.1016/j.bmcl.2007.12.066 | ||
| 11569996 | 95312 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 525 | 7 | 0 | 8 | 5.4 | CCc1nn(C)c2cc3c(cc12)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL256477 | 95312 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 525 | 7 | 0 | 8 | 5.4 | CCc1nn(C)c2cc3c(cc12)CCN(CCCSc1nnc(-c2cccc4nc(C)ccc24)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| 11518972 | 155032 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 501 | 6 | 0 | 7 | 5.5 | Cc1noc2cc3c(cc12)CCN(CCCSc1nnc(-c2ccc(C(F)(F)F)cc2)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL401576 | 155032 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 501 | 6 | 0 | 7 | 5.5 | Cc1noc2cc3c(cc12)CCN(CCCSc1nnc(-c2ccc(C(F)(F)F)cc2)n1C)CC3 | 10.1016/j.bmcl.2007.12.066 | ||
| 52937633 | 61309 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 391 | 5 | 0 | 6 | 2.9 | COC(=O)c1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767143 | 61309 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 391 | 5 | 0 | 6 | 2.9 | COC(=O)c1ccc(Cc2nn(C[C@H]3CCCN3C)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| 24803638 | 61330 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 636 | 15 | 0 | 7 | 7.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3CCCCc3ccc(OCCCN4CCCCCC4)cc3)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| CHEMBL1767165 | 61330 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 636 | 15 | 0 | 7 | 7.1 | COc1ccc(Cc2nn(C[C@H]3CCCN3CCCCc3ccc(OCCCN4CCCCCC4)cc3)c(=O)c3ccccc23)cc1 | 10.1021/jm1013874 | ||
| 49836639 | 18684 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 377 | 2 | 1 | 3 | 4.6 | O=C(O)C1CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| CHEMBL1277216 | 18684 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 377 | 2 | 1 | 3 | 4.6 | O=C(O)C1CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | ||
| 49836739 | 18703 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 387 | 2 | 1 | 3 | 4.0 | O=C(O)C1=CCCN(C2CCC3(C2)C(=O)c2ccccc2Cc2ccccc23)C1 | 10.1021/jm100856p | ||
| CHEMBL1277400 | 18703 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 387 | 2 | 1 | 3 | 4.0 | O=C(O)C1=CCCN(C2CCC3(C2)C(=O)c2ccccc2Cc2ccccc23)C1 | 10.1021/jm100856p | ||
| 134139893 | 146413 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 486 | 10 | 0 | 5 | 5.6 | c1cnc2c(N3CCN(CCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| CHEMBL3921827 | 146413 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 486 | 10 | 0 | 5 | 5.6 | c1cnc2c(N3CCN(CCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1 | 10.1016/j.bmcl.2016.11.022 | ||
| 46933091 | 15763 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 400 | 4 | 1 | 5 | 3.1 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3cc(Cl)nc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| CHEMBL1222695 | 15763 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 400 | 4 | 1 | 5 | 3.1 | CC(C)(CN1CCN(C2=Cc3ccccc3Cn3cc(Cl)nc32)CC1)C(=O)O | 10.1016/j.bmcl.2010.07.029 | ||
| 52937734 | 61316 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 339 | 4 | 0 | 4 | 3.6 | CN1CCC[C@@H]1Cn1nc(CC2CCCCC2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| CHEMBL1767151 | 61316 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 339 | 4 | 0 | 4 | 3.6 | CN1CCC[C@@H]1Cn1nc(CC2CCCCC2)c2ccccc2c1=O | 10.1021/jm1013874 | ||
| 49836413 | 18777 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 393 | 2 | 1 | 2 | 4.5 | O=C(O)C1(F)CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| CHEMBL1278019 | 18777 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 393 | 2 | 1 | 2 | 4.5 | O=C(O)C1(F)CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | ||
| 11584660 | 93268 | 8 | None | - | 5 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 537 | 7 | 0 | 8 | 5.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc(-c6cc(C)nn6C)cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL244946 | 93268 | 8 | None | - | 5 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 537 | 7 | 0 | 8 | 5.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc(-c6cc(C)nn6C)cc5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 44454190 | 98065 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 537 | 7 | 0 | 8 | 5.6 | Cc1cc2c(-c3nnc(SCCCN4CCc5ccc(-c6cc(C)nn6C)cc5CC4)n3C)cccc2cn1 | 10.1016/j.bmcl.2007.12.066 | ||
| CHEMBL273199 | 98065 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 537 | 7 | 0 | 8 | 5.6 | Cc1cc2c(-c3nnc(SCCCN4CCc5ccc(-c6cc(C)nn6C)cc5CC4)n3C)cccc2cn1 | 10.1016/j.bmcl.2007.12.066 | ||
| 44454351 | 160607 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 551 | 6 | 0 | 8 | 5.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5nc6cc(C(F)(F)F)ccn6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| CHEMBL411293 | 160607 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 551 | 6 | 0 | 8 | 5.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5nc6cc(C(F)(F)F)ccn6c5CC4)n3C)cccc2n1 | 10.1016/j.bmcl.2007.12.042 | ||
| 57397055 | 69705 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 390 | 5 | 0 | 5 | 4.6 | Fc1ccc(Cn2c(C3CCCN(Cc4ncco4)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935435 | 69705 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 390 | 5 | 0 | 5 | 4.6 | Fc1ccc(Cn2c(C3CCCN(Cc4ncco4)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57395286 | 69701 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 394 | 5 | 0 | 4 | 3.5 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935431 | 69701 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 394 | 5 | 0 | 4 | 3.5 | CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2Cc2ccc(F)cc2)C1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57402230 | 69718 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 339 | 4 | 1 | 5 | 3.5 | COc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935448 | 69718 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 339 | 4 | 1 | 5 | 3.5 | COc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 57400504 | 69715 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 327 | 3 | 1 | 4 | 3.6 | Fc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| CHEMBL1935445 | 69715 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 327 | 3 | 1 | 4 | 3.6 | Fc1ccc(Cn2c(C3CNCCS3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2011.10.115 | ||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 8.1 | pA2 | = | 8.1 | Functional | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | ||
| 249 | 505 | 81 | None | -4 | 42 | Human | 8.1 | pA2 | = | 8.1 | Functional | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | ||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 8.1 | pA2 | = | 8.1 | Functional | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | ||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 8.1 | pA2 | = | 8.1 | Functional | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | ||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 8.1 | pA2 | = | 8.1 | Functional | Drug Central | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | ||
| 1204 | 1932 | 119 | None | -9 | 10 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 1247 | 1932 | 119 | None | -9 | 10 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 1375 | 1932 | 119 | None | -9 | 10 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 774 | 1932 | 119 | None | -9 | 10 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| CHEMBL90 | 1932 | 119 | None | -9 | 10 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| DB05381 | 1932 | 119 | None | -9 | 10 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 1204 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 1247 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 1375 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 774 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| CHEMBL90 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| DB05381 | 1932 | 119 | None | -3 | 10 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Functional | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | ||
| 1427 | 2013 | 54 | None | 5 | 30 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| 357 | 2013 | 54 | None | 5 | 30 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| 3696 | 2013 | 54 | None | 5 | 30 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| CHEMBL11 | 2013 | 54 | None | 5 | 30 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| DB00458 | 2013 | 54 | None | 5 | 30 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| 1971 | 2866 | 38 | None | 6 | 32 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | ||
| 2404 | 2866 | 38 | None | 6 | 32 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | ||
| 4543 | 2866 | 38 | None | 6 | 32 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | ||
| CHEMBL445 | 2866 | 38 | None | 6 | 32 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | ||
| DB00540 | 2866 | 38 | None | 6 | 32 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | ||
| 180 | 401 | 56 | None | 3 | 38 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | ||
| 200 | 401 | 56 | None | 3 | 38 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | ||
| 2160 | 401 | 56 | None | 3 | 38 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | ||
| CHEMBL629 | 401 | 56 | None | 3 | 38 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | ||
| DB00321 | 401 | 56 | None | 3 | 38 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | ||
| 40466858 | 16155 | 67 | None | -5 | 4 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | Drug Central | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | None | ||
| 5284514 | 16155 | 67 | None | -5 | 4 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | Drug Central | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | None | ||
| CHEMBL1224 | 16155 | 67 | None | -5 | 4 | Guinea pig | 8.3 | pIC50 | = | 8.3 | Functional | Drug Central | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | None | ||
| 1599 | 2341 | 50 | None | -3 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | ||
| 3955 | 2341 | 50 | None | -3 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | ||
| 7215 | 2341 | 50 | None | -3 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | ||
| CHEMBL841 | 2341 | 50 | None | -3 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | ||
| DB00836 | 2341 | 50 | None | -3 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | ||
| 4223 | 3992 | 94 | None | -199 | 16 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | None | ||
| 6918314 | 3992 | 94 | None | -199 | 16 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | None | ||
| 7427 | 3992 | 94 | None | -199 | 16 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | None | ||
| CHEMBL439849 | 3992 | 94 | None | -199 | 16 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | None | ||
| DB06684 | 3992 | 94 | None | -199 | 16 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | None | ||
| 40466858 | 16155 | 67 | None | 5 | 4 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | None | ||
| 5284514 | 16155 | 67 | None | 5 | 4 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | None | ||
| CHEMBL1224 | 16155 | 67 | None | 5 | 4 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | None | ||
| 2762 | 3863 | 31 | None | 100 | 9 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | ||
| 5587 | 3863 | 31 | None | 100 | 9 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | ||
| 7318 | 3863 | 31 | None | 100 | 9 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | ||
| CHEMBL1241 | 3863 | 31 | None | 100 | 9 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | ||
| DB00792 | 3863 | 31 | None | 100 | 9 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | ||
| 1427 | 2013 | 54 | None | -19 | 30 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| 357 | 2013 | 54 | None | -19 | 30 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| 3696 | 2013 | 54 | None | -19 | 30 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| CHEMBL11 | 2013 | 54 | None | -19 | 30 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| DB00458 | 2013 | 54 | None | -19 | 30 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | ||
| 2337 | 3256 | 77 | None | -1 | 29 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
| 50 | 3256 | 77 | None | -1 | 29 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
| 5002 | 3256 | 77 | None | -1 | 29 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
| CHEMBL716 | 3256 | 77 | None | -1 | 29 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
| DB01224 | 3256 | 77 | None | -1 | 29 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | ||
| 10103 | 3416 | 72 | None | 28 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | ||
| 133017 | 3416 | 72 | None | 28 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | ||
| 2413 | 3416 | 72 | None | 28 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | ||
| CHEMBL91397 | 3416 | 72 | None | 28 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | ||
| DB11614 | 3416 | 72 | None | 28 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | ||
| 1027 | 1576 | 73 | None | 6 | 7 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | ||
| 3241 | 1576 | 73 | None | 6 | 7 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | ||
| 7176 | 1576 | 73 | None | 6 | 7 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | ||
| CHEMBL1106 | 1576 | 73 | None | 6 | 7 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | ||
| DB00751 | 1576 | 73 | None | 6 | 7 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | ||
| 1224 | 1432 | 83 | None | 85 | 22 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | ||
| 3100 | 1432 | 83 | None | 85 | 22 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | ||
| 8980 | 1432 | 83 | None | 85 | 22 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | ||
| 916 | 1432 | 83 | None | 85 | 22 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | ||
| CHEMBL657 | 1432 | 83 | None | 85 | 22 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | ||
| DB01075 | 1432 | 83 | None | 85 | 22 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | ||
| 2995 | 204405 | 53 | None | 2 | 18 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | ||
| CHEMBL1696 | 204405 | 53 | None | 2 | 18 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | ||
| CHEMBL72 | 204405 | 53 | None | 2 | 18 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | ||
| 2398 | 954 | 62 | None | 2 | 36 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | ||
| 2801 | 954 | 62 | None | 2 | 36 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | ||
| 701 | 954 | 62 | None | 2 | 36 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | ||
| CHEMBL415 | 954 | 62 | None | 2 | 36 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | ||
| DB01242 | 954 | 62 | None | 2 | 36 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | ||
| 4223 | 3992 | 94 | None | -199 | 16 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | 15341484 | ||
| 6918314 | 3992 | 94 | None | -199 | 16 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | 15341484 | ||
| 7427 | 3992 | 94 | None | -199 | 16 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | 15341484 | ||
| CHEMBL439849 | 3992 | 94 | None | -199 | 16 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | 15341484 | ||
| DB06684 | 3992 | 94 | None | -199 | 16 | Human | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 441 | 7 | 2 | 5 | 4.0 | N#Cc1ccc2c(c1)c(CCCCN1CCN(CC1)c1ccc3c(c1)cc(o3)C(=O)N)c[nH]2 | 15341484 | ||
| 2762 | 3863 | 31 | None | 100 | 9 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | ||
| 5587 | 3863 | 31 | None | 100 | 9 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | ||
| 7318 | 3863 | 31 | None | 100 | 9 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | ||
| CHEMBL1241 | 3863 | 31 | None | 100 | 9 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | ||
| DB00792 | 3863 | 31 | None | 100 | 9 | Human | 7.4 | pIC50 | = | 7.4 | Functional | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | ||
| 10103 | 3416 | 72 | None | 28 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 16220969 | ||
| 133017 | 3416 | 72 | None | 28 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 16220969 | ||
| 2413 | 3416 | 72 | None | 28 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 16220969 | ||
| CHEMBL91397 | 3416 | 72 | None | 28 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 16220969 | ||
| DB11614 | 3416 | 72 | None | 28 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 16220969 | ||
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Similar- ity |
Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
Assay Type |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
| 3158 | 56267 | 27 | None | 40 | 20 | Human | 9.0 | pAC50 | = | 9 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1628227 | 56267 | 27 | None | 40 | 20 | Human | 9.0 | pAC50 | = | 9 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 135 | 2532 | 43 | None | -1 | 58 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| 3121 | 7885 | 104 | None | - | 0 | Human | 7.0 | pAC50 | = | 7 | Binding | ChEMBL | 144 | 5 | 1 | 1 | 2.3 | CCCC(CCC)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL109 | 7885 | 104 | None | - | 0 | Human | 7.0 | pAC50 | = | 7 | Binding | ChEMBL | 144 | 5 | 1 | 1 | 2.3 | CCCC(CCC)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL433 | 7885 | 104 | None | - | 0 | Human | 7.0 | pAC50 | = | 7 | Binding | ChEMBL | 144 | 5 | 1 | 1 | 2.3 | CCCC(CCC)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 213 | 3853 | 55 | None | -8 | 44 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2717 | 3853 | 55 | None | -8 | 44 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 5533 | 3853 | 55 | None | -8 | 44 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL621 | 3853 | 55 | None | -8 | 44 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00656 | 3853 | 55 | None | -8 | 44 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 3689 | 102771 | 55 | None | - | 0 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1372983 | 102771 | 55 | None | - | 0 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL305187 | 102771 | 55 | None | - | 0 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 42890 | 9425 | 59 | None | - | 0 | Human | 5.0 | pAC50 | = | 5 | Binding | ChEMBL | 497 | 3 | 5 | 10 | 1.0 | CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1ccccc1C3=O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1117 | 9425 | 59 | None | - | 0 | Human | 5.0 | pAC50 | = | 5 | Binding | ChEMBL | 497 | 3 | 5 | 10 | 1.0 | CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1ccccc1C3=O | 10.1038/s41467-023-40064-9 | |||
| 44139752 | 104284 | 45 | None | - | 0 | Human | 5.0 | pAC50 | = | 5 | Binding | ChEMBL | 227 | 1 | 0 | 3 | 2.4 | N#Cc1ccc([C@H]2CCc3cncn32)c(F)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3099695 | 104284 | 45 | None | - | 0 | Human | 5.0 | pAC50 | = | 5 | Binding | ChEMBL | 227 | 1 | 0 | 3 | 2.4 | N#Cc1ccc([C@H]2CCc3cncn32)c(F)c1 | 10.1038/s41467-023-40064-9 | |||
| 2477 | 745 | 59 | None | - | 29 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 385 | 6 | 0 | 6 | 2.1 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1 | 10.1038/s41467-023-40064-9 | |||
| 36 | 745 | 59 | None | - | 29 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 385 | 6 | 0 | 6 | 2.1 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1 | 10.1038/s41467-023-40064-9 | |||
| 437 | 745 | 59 | None | - | 29 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 385 | 6 | 0 | 6 | 2.1 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL49 | 745 | 59 | None | - | 29 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 385 | 6 | 0 | 6 | 2.1 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1 | 10.1038/s41467-023-40064-9 | |||
| DB00490 | 745 | 59 | None | - | 29 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 385 | 6 | 0 | 6 | 2.1 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1 | 10.1038/s41467-023-40064-9 | |||
| 11693 | 1827 | 16 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 3494 | 1827 | 16 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 4302 | 1827 | 16 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 7459 | 1827 | 16 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201335 | 1827 | 16 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| DB00986 | 1827 | 16 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 5048 | 3133 | 64 | None | -109 | 7 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 8924 | 3133 | 64 | None | -109 | 7 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 9948102 | 3133 | 64 | None | -109 | 7 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL462605 | 3133 | 64 | None | -109 | 7 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| DB11642 | 3133 | 64 | None | -109 | 7 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 4846 | 27987 | 53 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 308 | 1 | 2 | 6 | 2.2 | O=C(O)c1cc(O)c2c3nc4ccccc4oc-3cc(=O)c2n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1372341 | 27987 | 53 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 308 | 1 | 2 | 6 | 2.2 | O=C(O)c1cc(O)c2c3nc4ccccc4oc-3cc(=O)c2n1 | 10.1038/s41467-023-40064-9 | |||
| 5284632 | 67402 | 13 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 392 | 4 | 1 | 3 | 3.8 | O=C(O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]21CCCC1)C(O)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1888176 | 67402 | 13 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 392 | 4 | 1 | 3 | 3.8 | O=C(O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]21CCCC1)C(O)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3084748 | 67402 | 13 | None | - | 5 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 392 | 4 | 1 | 3 | 3.8 | O=C(O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]21CCCC1)C(O)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 1549120 | 196486 | 85 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 319 | 4 | 1 | 4 | 2.9 | CC(/C=C1\SC(=S)N(CC(=O)O)C1=O)=C\c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL56337 | 196486 | 85 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 319 | 4 | 1 | 4 | 2.9 | CC(/C=C1\SC(=S)N(CC(=O)O)C1=O)=C\c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| 2564 | 206184 | 51 | None | -2 | 3 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL864 | 206184 | 51 | None | -2 | 3 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| 6337614 | 12996 | 54 | None | - | 0 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 296 | 1 | 0 | 2 | 2.7 | O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1189679 | 12996 | 54 | None | - | 0 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 296 | 1 | 0 | 2 | 2.7 | O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 4260 | 52558 | 31 | None | - | 0 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 279 | 6 | 0 | 4 | 3.0 | CC(=O)Oc1cc(C(C)C)c(OCCN(C)C)cc1C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL159226 | 52558 | 31 | None | - | 0 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 279 | 6 | 0 | 4 | 3.0 | CC(=O)Oc1cc(C(C)C)c(OCCN(C)C)cc1C | 10.1038/s41467-023-40064-9 | |||
| 4034 | 55822 | 55 | None | - | 1 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 390 | 5 | 0 | 2 | 5.6 | Cc1cccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1623 | 55822 | 55 | None | - | 1 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 390 | 5 | 0 | 2 | 5.6 | Cc1cccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)c1 | 10.1038/s41467-023-40064-9 | |||
| 5656 | 203066 | 87 | None | -79 | 40 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL637 | 203066 | 87 | None | -79 | 40 | Human | 6.0 | pAC50 | = | 6.0 | Binding | ChEMBL | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 214 | 3860 | 58 | None | -43 | 30 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 2740 | 3860 | 58 | None | -43 | 30 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 5566 | 3860 | 58 | None | -43 | 30 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 66064 | 3860 | 58 | None | -43 | 30 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL422 | 3860 | 58 | None | -43 | 30 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB00831 | 3860 | 58 | None | -43 | 30 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 367 | 3824 | 12 | None | - | 8 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | |||
| 5487427 | 3824 | 12 | None | - | 8 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | |||
| 8592 | 3824 | 12 | None | - | 8 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1900528 | 3824 | 12 | None | - | 8 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3305968 | 3824 | 12 | None | - | 8 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL4650755 | 3824 | 12 | None | - | 8 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | |||
| DB01409 | 3824 | 12 | None | - | 8 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 392 | 4 | 1 | 6 | 2.3 | O=C(C(c1cccs1)(c1cccs1)O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1038/s41467-023-40064-9 | |||
| 2218 | 15283 | 23 | None | - | 0 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 322 | 8 | 0 | 2 | 4.4 | CCN(CC)CCCN(c1ccccc1)C1Cc2ccccc2C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1213033 | 15283 | 23 | None | - | 0 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 322 | 8 | 0 | 2 | 4.4 | CCN(CC)CCCN(c1ccccc1)C1Cc2ccccc2C1 | 10.1038/s41467-023-40064-9 | |||
| 1613 | 2348 | 53 | None | -3 | 44 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 205 | 2348 | 53 | None | -3 | 44 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 3964 | 2348 | 53 | None | -3 | 44 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL831 | 2348 | 53 | None | -3 | 44 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| DB00408 | 2348 | 53 | None | -3 | 44 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1038/s41467-023-40064-9 | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1038/s41467-023-40064-9 | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1038/s41467-023-40064-9 | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1038/s41467-023-40064-9 | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1038/s41467-023-40064-9 | |||
| 260 | 3869 | 54 | None | - | 5 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 284 | 2 | 1 | 3 | 3.0 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c1c[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2775 | 3869 | 54 | None | - | 5 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 284 | 2 | 1 | 3 | 3.0 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c1c[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 656665 | 3869 | 54 | None | - | 5 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 284 | 2 | 1 | 3 | 3.0 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c1c[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL56564 | 3869 | 54 | None | - | 5 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 284 | 2 | 1 | 3 | 3.0 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c1c[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB11699 | 3869 | 54 | None | - | 5 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 284 | 2 | 1 | 3 | 3.0 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c1c[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 3149 | 12614 | 15 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 334 | 15 | 0 | 1 | 6.1 | CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1187011 | 12614 | 15 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 334 | 15 | 0 | 1 | 6.1 | CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 7029 | 13669 | 19 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 205 | 5 | 0 | 2 | 2.6 | CCN(CC)C(C)C(=O)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1194666 | 13669 | 19 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 205 | 5 | 0 | 2 | 2.6 | CCN(CC)C(C)C(=O)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 11980903 | 14492 | 19 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 382 | 4 | 0 | 2 | 5.3 | Cc1cc(/C=C/c2ccc3cc(N(C)C)ccc3[n+]2C)c(C)n1-c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 22526 | 14492 | 19 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 382 | 4 | 0 | 2 | 5.3 | Cc1cc(/C=C/c2ccc3cc(N(C)C)ccc3[n+]2C)c(C)n1-c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 5281035 | 14492 | 19 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 382 | 4 | 0 | 2 | 5.3 | Cc1cc(/C=C/c2ccc3cc(N(C)C)ccc3[n+]2C)c(C)n1-c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201303 | 14492 | 19 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 382 | 4 | 0 | 2 | 5.3 | Cc1cc(/C=C/c2ccc3cc(N(C)C)ccc3[n+]2C)c(C)n1-c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 54841 | 203127 | 52 | None | -2 | 27 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL641 | 203127 | 52 | None | -2 | 27 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 10531 | 1420 | 21 | None | - | 23 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 583 | 4 | 3 | 6 | 2.1 | CN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1038/s41467-023-40064-9 | |||
| 121 | 1420 | 21 | None | - | 23 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 583 | 4 | 3 | 6 | 2.1 | CN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1038/s41467-023-40064-9 | |||
| 888 | 1420 | 21 | None | - | 23 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 583 | 4 | 3 | 6 | 2.1 | CN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1732 | 1420 | 21 | None | - | 23 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 583 | 4 | 3 | 6 | 2.1 | CN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1038/s41467-023-40064-9 | |||
| DB00320 | 1420 | 21 | None | - | 23 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 583 | 4 | 3 | 6 | 2.1 | CN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N[C@]1(C)O[C@@]2(N(C1=O)[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CCC1)O | 10.1038/s41467-023-40064-9 | |||
| 135398747 | 33453 | 24 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 137 | 1 | 1 | 2 | 0.3 | C[n+]1ccccc1C=NO | 10.1038/s41467-023-40064-9 | |||
| 135484646 | 33453 | 24 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 137 | 1 | 1 | 2 | 0.3 | C[n+]1ccccc1C=NO | 10.1038/s41467-023-40064-9 | |||
| 4884 | 33453 | 24 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 137 | 1 | 1 | 2 | 0.3 | C[n+]1ccccc1C=NO | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1420 | 33453 | 24 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 137 | 1 | 1 | 2 | 0.3 | C[n+]1ccccc1C=NO | 10.1038/s41467-023-40064-9 | |||
| 180 | 401 | 56 | None | -1 | 40 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 200 | 401 | 56 | None | -1 | 40 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 2160 | 401 | 56 | None | -1 | 40 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL629 | 401 | 56 | None | -1 | 40 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00321 | 401 | 56 | None | -1 | 40 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| 1201549 | 597 | 24 | None | -1 | 20 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 333 | 597 | 24 | None | -1 | 20 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 7601 | 597 | 24 | None | -1 | 20 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201203 | 597 | 24 | None | -1 | 20 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL438151 | 597 | 24 | None | -1 | 20 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00245 | 597 | 24 | None | -1 | 20 | Human | 7.9 | pAC50 | = | 7.9 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 2318 | 154856 | 29 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 351 | 7 | 1 | 3 | 4.1 | CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL400599 | 154856 | 29 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 351 | 7 | 1 | 3 | 4.1 | CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 2402 | 3370 | 62 | None | - | 24 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | 10.1038/s41467-023-40064-9 | |||
| 5095 | 3370 | 62 | None | - | 24 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | 10.1038/s41467-023-40064-9 | |||
| 7295 | 3370 | 62 | None | - | 24 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL589 | 3370 | 62 | None | - | 24 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | 10.1038/s41467-023-40064-9 | |||
| DB00268 | 3370 | 62 | None | - | 24 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | 10.1038/s41467-023-40064-9 | |||
| 2274 | 3173 | 58 | None | -3 | 31 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 4917 | 3173 | 58 | None | -3 | 31 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 7279 | 3173 | 58 | None | -3 | 31 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL728 | 3173 | 58 | None | -3 | 31 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| DB00433 | 3173 | 58 | None | -3 | 31 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 2995 | 204405 | 53 | None | -14 | 23 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1696 | 204405 | 53 | None | -14 | 23 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL72 | 204405 | 53 | None | -14 | 23 | Human | 6.9 | pAC50 | = | 6.9 | Binding | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 16362 | 3125 | 71 | None | -489 | 30 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2172 | 3125 | 71 | None | -489 | 30 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 90 | 3125 | 71 | None | -489 | 30 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1423 | 3125 | 71 | None | -489 | 30 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB01100 | 3125 | 71 | None | -489 | 30 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2470 | 3653 | 50 | None | -4570 | 59 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3300 | 3653 | 50 | None | -4570 | 59 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 5265 | 3653 | 50 | None | -4570 | 59 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 99 | 3653 | 50 | None | -4570 | 59 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL267930 | 3653 | 50 | None | -4570 | 59 | Human | 5.9 | pAC50 | = | 5.9 | Binding | ChEMBL | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 10007 | 14484 | 38 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 183 | 2 | 1 | 1 | 2.6 | CC(C)(N)Cc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201269 | 14484 | 38 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 183 | 2 | 1 | 1 | 2.6 | CC(C)(N)Cc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 20628 | 96548 | 28 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 324 | 6 | 1 | 5 | 3.7 | CN(C)CCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL26291 | 96548 | 28 | None | - | 0 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 324 | 6 | 1 | 5 | 3.7 | CN(C)CCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12 | 10.1038/s41467-023-40064-9 | |||
| 5365247 | 138429 | 33 | None | - | 1 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 316 | 4 | 0 | 2 | 3.8 | CN(C)C/C=C(/c1ccc(Br)cc1)c1cccnc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL37744 | 138429 | 33 | None | - | 1 | Human | 4.9 | pAC50 | = | 4.9 | Binding | ChEMBL | 316 | 4 | 0 | 2 | 3.8 | CN(C)C/C=C(/c1ccc(Br)cc1)c1cccnc1 | 10.1038/s41467-023-40064-9 | |||
| 21772 | 78399 | 31 | None | - | 0 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 293 | 4 | 0 | 1 | 4.5 | CC(CC1c2ccccc2CCc2ccccc21)CN(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2110816 | 78399 | 31 | None | - | 0 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 293 | 4 | 0 | 1 | 4.5 | CC(CC1c2ccccc2CCc2ccccc21)CN(C)C | 10.1038/s41467-023-40064-9 | |||
| 228 | 445 | 28 | None | - | 24 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 267 | 0 | 2 | 3 | 2.9 | CN1CCc2c3[C@H]1Cc1ccc(c(c1c3ccc2)O)O | 10.1038/s41467-023-40064-9 | |||
| 33 | 445 | 28 | None | - | 24 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 267 | 0 | 2 | 3 | 2.9 | CN1CCc2c3[C@H]1Cc1ccc(c(c1c3ccc2)O)O | 10.1038/s41467-023-40064-9 | |||
| 6005 | 445 | 28 | None | - | 24 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 267 | 0 | 2 | 3 | 2.9 | CN1CCc2c3[C@H]1Cc1ccc(c(c1c3ccc2)O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL53 | 445 | 28 | None | - | 24 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 267 | 0 | 2 | 3 | 2.9 | CN1CCc2c3[C@H]1Cc1ccc(c(c1c3ccc2)O)O | 10.1038/s41467-023-40064-9 | |||
| DB00714 | 445 | 28 | None | - | 24 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 267 | 0 | 2 | 3 | 2.9 | CN1CCc2c3[C@H]1Cc1ccc(c(c1c3ccc2)O)O | 10.1038/s41467-023-40064-9 | |||
| 2264 | 53190 | 38 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 349 | 2 | 1 | 4 | 1.5 | CN1C(=O)COc2c(C(=O)NC3CN4CCC3CC4)cc(Cl)cc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1598608 | 53190 | 38 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 349 | 2 | 1 | 4 | 1.5 | CN1C(=O)COc2c(C(=O)NC3CN4CCC3CC4)cc(Cl)cc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL5292015 | 194537 | 0 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 398 | 6 | 1 | 3 | 3.6 | C[N@+]1(CCF)[C@@H]2CC[C@H]1C[C@@H](OC(=O)C(O)(c1ccccc1)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| 55483 | 205097 | 40 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 356 | 13 | 4 | 4 | 3.6 | Oc1ccc(CCNCCCCCCNCCc2ccccc2)cc1O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL77622 | 205097 | 40 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 356 | 13 | 4 | 4 | 3.6 | Oc1ccc(CCNCCCCCCNCCc2ccccc2)cc1O | 10.1038/s41467-023-40064-9 | |||
| 4066 | 204626 | 78 | None | -1 | 7 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL73451 | 204626 | 78 | None | -1 | 7 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 156419 | 938 | 74 | None | - | 1 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3308 | 938 | 74 | None | - | 1 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 647 | 938 | 74 | None | - | 1 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201284 | 938 | 74 | None | - | 1 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB01012 | 938 | 74 | None | - | 1 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3042 | 1414 | 35 | None | - | 14 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| 355 | 1414 | 35 | None | - | 14 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| 868 | 1414 | 35 | None | - | 14 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1123 | 1414 | 35 | None | - | 14 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| DB00804 | 1414 | 35 | None | - | 14 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| 2169 | 44847 | 35 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 380 | 9 | 3 | 6 | 1.4 | COc1ccccc1OCCNCC(O)c1ccc(C)c(S(N)(=O)=O)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL152231 | 44847 | 35 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 380 | 9 | 3 | 6 | 1.4 | COc1ccccc1OCCNCC(O)c1ccc(C)c(S(N)(=O)=O)c1 | 10.1038/s41467-023-40064-9 | |||
| 1427 | 2013 | 54 | None | -5 | 27 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 357 | 2013 | 54 | None | -5 | 27 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 3696 | 2013 | 54 | None | -5 | 27 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL11 | 2013 | 54 | None | -5 | 27 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00458 | 2013 | 54 | None | -5 | 27 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 40466858 | 16155 | 67 | None | - | 0 | Human | 6.8 | pAC50 | = | 6.8 | Binding | ChEMBL | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 5284514 | 16155 | 67 | None | - | 0 | Human | 6.8 | pAC50 | = | 6.8 | Binding | ChEMBL | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1224 | 16155 | 67 | None | - | 0 | Human | 6.8 | pAC50 | = | 6.8 | Binding | ChEMBL | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 5440 | 28724 | 37 | None | -1 | 9 | Human | 6.8 | pAC50 | = | 6.8 | Binding | ChEMBL | 399 | 6 | 0 | 5 | 5.0 | CCSc1ccc2c(c1)N(CCCN1CCN(C)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1378 | 28724 | 37 | None | -1 | 9 | Human | 6.8 | pAC50 | = | 6.8 | Binding | ChEMBL | 399 | 6 | 0 | 5 | 5.0 | CCSc1ccc2c(c1)N(CCCN1CCN(C)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| 2142 | 3096 | 58 | None | -263 | 36 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1038/s41467-023-40064-9 | |||
| 4920903 | 3096 | 58 | None | -263 | 36 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1038/s41467-023-40064-9 | |||
| 502 | 3096 | 58 | None | -263 | 36 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1038/s41467-023-40064-9 | |||
| 5775 | 3096 | 58 | None | -263 | 36 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL597 | 3096 | 58 | None | -263 | 36 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1038/s41467-023-40064-9 | |||
| DB00692 | 3096 | 58 | None | -263 | 36 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1038/s41467-023-40064-9 | |||
| 4632 | 56058 | 115 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 228 | 3 | 1 | 3 | 2.6 | COc1ccc(C(=O)c2ccccc2)c(O)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1625 | 56058 | 115 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 228 | 3 | 1 | 3 | 2.6 | COc1ccc(C(=O)c2ccccc2)c(O)c1 | 10.1038/s41467-023-40064-9 | |||
| 3704 | 78189 | 41 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 231 | 3 | 1 | 3 | 1.6 | C1=Cc2cccc(OCC3CNCCO3)c2C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2105022 | 78189 | 41 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 231 | 3 | 1 | 3 | 1.6 | C1=Cc2cccc(OCC3CNCCO3)c2C1 | 10.1038/s41467-023-40064-9 | |||
| 4942 | 5718 | 50 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 367 | 7 | 0 | 4 | 4.0 | CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1078261 | 5718 | 50 | None | - | 0 | Human | 4.8 | pAC50 | = | 4.8 | Binding | ChEMBL | 367 | 7 | 0 | 4 | 4.0 | CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 1971 | 2866 | 38 | None | -1 | 30 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2404 | 2866 | 38 | None | -1 | 30 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 4543 | 2866 | 38 | None | -1 | 30 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL445 | 2866 | 38 | None | -1 | 30 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00540 | 2866 | 38 | None | -1 | 30 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 1228 | 3866 | 34 | None | -5 | 4 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| 2763 | 3866 | 34 | None | -5 | 4 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| 5282443 | 3866 | 34 | None | -5 | 4 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL855 | 3866 | 34 | None | -5 | 4 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| DB00427 | 3866 | 34 | None | -5 | 4 | Human | 7.8 | pAC50 | = | 7.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 5.8 | pAC50 | = | 5.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| 30323 | 62485 | 57 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 527 | 4 | 5 | 11 | 1.0 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1563 | 62485 | 57 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 527 | 4 | 5 | 11 | 1.0 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL178 | 62485 | 57 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 527 | 4 | 5 | 11 | 1.0 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1 | 10.1038/s41467-023-40064-9 | |||
| 2812 | 4779 | 101 | None | -28 | 34 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL104 | 4779 | 101 | None | -28 | 34 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1038/s41467-023-40064-9 | |||
| 72093 | 35061 | 9 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 483 | 16 | 1 | 4 | 6.3 | CCCCCCCCOc1ccccc1C(=O)Nc1ccc(C(=O)OCC[N+](C)(CC)CC)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1433361 | 35061 | 9 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 483 | 16 | 1 | 4 | 6.3 | CCCCCCCCOc1ccccc1C(=O)Nc1ccc(C(=O)OCC[N+](C)(CC)CC)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2103773 | 35061 | 9 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 483 | 16 | 1 | 4 | 6.3 | CCCCCCCCOc1ccccc1C(=O)Nc1ccc(C(=O)OCC[N+](C)(CC)CC)cc1 | 10.1038/s41467-023-40064-9 | |||
| 5284550 | 41721 | 15 | None | -1 | 9 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1492500 | 41721 | 15 | None | -1 | 9 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 4640 | 78266 | 30 | None | - | 0 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 3.9 | COc1cc2[nH]c(C)c(CCN3CCN(c4ccccc4)CC3)c2cc1OC | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2107011 | 78266 | 30 | None | - | 0 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 3.9 | COc1cc2[nH]c(C)c(CCN3CCN(c4ccccc4)CC3)c2cc1OC | 10.1038/s41467-023-40064-9 | |||
| 2771 | 195017 | 74 | None | -2 | 27 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1200781 | 195017 | 74 | None | -2 | 27 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL549 | 195017 | 74 | None | -2 | 27 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | |||
| 46780481 | 107531 | 20 | None | -13 | 53 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | 10.1038/s41467-023-40064-9 | |||
| 9903970 | 107531 | 20 | None | -13 | 53 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3187365 | 107531 | 20 | None | -13 | 53 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3544974 | 107531 | 20 | None | -13 | 53 | Human | 8.7 | pAC50 | = | 8.7 | Binding | ChEMBL | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | 10.1038/s41467-023-40064-9 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 16351 | 102730 | 47 | None | - | 6 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL304902 | 102730 | 47 | None | - | 6 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 225609 | 14452 | 56 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 422 | 3 | 2 | 6 | 2.4 | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201010 | 14452 | 56 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 422 | 3 | 2 | 6 | 2.4 | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C | 10.1038/s41467-023-40064-9 | |||
| 216416 | 111581 | 48 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 413 | 6 | 1 | 3 | 5.7 | Oc1ccc2c(c1)CC[C@H](c1ccccc1)[C@@H]2c1ccc(OCCN2CCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL328190 | 111581 | 48 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 413 | 6 | 1 | 3 | 5.7 | Oc1ccc2c(c1)CC[C@H](c1ccccc1)[C@@H]2c1ccc(OCCN2CCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2895 | 203592 | 41 | None | -1 | 8 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL669 | 203592 | 41 | None | -1 | 8 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 1524 | 2181 | 96 | None | -2 | 52 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 197 | 2181 | 96 | None | -2 | 52 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 3822 | 2181 | 96 | None | -2 | 52 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 88 | 2181 | 96 | None | -2 | 52 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL51 | 2181 | 96 | None | -2 | 52 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB12465 | 2181 | 96 | None | -2 | 52 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2601 | 3780 | 33 | None | - | 21 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | |||
| 443951 | 3780 | 33 | None | - | 21 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | |||
| 56 | 3780 | 33 | None | - | 21 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | |||
| CHEMBL73151 | 3780 | 33 | None | - | 21 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | |||
| DB13399 | 3780 | 33 | None | - | 21 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1038/s41467-023-40064-9 | |||
| 6729 | 14485 | 41 | None | - | 0 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 432 | 5 | 0 | 2 | 6.5 | CC(C)(C)c1ccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201271 | 14485 | 41 | None | - | 0 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 432 | 5 | 0 | 2 | 6.5 | CC(C)(C)c1ccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 24826799 | 10798 | 104 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 532 | 4 | 1 | 6 | 4.5 | Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cccnn12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1171837 | 10798 | 104 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 532 | 4 | 1 | 6 | 4.5 | Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cccnn12 | 10.1038/s41467-023-40064-9 | |||
| 107771 | 120248 | 49 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 517 | 7 | 2 | 7 | 6.1 | COc1ccc2nc3cc(Cl)ccc3c(Nc3cc(CN4CCCC4)c(O)c(CN4CCCC4)c3)c2n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL35228 | 120248 | 49 | None | - | 0 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 517 | 7 | 2 | 7 | 6.1 | COc1ccc2nc3cc(Cl)ccc3c(Nc3cc(CN4CCCC4)c(O)c(CN4CCCC4)c3)c2n1 | 10.1038/s41467-023-40064-9 | |||
| 240 | 944 | 43 | None | - | 24 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 465 | 9 | 2 | 6 | 3.4 | COC1CN(CCCOc2ccc(cc2)F)CCC1NC(=O)c1cc(Cl)c(cc1OC)N | 10.1038/s41467-023-40064-9 | |||
| 2769 | 944 | 43 | None | - | 24 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 465 | 9 | 2 | 6 | 3.4 | COC1CN(CCCOc2ccc(cc2)F)CCC1NC(=O)c1cc(Cl)c(cc1OC)N | 10.1038/s41467-023-40064-9 | |||
| 44279790 | 944 | 43 | None | - | 24 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 465 | 9 | 2 | 6 | 3.4 | COC1CN(CCCOc2ccc(cc2)F)CCC1NC(=O)c1cc(Cl)c(cc1OC)N | 10.1038/s41467-023-40064-9 | |||
| 660 | 944 | 43 | None | - | 24 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 465 | 9 | 2 | 6 | 3.4 | COC1CN(CCCOc2ccc(cc2)F)CCC1NC(=O)c1cc(Cl)c(cc1OC)N | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1729 | 944 | 43 | None | - | 24 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 465 | 9 | 2 | 6 | 3.4 | COC1CN(CCCOc2ccc(cc2)F)CCC1NC(=O)c1cc(Cl)c(cc1OC)N | 10.1038/s41467-023-40064-9 | |||
| CHEMBL560739 | 944 | 43 | None | - | 24 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 465 | 9 | 2 | 6 | 3.4 | COC1CN(CCCOc2ccc(cc2)F)CCC1NC(=O)c1cc(Cl)c(cc1OC)N | 10.1038/s41467-023-40064-9 | |||
| DB00604 | 944 | 43 | None | - | 24 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 465 | 9 | 2 | 6 | 3.4 | COC1CN(CCCOc2ccc(cc2)F)CCC1NC(=O)c1cc(Cl)c(cc1OC)N | 10.1038/s41467-023-40064-9 | |||
| 104850 | 3330 | 96 | None | - | 5 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 462 | 4 | 1 | 4 | 5.9 | Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 4150 | 3330 | 96 | None | - | 5 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 462 | 4 | 1 | 4 | 5.9 | Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 743 | 3330 | 96 | None | - | 5 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 462 | 4 | 1 | 4 | 5.9 | Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL111 | 3330 | 96 | None | - | 5 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 462 | 4 | 1 | 4 | 5.9 | Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| DB06155 | 3330 | 96 | None | - | 5 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 462 | 4 | 1 | 4 | 5.9 | Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 444 | 206666 | 53 | None | -2089 | 18 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 239 | 3 | 1 | 2 | 3.3 | CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL894 | 206666 | 53 | None | -2089 | 18 | Human | 4.7 | pAC50 | = | 4.7 | Binding | ChEMBL | 239 | 3 | 1 | 2 | 3.3 | CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1 | 10.1038/s41467-023-40064-9 | |||
| 2726 | 919 | 68 | None | -2 | 72 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 621 | 919 | 68 | None | -2 | 72 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 83 | 919 | 68 | None | -2 | 72 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL71 | 919 | 68 | None | -2 | 72 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00477 | 919 | 68 | None | -2 | 72 | Human | 7.7 | pAC50 | = | 7.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 21722 | 17992 | 31 | None | 1 | 6 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL126224 | 17992 | 31 | None | 1 | 6 | Human | 6.7 | pAC50 | = | 6.7 | Binding | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | |||
| 2200 | 20203 | 61 | None | - | 2 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1256819 | 20203 | 61 | None | - | 2 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1305 | 20203 | 61 | None | - | 2 | Human | 5.7 | pAC50 | = | 5.7 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 1164 | 1630 | 26 | None | - | 12 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 1626 | 1630 | 26 | None | - | 12 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3345 | 1630 | 26 | None | - | 12 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL596 | 1630 | 26 | None | - | 12 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00813 | 1630 | 26 | None | - | 12 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 46220502 | 112583 | 84 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 506 | 7 | 1 | 8 | 4.9 | CCN1CCN(Cc2ccc(Nc3ncc(F)c(-c4cc(F)c5nc(C)n(C(C)C)c5c4)n3)nc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3301610 | 112583 | 84 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 506 | 7 | 1 | 8 | 4.9 | CCN1CCN(Cc2ccc(Nc3ncc(F)c(-c4cc(F)c5nc(C)n(C(C)C)c5c4)n3)nc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 68617 | 205527 | 62 | None | -1023 | 26 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1709 | 205527 | 62 | None | -1023 | 26 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL809 | 205527 | 62 | None | -1023 | 26 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 176 | 398 | 66 | None | - | 31 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2157 | 398 | 66 | None | - | 31 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2566 | 398 | 66 | None | - | 31 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL633 | 398 | 66 | None | - | 31 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB01118 | 398 | 66 | None | - | 31 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2381 | 663 | 48 | None | - | 8 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 374 | 663 | 48 | None | - | 8 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 7128 | 663 | 48 | None | - | 8 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1101 | 663 | 48 | None | - | 8 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| DB00810 | 663 | 48 | None | - | 8 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 2267 | 559 | 71 | None | 10 | 7 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 271 | 559 | 71 | None | 10 | 7 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 7121 | 559 | 71 | None | 10 | 7 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL639 | 559 | 71 | None | 10 | 7 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00972 | 559 | 71 | None | 10 | 7 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 65709 | 59881 | 39 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 365 | 8 | 0 | 5 | 3.3 | CCN(CC)CCn1c(=O)c(Cc2ccc(OC)cc2)nc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1729803 | 59881 | 39 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 365 | 8 | 0 | 5 | 3.3 | CCN(CC)CCn1c(=O)c(Cc2ccc(OC)cc2)nc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 71481097 | 120510 | 48 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 443 | 5 | 2 | 7 | 3.4 | O=C(/C=C\n1cnc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1)NNc1cnccn1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3545185 | 120510 | 48 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 443 | 5 | 2 | 7 | 3.4 | O=C(/C=C\n1cnc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1)NNc1cnccn1 | 10.1038/s41467-023-40064-9 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 150 | 2509 | 21 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 339 | 4 | 3 | 3 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CO | 10.1038/s41467-023-40064-9 | |||
| 1764 | 2509 | 21 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 339 | 4 | 3 | 3 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CO | 10.1038/s41467-023-40064-9 | |||
| 8226 | 2509 | 21 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 339 | 4 | 3 | 3 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CO | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201356 | 2509 | 21 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 339 | 4 | 3 | 3 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CO | 10.1038/s41467-023-40064-9 | |||
| DB00353 | 2509 | 21 | None | - | 16 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 339 | 4 | 3 | 3 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CO | 10.1038/s41467-023-40064-9 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1038/s41467-023-40064-9 | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1038/s41467-023-40064-9 | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1038/s41467-023-40064-9 | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1038/s41467-023-40064-9 | |||
| 4832 | 55420 | 17 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 354 | 5 | 1 | 3 | 3.1 | CC[N+]1(C)CCCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1619528 | 55420 | 17 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 354 | 5 | 1 | 3 | 3.1 | CC[N+]1(C)CCCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)C1 | 10.1038/s41467-023-40064-9 | |||
| 68867 | 78173 | 38 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 402 | 7 | 2 | 6 | 3.1 | CCOc1cc(N)c([N+](=O)[O-])cc1C(=O)NC1CCN(CC2CC=CCC2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2104523 | 78173 | 38 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 402 | 7 | 2 | 6 | 3.1 | CCOc1cc(N)c([N+](=O)[O-])cc1C(=O)NC1CCN(CC2CC=CCC2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 60065 | 84369 | 6 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 505 | 7 | 1 | 8 | 4.2 | COC(=O)C1=C(C)NC(C)=C(C(=O)O[C@@H]2CCCN(Cc3ccccc3)C2)C1c1cccc([N+](=O)[O-])c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2218858 | 84369 | 6 | None | - | 0 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 505 | 7 | 1 | 8 | 4.2 | COC(=O)C1=C(C)NC(C)=C(C(=O)O[C@@H]2CCCN(Cc3ccccc3)C2)C1c1cccc([N+](=O)[O-])c1 | 10.1038/s41467-023-40064-9 | |||
| 146570 | 43454 | 67 | None | -1 | 4 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1508 | 43454 | 67 | None | -1 | 4 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | 10.1038/s41467-023-40064-9 | |||
| 1212 | 1662 | 50 | None | -41 | 65 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 204 | 1662 | 50 | None | -41 | 65 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3372 | 1662 | 50 | None | -41 | 65 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL726 | 1662 | 50 | None | -41 | 65 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB00623 | 1662 | 50 | None | -41 | 65 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 5311507 | 194815 | 41 | None | - | 1 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 400 | 5 | 1 | 4 | 4.2 | OCCN1CCN(CC/C=C2/c3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL53904 | 194815 | 41 | None | - | 1 | Human | 7.6 | pAC50 | = | 7.6 | Binding | ChEMBL | 400 | 5 | 1 | 4 | 4.2 | OCCN1CCN(CC/C=C2/c3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 55645 | 84370 | 8 | None | - | 0 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 395 | 7 | 2 | 4 | 2.1 | CCCN1CC(NS(=O)(=O)N(CC)CC)CC2Cc3c(O)cccc3CC21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2218861 | 84370 | 8 | None | - | 0 | Human | 5.6 | pAC50 | = | 5.6 | Binding | ChEMBL | 395 | 7 | 2 | 4 | 2.1 | CCCN1CC(NS(=O)(=O)N(CC)CC)CC2Cc3c(O)cccc3CC21 | 10.1038/s41467-023-40064-9 | |||
| 11658860 | 2344 | 51 | None | - | 3 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 195 | 0 | 1 | 1 | 2.6 | Clc1ccc2c(c1)[C@@H](C)CNCC2 | 10.1038/s41467-023-40064-9 | |||
| 2941 | 2344 | 51 | None | - | 3 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 195 | 0 | 1 | 1 | 2.6 | Clc1ccc2c(c1)[C@@H](C)CNCC2 | 10.1038/s41467-023-40064-9 | |||
| 4374 | 2344 | 51 | None | - | 3 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 195 | 0 | 1 | 1 | 2.6 | Clc1ccc2c(c1)[C@@H](C)CNCC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL360328 | 2344 | 51 | None | - | 3 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 195 | 0 | 1 | 1 | 2.6 | Clc1ccc2c(c1)[C@@H](C)CNCC2 | 10.1038/s41467-023-40064-9 | |||
| DB04871 | 2344 | 51 | None | - | 3 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 195 | 0 | 1 | 1 | 2.6 | Clc1ccc2c(c1)[C@@H](C)CNCC2 | 10.1038/s41467-023-40064-9 | |||
| 4046 | 2483 | 33 | None | - | 2 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| 4252 | 2483 | 33 | None | - | 2 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL416956 | 2483 | 33 | None | - | 2 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| DB00358 | 2483 | 33 | None | - | 2 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| 104870 | 98880 | 47 | None | - | 21 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 209 | 2 | 1 | 4 | 1.3 | C=CCN1CCc2nc(N)sc2CC1 | 10.1038/s41467-023-40064-9 | |||
| 5374 | 98880 | 47 | None | - | 21 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 209 | 2 | 1 | 4 | 1.3 | C=CCN1CCc2nc(N)sc2CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL279085 | 98880 | 47 | None | - | 21 | Human | 4.6 | pAC50 | = | 4.6 | Binding | ChEMBL | 209 | 2 | 1 | 4 | 1.3 | C=CCN1CCc2nc(N)sc2CC1 | 10.1038/s41467-023-40064-9 | |||
| 3081361 | 93934 | 123 | None | - | 0 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 474 | 5 | 1 | 5 | 4.4 | COc1cc2/c(=N/c3ccc(Br)cc3F)nc[nH]c2cc1OCC1CCN(C)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL24828 | 93934 | 123 | None | - | 0 | Human | 6.6 | pAC50 | = | 6.6 | Binding | ChEMBL | 474 | 5 | 1 | 5 | 4.4 | COc1cc2/c(=N/c3ccc(Br)cc3F)nc[nH]c2cc1OCC1CCN(C)CC1 | 10.1038/s41467-023-40064-9 | |||
| 2540 | 4401 | 111 | None | - | 4 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 610 | 10 | 1 | 11 | 6.3 | CCOc1nc2cccc(C(=O)OC(C)OC(=O)OC3CCCCC3)c2n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1014 | 4401 | 111 | None | - | 4 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 610 | 10 | 1 | 11 | 6.3 | CCOc1nc2cccc(C(=O)OC(C)OC(=O)OC3CCCCC3)c2n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 6127 | 14499 | 8 | None | - | 0 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 278 | 2 | 0 | 0 | 4.4 | C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201340 | 14499 | 8 | None | - | 0 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 278 | 2 | 0 | 0 | 4.4 | C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 179 | 400 | 115 | None | -4365 | 49 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | 10.1038/s41467-023-40064-9 | |||
| 2159 | 400 | 115 | None | -4365 | 49 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | 10.1038/s41467-023-40064-9 | |||
| 963 | 400 | 115 | None | -4365 | 49 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | 10.1038/s41467-023-40064-9 | |||
| CHEMBL243712 | 400 | 115 | None | -4365 | 49 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | 10.1038/s41467-023-40064-9 | |||
| DB06288 | 400 | 115 | None | -4365 | 49 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | 10.1038/s41467-023-40064-9 | |||
| 131411 | 15392 | 70 | None | - | 0 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 476 | 7 | 1 | 6 | 5.2 | CCOC(=O)c1c(CSc2ccccc2)n(C)c2cc(Br)c(O)c(CN(C)C)c12 | 10.1038/s41467-023-40064-9 | |||
| 28446253 | 15392 | 70 | None | - | 0 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 476 | 7 | 1 | 6 | 5.2 | CCOC(=O)c1c(CSc2ccccc2)n(C)c2cc(Br)c(O)c(CN(C)C)c12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1214598 | 15392 | 70 | None | - | 0 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 476 | 7 | 1 | 6 | 5.2 | CCOC(=O)c1c(CSc2ccccc2)n(C)c2cc(Br)c(O)c(CN(C)C)c12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2103737 | 78140 | 0 | None | - | 0 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 4528 | 98126 | 80 | None | -1 | 10 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL273575 | 98126 | 80 | None | -1 | 10 | Human | 4.5 | pAC50 | = | 4.5 | Binding | ChEMBL | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | 10.1038/s41467-023-40064-9 | |||
| 2284 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 4926 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 7281 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL564 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00420 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 26987 | 949 | 33 | None | 16 | 21 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| 6063 | 949 | 33 | None | 16 | 21 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| 671 | 949 | 33 | None | 16 | 21 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1626 | 949 | 33 | None | 16 | 21 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| DB00283 | 949 | 33 | None | 16 | 21 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| 2782 | 32000 | 67 | None | - | 1 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 325 | 4 | 0 | 3 | 4.3 | Clc1ccc(Cn2c(CN3CCCC3)nc3ccccc32)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1407943 | 32000 | 67 | None | - | 1 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 325 | 4 | 0 | 3 | 4.3 | Clc1ccc(Cn2c(CN3CCCC3)nc3ccccc32)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3216363 | 32000 | 67 | None | - | 1 | Human | 8.5 | pAC50 | = | 8.5 | Binding | ChEMBL | 325 | 4 | 0 | 3 | 4.3 | Clc1ccc(Cn2c(CN3CCCC3)nc3ccccc32)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2136 | 3095 | 30 | None | - | 6 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 4768 | 3095 | 30 | None | - | 6 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 7268 | 3095 | 30 | None | - | 6 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL753 | 3095 | 30 | None | - | 6 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00925 | 3095 | 30 | None | - | 6 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 4614 | 5391 | 103 | None | - | 0 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 293 | 5 | 1 | 3 | 4.0 | O=C(O)CCc1nc(-c2ccccc2)c(-c2ccccc2)o1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1071 | 5391 | 103 | None | - | 0 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 293 | 5 | 1 | 3 | 4.0 | O=C(O)CCc1nc(-c2ccccc2)c(-c2ccccc2)o1 | 10.1038/s41467-023-40064-9 | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 1547484 | 940 | 74 | None | -1 | 20 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 654 | 940 | 74 | None | -1 | 20 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 9072 | 940 | 74 | None | -1 | 20 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL43064 | 940 | 74 | None | -1 | 20 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00568 | 940 | 74 | None | -1 | 20 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 9429 | 202133 | 58 | None | - | 5 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 446 | 6 | 0 | 6 | 3.2 | CN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL609109 | 202133 | 58 | None | - | 5 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 446 | 6 | 0 | 6 | 3.2 | CN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 5329102 | 194726 | 86 | None | - | 0 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 398 | 7 | 3 | 3 | 3.3 | CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL535 | 194726 | 86 | None | - | 0 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 398 | 7 | 3 | 3 | 3.3 | CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C | 10.1038/s41467-023-40064-9 | |||
| 154417 | 23181 | 60 | None | - | 5 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 289 | 4 | 1 | 4 | 1.9 | CN1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@H](CO)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1331216 | 23181 | 60 | None | - | 5 | Human | 5.5 | pAC50 | = | 5.5 | Binding | ChEMBL | 289 | 4 | 1 | 4 | 1.9 | CN1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@H](CO)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| 4940 | 14470 | 35 | None | - | 0 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 340 | 5 | 0 | 4 | 4.8 | CCC(=O)c1ccc2c(c1)N(CC(C)N(C)C)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201210 | 14470 | 35 | None | - | 0 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 340 | 5 | 0 | 4 | 4.8 | CCC(=O)c1ccc2c(c1)N(CC(C)N(C)C)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| 1385580 | 29276 | 76 | None | -1 | 5 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 4615 | 29276 | 76 | None | -1 | 5 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL13828 | 29276 | 76 | None | -1 | 5 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 19675 | 51670 | 43 | None | - | 0 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.0 | CC(=O)c1ccc2c(c1)N(CCCN1CCC(CCO)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1584 | 51670 | 43 | None | - | 0 | Human | 7.5 | pAC50 | = | 7.5 | Binding | ChEMBL | 410 | 7 | 1 | 5 | 5.0 | CC(=O)c1ccc2c(c1)N(CCCN1CCC(CCO)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| 65700 | 78260 | 28 | None | - | 0 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 238 | 1 | 1 | 2 | 3.3 | CNC1Cc2ccccc2N(C)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2106919 | 78260 | 28 | None | - | 0 | Human | 6.5 | pAC50 | = | 6.5 | Binding | ChEMBL | 238 | 1 | 1 | 2 | 3.3 | CNC1Cc2ccccc2N(C)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 212 | 3806 | 47 | None | -5 | 25 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| 2639 | 3806 | 47 | None | -5 | 25 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| 941651 | 3806 | 47 | None | -5 | 25 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201 | 3806 | 47 | None | -5 | 25 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| DB01623 | 3806 | 47 | None | -5 | 25 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| 25382 | 9157 | 37 | None | - | 0 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 291 | 3 | 0 | 1 | 4.7 | CN(C)CCC=C1c2ccccc2C(C)(C)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL110094 | 9157 | 37 | None | - | 0 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 291 | 3 | 0 | 1 | 4.7 | CN(C)CCC=C1c2ccccc2C(C)(C)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 4008 | 7226 | 92 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 610 | 10 | 1 | 9 | 5.0 | COC(=O)C1=C(C)NC(C)=C(C(=O)OCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)C1c1cccc([N+](=O)[O-])c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1085699 | 7226 | 92 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 610 | 10 | 1 | 9 | 5.0 | COC(=O)C1=C(C)NC(C)=C(C(=O)OCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)C1c1cccc([N+](=O)[O-])c1 | 10.1038/s41467-023-40064-9 | |||
| 1400 | 1957 | 70 | None | 2 | 3 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3658 | 1957 | 70 | None | 2 | 3 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 7199 | 1957 | 70 | None | 2 | 3 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 91513 | 1957 | 70 | None | 2 | 3 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL896 | 1957 | 70 | None | 2 | 3 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00557 | 1957 | 70 | None | 2 | 3 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3151 | 1462 | 97 | None | -41 | 27 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 945 | 1462 | 97 | None | -41 | 27 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 965 | 1462 | 97 | None | -41 | 27 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL219916 | 1462 | 97 | None | -41 | 27 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB01184 | 1462 | 97 | None | -41 | 27 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL4743867 | 214033 | 14 | None | - | 0 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | None | None | None | OCCN1CCN(CCC=C2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2220 | 3134 | 82 | None | - | 14 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | |||
| 27400 | 3134 | 82 | None | - | 14 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | |||
| 93 | 3134 | 82 | None | - | 14 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL294951 | 3134 | 82 | None | - | 14 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB06153 | 3134 | 82 | None | - | 14 | Human | 8.3 | pAC50 | = | 8.3 | Binding | ChEMBL | 295 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1 | 10.1038/s41467-023-40064-9 | |||
| 2705 | 3842 | 64 | None | - | 10 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.1038/s41467-023-40064-9 | |||
| 360 | 3842 | 64 | None | - | 10 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.1038/s41467-023-40064-9 | |||
| 443879 | 3842 | 64 | None | - | 10 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1382 | 3842 | 64 | None | - | 10 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.1038/s41467-023-40064-9 | |||
| DB01036 | 3842 | 64 | None | - | 10 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.1038/s41467-023-40064-9 | |||
| 1890 | 2759 | 49 | None | -44 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
| 4449 | 2759 | 49 | None | -44 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
| 7247 | 2759 | 49 | None | -44 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL623 | 2759 | 49 | None | -44 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
| DB01149 | 2759 | 49 | None | -44 | 16 | Human | 6.4 | pAC50 | = | 6.4 | Binding | ChEMBL | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | 10.1038/s41467-023-40064-9 | |||
| 209 | 3057 | 97 | None | -11 | 23 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 2113 | 3057 | 97 | None | -11 | 23 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 4748 | 3057 | 97 | None | -11 | 23 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL567 | 3057 | 97 | None | -11 | 23 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| DB00850 | 3057 | 97 | None | -11 | 23 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 1209 | 1658 | 75 | None | -144 | 32 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 203 | 1658 | 75 | None | -144 | 32 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3386 | 1658 | 75 | None | -144 | 32 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL41 | 1658 | 75 | None | -144 | 32 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB00472 | 1658 | 75 | None | -144 | 32 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1038/s41467-023-40064-9 | |||
| 4452 | 2762 | 19 | None | - | 19 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 983 | 2762 | 19 | None | - | 19 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL20734 | 2762 | 19 | None | - | 19 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 2407 | 3372 | 76 | None | - | 7 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 315 | 6 | 1 | 3 | 4.3 | CCCN([C@H]1CCc2c(C1)cccc2O)CCc1cccs1 | 10.1038/s41467-023-40064-9 | |||
| 59227 | 3372 | 76 | None | - | 7 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 315 | 6 | 1 | 3 | 4.3 | CCCN([C@H]1CCc2c(C1)cccc2O)CCc1cccs1 | 10.1038/s41467-023-40064-9 | |||
| 941 | 3372 | 76 | None | - | 7 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 315 | 6 | 1 | 3 | 4.3 | CCCN([C@H]1CCc2c(C1)cccc2O)CCc1cccs1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1303 | 3372 | 76 | None | - | 7 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 315 | 6 | 1 | 3 | 4.3 | CCCN([C@H]1CCc2c(C1)cccc2O)CCc1cccs1 | 10.1038/s41467-023-40064-9 | |||
| DB05271 | 3372 | 76 | None | - | 7 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 315 | 6 | 1 | 3 | 4.3 | CCCN([C@H]1CCc2c(C1)cccc2O)CCc1cccs1 | 10.1038/s41467-023-40064-9 | |||
| 5639 | 98895 | 75 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 387 | 7 | 1 | 8 | 0.7 | COc1ccccc1N1CCN(CCCNc2cc(=O)n(C)c(=O)n2C)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL279229 | 98895 | 75 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 387 | 7 | 1 | 8 | 0.7 | COc1ccccc1N1CCN(CCCNc2cc(=O)n(C)c(=O)n2C)CC1 | 10.1038/s41467-023-40064-9 | |||
| 3294 | 2006 | 111 | None | -14 | 45 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | 10.1038/s41467-023-40064-9 | |||
| 71360 | 2006 | 111 | None | -14 | 45 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | 10.1038/s41467-023-40064-9 | |||
| 87 | 2006 | 111 | None | -14 | 45 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL14376 | 2006 | 111 | None | -14 | 45 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | 10.1038/s41467-023-40064-9 | |||
| DB04946 | 2006 | 111 | None | -14 | 45 | Human | 7.4 | pAC50 | = | 7.4 | Binding | ChEMBL | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | 10.1038/s41467-023-40064-9 | |||
| 134 | 2514 | 24 | None | -933 | 67 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 10.1038/s41467-023-40064-9 | |||
| 1775 | 2514 | 24 | None | -933 | 67 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 10.1038/s41467-023-40064-9 | |||
| 9681 | 2514 | 24 | None | -933 | 67 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1065 | 2514 | 24 | None | -933 | 67 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 10.1038/s41467-023-40064-9 | |||
| DB00247 | 2514 | 24 | None | -933 | 67 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | 10.1038/s41467-023-40064-9 | |||
| 11434515 | 261 | 6 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 11519741 | 261 | 6 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 4484 | 261 | 6 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 7449 | 261 | 6 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1194325 | 261 | 6 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| DB08897 | 261 | 6 | None | - | 5 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 4756 | 16649 | 50 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 213 | 2 | 2 | 5 | 2.7 | Nc1ccc(/N=N/c2ccccc2)c(N)n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201022 | 16649 | 50 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 213 | 2 | 2 | 5 | 2.7 | Nc1ccc(/N=N/c2ccccc2)c(N)n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1242 | 16649 | 50 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 213 | 2 | 2 | 5 | 2.7 | Nc1ccc(/N=N/c2ccccc2)c(N)n1 | 10.1038/s41467-023-40064-9 | |||
| 3949 | 100614 | 50 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 468 | 8 | 0 | 5 | 4.9 | COc1ccc(CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c(OC)c1OC | 10.1038/s41467-023-40064-9 | |||
| CHEMBL29188 | 100614 | 50 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 468 | 8 | 0 | 5 | 4.9 | COc1ccc(CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c(OC)c1OC | 10.1038/s41467-023-40064-9 | |||
| 29566 | 78204 | 82 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 284 | 2 | 2 | 6 | -2.7 | O=S1(=O)CCN(CN2CCS(=O)(=O)NC2)CN1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2105420 | 78204 | 82 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 284 | 2 | 2 | 6 | -2.7 | O=S1(=O)CCN(CN2CCS(=O)(=O)NC2)CN1 | 10.1038/s41467-023-40064-9 | |||
| 17676 | 7072 | 29 | None | - | 3 | Human | 7.3 | pAC50 | = | 7.3 | Binding | ChEMBL | 411 | 7 | 1 | 6 | 3.5 | CC(=O)c1ccc2c(c1)N(CCCN1CCN(CCO)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| 5281082 | 7072 | 29 | None | - | 3 | Human | 7.3 | pAC50 | = | 7.3 | Binding | ChEMBL | 411 | 7 | 1 | 6 | 3.5 | CC(=O)c1ccc2c(c1)N(CCCN1CCN(CCO)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1085 | 7072 | 29 | None | - | 3 | Human | 7.3 | pAC50 | = | 7.3 | Binding | ChEMBL | 411 | 7 | 1 | 6 | 3.5 | CC(=O)c1ccc2c(c1)N(CCCN1CCN(CCO)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| 19910 | 37408 | 106 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 190 | 1 | 1 | 4 | 1.8 | O=[N+]([O-])c1ccc(O)c2ncccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1454910 | 37408 | 106 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 190 | 1 | 1 | 4 | 1.8 | O=[N+]([O-])c1ccc(O)c2ncccc12 | 10.1038/s41467-023-40064-9 | |||
| 4976 | 203579 | 29 | None | -1 | 12 | Human | 7.3 | pAC50 | = | 7.3 | Binding | ChEMBL | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL668 | 203579 | 29 | None | -1 | 12 | Human | 7.3 | pAC50 | = | 7.3 | Binding | ChEMBL | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 2105 | 3054 | 37 | None | - | 33 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | 10.1038/s41467-023-40064-9 | |||
| 47811 | 3054 | 37 | None | - | 33 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | 10.1038/s41467-023-40064-9 | |||
| 48 | 3054 | 37 | None | - | 33 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL531 | 3054 | 37 | None | - | 33 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | 10.1038/s41467-023-40064-9 | |||
| DB01186 | 3054 | 37 | None | - | 33 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | 10.1038/s41467-023-40064-9 | |||
| 6834 | 205552 | 45 | None | -1 | 2 | Human | 7.3 | pAC50 | = | 7.3 | Binding | ChEMBL | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL811 | 205552 | 45 | None | -1 | 2 | Human | 7.3 | pAC50 | = | 7.3 | Binding | ChEMBL | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| 7045767 | 59108 | 27 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 203 | 5 | 0 | 4 | -1.2 | CC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1697733 | 59108 | 27 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 203 | 5 | 0 | 4 | -1.2 | CC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C | 10.1038/s41467-023-40064-9 | |||
| 11949652 | 80512 | 60 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 426 | 4 | 1 | 7 | 1.6 | Cc1cc(N2CCN([C@@H]3CN[C@H](C(=O)N4CCSC4)C3)CC2)n(-c2ccccc2)n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2147777 | 80512 | 60 | None | - | 0 | Human | 5.3 | pAC50 | = | 5.3 | Binding | ChEMBL | 426 | 4 | 1 | 7 | 1.6 | Cc1cc(N2CCN([C@@H]3CN[C@H](C(=O)N4CCSC4)C3)CC2)n(-c2ccccc2)n1 | 10.1038/s41467-023-40064-9 | |||
| 44093 | 48931 | 94 | None | - | 0 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 217 | 3 | 2 | 3 | 0.6 | C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1560 | 48931 | 94 | None | - | 0 | Human | 6.3 | pAC50 | = | 6.3 | Binding | ChEMBL | 217 | 3 | 2 | 3 | 0.6 | C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 2393 | 3334 | 82 | None | - | 5 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | |||
| 5078 | 3334 | 82 | None | - | 5 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | |||
| 51 | 3334 | 82 | None | - | 5 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL905 | 3334 | 82 | None | - | 5 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | |||
| DB00953 | 3334 | 82 | None | - | 5 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 269 | 5 | 1 | 4 | 1.9 | CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C | 10.1038/s41467-023-40064-9 | |||
| 16960 | 14487 | 23 | None | - | 0 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 318 | 5 | 0 | 2 | 3.9 | CN(C)CC[C@@H](c1ccc(Br)cc1)c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201287 | 14487 | 23 | None | - | 0 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 318 | 5 | 0 | 2 | 3.9 | CN(C)CC[C@@H](c1ccc(Br)cc1)c1ccccn1 | 10.1038/s41467-023-40064-9 | |||
| 1816 | 2540 | 102 | None | -3 | 18 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1038/s41467-023-40064-9 | |||
| 4205 | 2540 | 102 | None | -3 | 18 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1038/s41467-023-40064-9 | |||
| 7241 | 2540 | 102 | None | -3 | 18 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL654 | 2540 | 102 | None | -3 | 18 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00370 | 2540 | 102 | None | -3 | 18 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1038/s41467-023-40064-9 | |||
| 19861 | 207523 | 50 | None | - | 1 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL946 | 207523 | 50 | None | - | 1 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 3926 | 207241 | 40 | None | - | 0 | Human | 6.2 | pAC50 | = | 6.2 | Binding | ChEMBL | 491 | 9 | 1 | 3 | 5.8 | Cc1cccc(C)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL92870 | 207241 | 40 | None | - | 0 | Human | 6.2 | pAC50 | = | 6.2 | Binding | ChEMBL | 491 | 9 | 1 | 3 | 5.8 | Cc1cccc(C)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 146015336 | 53348 | 111 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 252 | 2 | 2 | 2 | 2.0 | O=C1N=C(O)NC1(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 1775 | 53348 | 111 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 252 | 2 | 2 | 2 | 2.0 | O=C1N=C(O)NC1(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL16 | 53348 | 111 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 252 | 2 | 2 | 2 | 2.0 | O=C1N=C(O)NC1(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1611 | 53348 | 111 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 252 | 2 | 2 | 2 | 2.0 | O=C1N=C(O)NC1(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 5453 | 203619 | 102 | None | - | 0 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 189 | 3 | 0 | 1 | 0.2 | S=P(N1CC1)(N1CC1)N1CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL671 | 203619 | 102 | None | - | 0 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 189 | 3 | 0 | 1 | 0.2 | S=P(N1CC1)(N1CC1)N1CC1 | 10.1038/s41467-023-40064-9 | |||
| 2435 | 3590 | 83 | None | -95 | 48 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1038/s41467-023-40064-9 | |||
| 60149 | 3590 | 83 | None | -95 | 48 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1038/s41467-023-40064-9 | |||
| 98 | 3590 | 83 | None | -95 | 48 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL12713 | 3590 | 83 | None | -95 | 48 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1038/s41467-023-40064-9 | |||
| DB06144 | 3590 | 83 | None | -95 | 48 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1038/s41467-023-40064-9 | |||
| 65866 | 94264 | 73 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 611 | 12 | 1 | 8 | 6.5 | COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)(C)CN(C)CCC(c2ccccc2)c2ccccc2)C1c1cccc([N+](=O)[O-])c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL250270 | 94264 | 73 | None | - | 0 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 611 | 12 | 1 | 8 | 6.5 | COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)(C)CN(C)CCC(c2ccccc2)c2ccccc2)C1c1cccc([N+](=O)[O-])c1 | 10.1038/s41467-023-40064-9 | |||
| 4450 | 178228 | 69 | None | - | 3 | Human | 6.2 | pAC50 | = | 6.2 | Binding | ChEMBL | 253 | 1 | 0 | 2 | 3.2 | CN1CCOC(c2ccccc2)c2ccccc2C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL465026 | 178228 | 69 | None | - | 3 | Human | 6.2 | pAC50 | = | 6.2 | Binding | ChEMBL | 253 | 1 | 0 | 2 | 3.2 | CN1CCOC(c2ccccc2)c2ccccc2C1 | 10.1038/s41467-023-40064-9 | |||
| 3947 | 206395 | 53 | None | -7 | 16 | Human | 6.2 | pAC50 | = | 6.2 | Binding | ChEMBL | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL87708 | 206395 | 53 | None | -7 | 16 | Human | 6.2 | pAC50 | = | 6.2 | Binding | ChEMBL | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2398 | 954 | 62 | None | -1 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 2801 | 954 | 62 | None | -1 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 701 | 954 | 62 | None | -1 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL415 | 954 | 62 | None | -1 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| DB01242 | 954 | 62 | None | -1 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 191 | 403 | 98 | None | -56 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 201 | 403 | 98 | None | -56 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 2170 | 403 | 98 | None | -56 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1113 | 403 | 98 | None | -56 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| DB00543 | 403 | 98 | None | -56 | 29 | Human | 7.2 | pAC50 | = | 7.2 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 37 | 778 | 60 | None | - | 17 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 451 | 8 | 2 | 4 | 3.2 | C=CCN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N(C(=O)NCC)CCCN(C)C | 10.1038/s41467-023-40064-9 | |||
| 460 | 778 | 60 | None | - | 17 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 451 | 8 | 2 | 4 | 3.2 | C=CCN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N(C(=O)NCC)CCCN(C)C | 10.1038/s41467-023-40064-9 | |||
| 54746 | 778 | 60 | None | - | 17 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 451 | 8 | 2 | 4 | 3.2 | C=CCN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N(C(=O)NCC)CCCN(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201087 | 778 | 60 | None | - | 17 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 451 | 8 | 2 | 4 | 3.2 | C=CCN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N(C(=O)NCC)CCCN(C)C | 10.1038/s41467-023-40064-9 | |||
| DB00248 | 778 | 60 | None | - | 17 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 451 | 8 | 2 | 4 | 3.2 | C=CCN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3)C(=O)N(C(=O)NCC)CCCN(C)C | 10.1038/s41467-023-40064-9 | |||
| 5904 | 100392 | 40 | None | - | 1 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 334 | 4 | 2 | 4 | 0.9 | CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1223 | 100392 | 40 | None | - | 1 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 334 | 4 | 2 | 4 | 0.9 | CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL29 | 100392 | 40 | None | - | 1 | Human | 5.2 | pAC50 | = | 5.2 | Binding | ChEMBL | 334 | 4 | 2 | 4 | 0.9 | CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 2286 | 3183 | 51 | None | -2 | 30 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| 4927 | 3183 | 51 | None | -2 | 30 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| 7282 | 3183 | 51 | None | -2 | 30 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL643 | 3183 | 51 | None | -2 | 30 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| DB01069 | 3183 | 51 | None | -2 | 30 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| 103 | 4153 | 61 | None | -1 | 53 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 2875 | 4153 | 61 | None | -1 | 53 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 5736 | 4153 | 61 | None | -1 | 53 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL285802 | 4153 | 61 | None | -1 | 53 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| DB09225 | 4153 | 61 | None | -1 | 53 | Human | 8.2 | pAC50 | = | 8.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 4011 | 82408 | 49 | None | 6 | 24 | Human | 8.1 | pAC50 | = | 8.1 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL21731 | 82408 | 49 | None | 6 | 24 | Human | 8.1 | pAC50 | = | 8.1 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | 10.1038/s41467-023-40064-9 | |||
| 16363 | 596 | 53 | None | - | 7 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 381 | 6 | 1 | 4 | 3.8 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 312 | 596 | 53 | None | - | 7 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 381 | 6 | 1 | 4 | 3.8 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 9215 | 596 | 53 | None | - | 7 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 381 | 6 | 1 | 4 | 3.8 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL297302 | 596 | 53 | None | - | 7 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 381 | 6 | 1 | 4 | 3.8 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB12867 | 596 | 53 | None | - | 7 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 381 | 6 | 1 | 4 | 3.8 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 4418 | 34222 | 85 | None | - | 6 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 392 | 7 | 1 | 5 | 3.4 | COc1ccccc1N1CCN(CC(O)COc2cccc3ccccc23)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL142635 | 34222 | 85 | None | - | 6 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 392 | 7 | 1 | 5 | 3.4 | COc1ccccc1N1CCN(CC(O)COc2cccc3ccccc23)CC1 | 10.1038/s41467-023-40064-9 | |||
| 4020 | 205150 | 39 | None | - | 1 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 284 | 1 | 1 | 3 | 2.6 | OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCN21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL781 | 205150 | 39 | None | - | 1 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 284 | 1 | 1 | 3 | 2.6 | OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCN21 | 10.1038/s41467-023-40064-9 | |||
| 23480 | 124090 | 23 | None | - | 0 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 281 | 5 | 1 | 1 | 5.0 | CC(CC(c1ccccc1)c1ccccc1)NC(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL363295 | 124090 | 23 | None | - | 0 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 281 | 5 | 1 | 1 | 5.0 | CC(CC(c1ccccc1)c1ccccc1)NC(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 9801 | 91585 | 35 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 329 | 8 | 1 | 1 | 5.4 | CC(Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL24072 | 91585 | 35 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 329 | 8 | 1 | 1 | 5.4 | CC(Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 5411 | 204033 | 89 | None | - | 2 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 264 | 8 | 1 | 4 | 2.6 | CCCCNc1ccc(C(=O)OCCN(C)C)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL698 | 204033 | 89 | None | - | 2 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 264 | 8 | 1 | 4 | 2.6 | CCCCNc1ccc(C(=O)OCCN(C)C)cc1 | 10.1038/s41467-023-40064-9 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pAC50 | = | 8.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pAC50 | = | 8.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pAC50 | = | 8.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pAC50 | = | 8.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 2762 | 3863 | 31 | None | -9 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 5587 | 3863 | 31 | None | -9 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 7318 | 3863 | 31 | None | -9 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1241 | 3863 | 31 | None | -9 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| DB00792 | 3863 | 31 | None | -9 | 2 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 249 | 505 | 81 | None | -4 | 42 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 9417 | 133512 | 54 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 363 | 6 | 1 | 4 | 3.3 | OCCN1CCN(CCCN2c3ccccc3C=Cc3ccccc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1524185 | 133512 | 54 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 363 | 6 | 1 | 4 | 3.3 | OCCN1CCN(CCCN2c3ccccc3C=Cc3ccccc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL370753 | 133512 | 54 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 363 | 6 | 1 | 4 | 3.3 | OCCN1CCN(CCCN2c3ccccc3C=Cc3ccccc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 11291 | 98796 | 25 | None | - | 2 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL278398 | 98796 | 25 | None | - | 2 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1038/s41467-023-40064-9 | |||
| 2712 | 916 | 34 | None | -5 | 4 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 3370 | 916 | 34 | None | -5 | 4 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 594 | 916 | 34 | None | -5 | 4 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL451 | 916 | 34 | None | -5 | 4 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| DB00475 | 916 | 34 | None | -5 | 4 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 1193 | 1656 | 108 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 2447 | 1656 | 108 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3371 | 1656 | 108 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL23588 | 1656 | 108 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB02266 | 1656 | 108 | None | - | 0 | Human | 7.1 | pAC50 | = | 7.1 | Binding | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 135564886 | 14493 | 5 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 752 | 14 | 1 | 6 | 8.7 | CC1(C)C(/C=C/C=C/C=C/C=C2\N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21 | 10.1038/s41467-023-40064-9 | |||
| 135673376 | 14493 | 5 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 752 | 14 | 1 | 6 | 8.7 | CC1(C)C(/C=C/C=C/C=C/C=C2\N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21 | 10.1038/s41467-023-40064-9 | |||
| 137157436 | 14493 | 5 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 752 | 14 | 1 | 6 | 8.7 | CC1(C)C(/C=C/C=C/C=C/C=C2\N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21 | 10.1038/s41467-023-40064-9 | |||
| 145948239 | 14493 | 5 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 752 | 14 | 1 | 6 | 8.7 | CC1(C)C(/C=C/C=C/C=C/C=C2\N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21 | 10.1038/s41467-023-40064-9 | |||
| 71587099 | 14493 | 5 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 752 | 14 | 1 | 6 | 8.7 | CC1(C)C(/C=C/C=C/C=C/C=C2\N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201304 | 14493 | 5 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 752 | 14 | 1 | 6 | 8.7 | CC1(C)C(/C=C/C=C/C=C/C=C2\N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21 | 10.1038/s41467-023-40064-9 | |||
| 1222 | 1664 | 49 | None | -17 | 33 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3396 | 1664 | 49 | None | -17 | 33 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 85 | 1664 | 49 | None | -17 | 33 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL46516 | 1664 | 49 | None | -17 | 33 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB04842 | 1664 | 49 | None | -17 | 33 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3180 | 14473 | 41 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 289 | 8 | 0 | 3 | 3.9 | CCCCOc1ccc(C(=O)CCN2CCCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201217 | 14473 | 41 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 289 | 8 | 0 | 3 | 3.9 | CCCCOc1ccc(C(=O)CCN2CCCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2794 | 19380 | 85 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 472 | 4 | 1 | 4 | 7.5 | CC(C)/N=c1\cc2n(-c3ccc(Cl)cc3)c3ccccc3nc-2cc1Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1292 | 19380 | 85 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 472 | 4 | 1 | 4 | 7.5 | CC(C)/N=c1\cc2n(-c3ccc(Cl)cc3)c3ccccc3nc-2cc1Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 5284616 | 161627 | 55 | None | - | 0 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 914 | 6 | 3 | 13 | 6.2 | CO[C@H]1C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H]([C@H](C)C[C@@H]2CC[C@@H](O)[C@H](OC)C2)CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)/C=C/C=C/C=C/1C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL413 | 161627 | 55 | None | - | 0 | Human | 6.1 | pAC50 | = | 6.1 | Binding | ChEMBL | 914 | 6 | 3 | 13 | 6.2 | CO[C@H]1C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H]([C@H](C)C[C@@H]2CC[C@@H](O)[C@H](OC)C2)CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)/C=C/C=C/C=C/1C | 10.1038/s41467-023-40064-9 | |||
| 2351 | 4300 | 49 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 366 | 10 | 0 | 3 | 4.8 | CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1008 | 4300 | 49 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 366 | 10 | 0 | 3 | 4.8 | CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1257078 | 4300 | 49 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 366 | 10 | 0 | 3 | 4.8 | CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1 | 10.1038/s41467-023-40064-9 | |||
| 213046 | 2385 | 59 | None | - | 9 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 492 | 5 | 0 | 6 | 4.3 | O=C1N(C[C@@H]2CCCC[C@H]2CN2CCN(CC2)c2nsc3c2cccc3)C(=O)[C@@H]2[C@H]1[C@H]1CC[C@@H]2C1 | 10.1038/s41467-023-40064-9 | |||
| 4168 | 2385 | 59 | None | - | 9 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 492 | 5 | 0 | 6 | 4.3 | O=C1N(C[C@@H]2CCCC[C@H]2CN2CCN(CC2)c2nsc3c2cccc3)C(=O)[C@@H]2[C@H]1[C@H]1CC[C@@H]2C1 | 10.1038/s41467-023-40064-9 | |||
| 7461 | 2385 | 59 | None | - | 9 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 492 | 5 | 0 | 6 | 4.3 | O=C1N(C[C@@H]2CCCC[C@H]2CN2CCN(CC2)c2nsc3c2cccc3)C(=O)[C@@H]2[C@H]1[C@H]1CC[C@@H]2C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1237021 | 2385 | 59 | None | - | 9 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 492 | 5 | 0 | 6 | 4.3 | O=C1N(C[C@@H]2CCCC[C@H]2CN2CCN(CC2)c2nsc3c2cccc3)C(=O)[C@@H]2[C@H]1[C@H]1CC[C@@H]2C1 | 10.1038/s41467-023-40064-9 | |||
| DB08815 | 2385 | 59 | None | - | 9 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 492 | 5 | 0 | 6 | 4.3 | O=C1N(C[C@@H]2CCCC[C@H]2CN2CCN(CC2)c2nsc3c2cccc3)C(=O)[C@@H]2[C@H]1[C@H]1CC[C@@H]2C1 | 10.1038/s41467-023-40064-9 | |||
| 135398735 | 136968 | 32 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 822 | 4 | 6 | 15 | 4.3 | CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c(/C=N/N5CCN(C)CC5)c(O)c4c3C2=O)NC(=O)/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C | 10.1038/s41467-023-40064-9 | |||
| 136262914 | 136968 | 32 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 822 | 4 | 6 | 15 | 4.3 | CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c(/C=N/N5CCN(C)CC5)c(O)c4c3C2=O)NC(=O)/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL374478 | 136968 | 32 | None | - | 0 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 822 | 4 | 6 | 15 | 4.3 | CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c(/C=N/N5CCN(C)CC5)c(O)c4c3C2=O)NC(=O)/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C | 10.1038/s41467-023-40064-9 | |||
| 202 | 1508 | 77 | None | -1 | 30 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 60835 | 1508 | 77 | None | -1 | 30 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 972 | 1508 | 77 | None | -1 | 30 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1175 | 1508 | 77 | None | -1 | 30 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00476 | 1508 | 77 | None | -1 | 30 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2335 | 11848 | 22 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 412 | 11 | 0 | 2 | 6.1 | CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 8478 | 11848 | 22 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 412 | 11 | 0 | 2 | 6.1 | CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1182210 | 11848 | 22 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 412 | 11 | 0 | 2 | 6.1 | CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL221753 | 11848 | 22 | None | - | 12 | Human | 5.1 | pAC50 | = | 5.1 | Binding | ChEMBL | 412 | 11 | 0 | 2 | 6.1 | CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 3547 | 141373 | 71 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 291 | 2 | 1 | 4 | 1.2 | O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL38380 | 141373 | 71 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 291 | 2 | 1 | 4 | 1.2 | O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL541388 | 141373 | 71 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 291 | 2 | 1 | 4 | 1.2 | O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 2179 | 167518 | 76 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 393 | 5 | 2 | 5 | 4.5 | COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1256655 | 167518 | 76 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 393 | 5 | 2 | 5 | 4.5 | COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL43 | 167518 | 76 | None | - | 0 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 393 | 5 | 2 | 5 | 4.5 | COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12 | 10.1038/s41467-023-40064-9 | |||
| 100 | 3805 | 58 | None | -7 | 55 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| 2637 | 3805 | 58 | None | -7 | 55 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| 5452 | 3805 | 58 | None | -7 | 55 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL479 | 3805 | 58 | None | -7 | 55 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00679 | 3805 | 58 | None | -7 | 55 | Human | 7.0 | pAC50 | = | 7.0 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| 2448 | 99323 | 70 | None | -4 | 18 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 419 | 6 | 1 | 3 | 4.5 | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL28218 | 99323 | 70 | None | -4 | 18 | Human | 5.0 | pAC50 | = | 5.0 | Binding | ChEMBL | 419 | 6 | 1 | 3 | 4.5 | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 | 10.1038/s41467-023-40064-9 | |||
| 4642 | 41986 | 28 | None | - | 0 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 344 | 5 | 1 | 5 | 2.7 | CN1CCCN=C1COC(=O)C(O)(c1ccccc1)C1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1495 | 41986 | 28 | None | - | 0 | Human | 6.0 | pAC50 | = | 6 | Binding | ChEMBL | 344 | 5 | 1 | 5 | 2.7 | CN1CCCN=C1COC(=O)C(O)(c1ccccc1)C1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.4 | pEC50 | = | 9.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.4 | pEC50 | = | 9.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.4 | pEC50 | = | 9.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.4 | pEC50 | = | 9.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.4 | pEC50 | = | 9.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 11327353 | 165621 | 0 | None | - | 0 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL424336 | 165621 | 0 | None | - | 0 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11201079 | 46218 | 0 | None | - | 0 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 424 | 12 | 2 | 3 | 5.3 | c1ccc(C(CCc2nc(CCNCCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153474 | 46218 | 0 | None | - | 0 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 424 | 12 | 2 | 3 | 5.3 | c1ccc(C(CCc2nc(CCNCCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11235688 | 119852 | 0 | None | - | 1 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 427 | 13 | 3 | 3 | 5.1 | c1ccc(C(CCc2nc(CCNCCCCc3c[nH]cn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL348656 | 119852 | 0 | None | - | 1 | Guinea pig | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 427 | 13 | 3 | 3 | 5.1 | c1ccc(C(CCc2nc(CCNCCCCc3c[nH]cn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 42625384 | 169773 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Binding | ChEMBL | 209 | 4 | 3 | 2 | -0.2 | CC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| CHEMBL443896 | 169773 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Binding | ChEMBL | 209 | 4 | 3 | 2 | -0.2 | CC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm020415q | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm020415q | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm020415q | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm020415q | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm020415q | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm020415q | |||
| 11407994 | 46478 | 0 | None | - | 0 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153736 | 46478 | 0 | None | - | 0 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11269940 | 46531 | 1 | None | - | 1 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 413 | 12 | 3 | 3 | 4.7 | c1ccc(C(CCc2nc(CCNCCCc3c[nH]cn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153776 | 46531 | 1 | None | - | 1 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 413 | 12 | 3 | 3 | 4.7 | c1ccc(C(CCc2nc(CCNCCCc3c[nH]cn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 10410901 | 119747 | 0 | None | 3 | 2 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL347796 | 119747 | 0 | None | 3 | 2 | Guinea pig | 7.9 | pEC50 | = | 7.9 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11166893 | 46214 | 0 | None | - | 0 | Guinea pig | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 452 | 14 | 2 | 3 | 6.1 | c1ccc(C(CCc2nc(CCNCCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153468 | 46214 | 0 | None | - | 0 | Guinea pig | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 452 | 14 | 2 | 3 | 6.1 | c1ccc(C(CCc2nc(CCNCCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 10447834 | 1933 | 4 | None | 8 | 5 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 4026 | 1933 | 4 | None | 8 | 5 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| CHEMBL275507 | 1933 | 4 | None | 8 | 5 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 10403687 | 2511 | 3 | None | -7 | 5 | Rat | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 1205 | 2511 | 3 | None | -7 | 5 | Rat | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| CHEMBL275035 | 2511 | 3 | None | -7 | 5 | Rat | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 1204 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 1247 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 1375 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 774 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| CHEMBL90 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| DB05381 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 42626110 | 179769 | 0 | None | - | 0 | Human | 5.8 | pEC50 | = | 5.8 | Binding | ChEMBL | 310 | 5 | 4 | 2 | 1.6 | N/C(=N\C(=O)c1cc2ccccc2[nH]1)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| CHEMBL474448 | 179769 | 0 | None | - | 0 | Human | 5.8 | pEC50 | = | 5.8 | Binding | ChEMBL | 310 | 5 | 4 | 2 | 1.6 | N/C(=N\C(=O)c1cc2ccccc2[nH]1)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| 10447834 | 1933 | 4 | None | 8 | 5 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 4026 | 1933 | 4 | None | 8 | 5 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| CHEMBL275507 | 1933 | 4 | None | 8 | 5 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm800841w | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm800841w | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm800841w | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm800841w | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm800841w | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm800841w | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.6b00120 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.6b00120 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.6b00120 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.6b00120 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.6b00120 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.03.082 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.03.082 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.03.082 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.03.082 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.03.082 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.bmcl.2010.03.082 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm9000693 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm9000693 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm9000693 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm9000693 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm9000693 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm9000693 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1039/C3MD00245D | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1039/C3MD00245D | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1039/C3MD00245D | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1039/C3MD00245D | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1039/C3MD00245D | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1039/C3MD00245D | |||
| 1204 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 1247 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 1375 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 774 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| CHEMBL90 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| DB05381 | 1932 | 119 | None | -46 | 24 | Guinea pig | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.6 | pEC50 | = | 8.6 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/np058114h | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.6 | pEC50 | = | 8.6 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/np058114h | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.6 | pEC50 | = | 8.6 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/np058114h | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.6 | pEC50 | = | 8.6 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/np058114h | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.6 | pEC50 | = | 8.6 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/np058114h | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.6 | pEC50 | = | 8.6 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/np058114h | |||
| 10364258 | 45769 | 0 | None | 2 | 2 | Guinea pig | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153067 | 45769 | 0 | None | 2 | 2 | Guinea pig | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11475781 | 46057 | 0 | None | - | 0 | Guinea pig | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 424 | 12 | 2 | 3 | 5.3 | c1ccc(C(CCc2nc(CCNCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153321 | 46057 | 0 | None | - | 0 | Guinea pig | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | 424 | 12 | 2 | 3 | 5.3 | c1ccc(C(CCc2nc(CCNCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 42625386 | 178353 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Binding | ChEMBL | 237 | 6 | 3 | 2 | 0.6 | CCCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| CHEMBL465170 | 178353 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Binding | ChEMBL | 237 | 6 | 3 | 2 | 0.6 | CCCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| 11453438 | 45701 | 0 | None | - | 0 | Guinea pig | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153010 | 45701 | 0 | None | - | 0 | Guinea pig | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 10410901 | 119747 | 0 | None | -3 | 2 | Rat | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL347796 | 119747 | 0 | None | -3 | 2 | Rat | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 42625304 | 179100 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Binding | ChEMBL | 237 | 5 | 3 | 2 | 0.4 | CC(C)C(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| CHEMBL471724 | 179100 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Binding | ChEMBL | 237 | 5 | 3 | 2 | 0.4 | CC(C)C(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| 11775345 | 42176 | 0 | None | - | 0 | Guinea pig | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 452 | 14 | 2 | 3 | 6.1 | c1ccc(C(CCc2nc(CCNCCCCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL149684 | 42176 | 0 | None | - | 0 | Guinea pig | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | 452 | 14 | 2 | 3 | 6.1 | c1ccc(C(CCc2nc(CCNCCCCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11339274 | 119624 | 0 | None | - | 0 | Guinea pig | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 424 | 12 | 2 | 3 | 5.3 | c1ccc(C(CCc2nc(CCNCCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL346620 | 119624 | 0 | None | - | 0 | Guinea pig | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 424 | 12 | 2 | 3 | 5.3 | c1ccc(C(CCc2nc(CCNCCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11741669 | 96753 | 0 | None | -2 | 2 | Rat | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL264491 | 96753 | 0 | None | -2 | 2 | Rat | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 42625303 | 180766 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 223 | 5 | 3 | 2 | 0.2 | CCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| CHEMBL475621 | 180766 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 223 | 5 | 3 | 2 | 0.2 | CCC(=O)/N=C(\N)NCCCc1c[nH]cn1 | 10.1021/jm9000693 | |||
| 10403687 | 2511 | 3 | None | 7 | 5 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 1205 | 2511 | 3 | None | 7 | 5 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| CHEMBL275035 | 2511 | 3 | None | 7 | 5 | Guinea pig | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 1204 | 1932 | 119 | None | -309 | 24 | Rat | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 1247 | 1932 | 119 | None | -309 | 24 | Rat | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 1375 | 1932 | 119 | None | -309 | 24 | Rat | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 774 | 1932 | 119 | None | -309 | 24 | Rat | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| CHEMBL90 | 1932 | 119 | None | -309 | 24 | Rat | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| DB05381 | 1932 | 119 | None | -309 | 24 | Rat | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm0309147 | |||
| 11741669 | 96753 | 0 | None | 2 | 2 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Binding | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL264491 | 96753 | 0 | None | 2 | 2 | Guinea pig | 8.3 | pEC50 | = | 8.3 | Binding | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 10364258 | 45769 | 0 | None | -2 | 2 | Rat | 6.3 | pEC50 | = | 6.3 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153067 | 45769 | 0 | None | -2 | 2 | Rat | 6.3 | pEC50 | = | 6.3 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 10403687 | 2511 | 3 | None | 7 | 5 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 1205 | 2511 | 3 | None | 7 | 5 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| CHEMBL275035 | 2511 | 3 | None | 7 | 5 | Guinea pig | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 10410901 | 119747 | 0 | None | 3 | 2 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL347796 | 119747 | 0 | None | 3 | 2 | Guinea pig | 8.2 | pEC50 | = | 8.2 | Binding | ChEMBL | 438 | 13 | 2 | 3 | 5.7 | c1ccc(C(CCc2nc(CCNCCCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 46887041 | 8760 | 1 | None | - | 0 | Human | 5.2 | pEC50 | = | 5.2 | Binding | ChEMBL | 313 | 7 | 4 | 3 | 2.2 | C[C@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1016/j.bmcl.2010.03.082 | |||
| CHEMBL1096428 | 8760 | 1 | None | - | 0 | Human | 5.2 | pEC50 | = | 5.2 | Binding | ChEMBL | 313 | 7 | 4 | 3 | 2.2 | C[C@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1016/j.bmcl.2010.03.082 | |||
| 46887043 | 8763 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 319 | 7 | 4 | 3 | 2.6 | C[C@@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1016/j.bmcl.2010.03.082 | |||
| CHEMBL1096431 | 8763 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 319 | 7 | 4 | 3 | 2.6 | C[C@@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1016/j.bmcl.2010.03.082 | |||
| 11269875 | 121004 | 0 | None | - | 1 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL356449 | 121004 | 0 | None | - | 1 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 10364258 | 45769 | 0 | None | 2 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL153067 | 45769 | 0 | None | 2 | 2 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3ccccn3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11269875 | 121004 | 0 | None | - | 1 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL356449 | 121004 | 0 | None | - | 1 | Guinea pig | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 410 | 11 | 2 | 3 | 4.9 | c1ccc(C(CCc2nc(CCNCCc3cccnc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 46830167 | 8761 | 0 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 313 | 7 | 4 | 3 | 2.2 | C[C@@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1016/j.bmcl.2010.03.082 | |||
| CHEMBL1096429 | 8761 | 0 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 313 | 7 | 4 | 3 | 2.2 | C[C@@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1016/j.bmcl.2010.03.082 | |||
| 10447834 | 1933 | 4 | None | -8 | 5 | Rat | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 4026 | 1933 | 4 | None | -8 | 5 | Rat | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| CHEMBL275507 | 1933 | 4 | None | -8 | 5 | Rat | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm0309147 | |||
| 10374457 | 28895 | 2 | None | - | 2 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 123 | 1 | 2 | 2 | 0.2 | N[C@H]1C[C@@H]1c1c[nH]cn1 | 10.1021/jm020415q | |||
| CHEMBL13795 | 28895 | 2 | None | - | 2 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 123 | 1 | 2 | 2 | 0.2 | N[C@H]1C[C@@H]1c1c[nH]cn1 | 10.1021/jm020415q | |||
| 46887042 | 8762 | 0 | None | - | 0 | Human | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 319 | 7 | 4 | 3 | 2.6 | C[C@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1016/j.bmcl.2010.03.082 | |||
| CHEMBL1096430 | 8762 | 0 | None | - | 0 | Human | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | 319 | 7 | 4 | 3 | 2.6 | C[C@H](CC(=O)NC(=N)NCCCc1c[nH]cn1)C1CCCCC1 | 10.1016/j.bmcl.2010.03.082 | |||
| 11741669 | 96753 | 0 | None | 2 | 2 | Guinea pig | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL264491 | 96753 | 0 | None | 2 | 2 | Guinea pig | 8.0 | pEC50 | = | 8.0 | Binding | ChEMBL | 399 | 11 | 3 | 3 | 4.3 | c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 11178495 | 168668 | 0 | None | - | 0 | Guinea pig | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | 452 | 14 | 2 | 3 | 6.1 | c1ccc(C(CCc2nc(CCNCCCCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| CHEMBL436415 | 168668 | 0 | None | - | 0 | Guinea pig | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | 452 | 14 | 2 | 3 | 6.1 | c1ccc(C(CCc2nc(CCNCCCCCc3ccncc3)c[nH]2)c2ccccc2)cc1 | 10.1021/jm0309147 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.03.006 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.03.006 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.03.006 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.03.006 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.03.006 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 10.9 | pIC50 | = | 10.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.03.006 | |||
| 180 | 401 | 56 | None | -11 | 40 | Rat | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| 200 | 401 | 56 | None | -11 | 40 | Rat | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| 2160 | 401 | 56 | None | -11 | 40 | Rat | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| CHEMBL629 | 401 | 56 | None | -11 | 40 | Rat | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| DB00321 | 401 | 56 | None | -11 | 40 | Rat | 10.7 | pIC50 | = | 10.7 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| 1971 | 2866 | 38 | None | -9 | 30 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1021/jm9910369 | |||
| 2404 | 2866 | 38 | None | -9 | 30 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1021/jm9910369 | |||
| 4543 | 2866 | 38 | None | -9 | 30 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1021/jm9910369 | |||
| CHEMBL445 | 2866 | 38 | None | -9 | 30 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1021/jm9910369 | |||
| DB00540 | 2866 | 38 | None | -9 | 30 | Rat | 10.3 | pIC50 | = | 10.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1021/jm9910369 | |||
| 1427 | 2013 | 54 | None | -1 | 27 | Rat | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| 357 | 2013 | 54 | None | -1 | 27 | Rat | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| 3696 | 2013 | 54 | None | -1 | 27 | Rat | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| CHEMBL11 | 2013 | 54 | None | -1 | 27 | Rat | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| DB00458 | 2013 | 54 | None | -1 | 27 | Rat | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm9910369 | |||
| 76316323 | 85629 | 0 | None | - | 0 | Guinea pig | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 314 | 2 | 1 | 6 | 1.6 | NC(=O)c1c(N2CCCC2)nc2sc3ccccc3n2c1=O | 10.1007/s00044-012-0100-4 | |||
| CHEMBL2283398 | 85629 | 0 | None | - | 0 | Guinea pig | 10.2 | pIC50 | = | 10.2 | Binding | ChEMBL | 314 | 2 | 1 | 6 | 1.6 | NC(=O)c1c(N2CCCC2)nc2sc3ccccc3n2c1=O | 10.1007/s00044-012-0100-4 | |||
| 2398 | 954 | 62 | None | - | 29 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1021/jm9910369 | |||
| 2801 | 954 | 62 | None | - | 29 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1021/jm9910369 | |||
| 701 | 954 | 62 | None | - | 29 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1021/jm9910369 | |||
| CHEMBL415 | 954 | 62 | None | - | 29 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1021/jm9910369 | |||
| DB01242 | 954 | 62 | None | - | 29 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1021/jm9910369 | |||
| 13726621 | 95265 | 0 | None | - | 0 | Guinea pig | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 311 | 3 | 0 | 4 | 2.2 | CN1C[C@@H](CCN2CCC2)Oc2ncc(Cl)cc2C1=S | 10.1021/jm00108a012 | |||
| CHEMBL25626 | 95265 | 0 | None | - | 0 | Guinea pig | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 311 | 3 | 0 | 4 | 2.2 | CN1C[C@@H](CCN2CCC2)Oc2ncc(Cl)cc2C1=S | 10.1021/jm00108a012 | |||
| 26987 | 949 | 33 | None | 16 | 21 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| 6063 | 949 | 33 | None | 16 | 21 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| 671 | 949 | 33 | None | 16 | 21 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| CHEMBL1626 | 949 | 33 | None | 16 | 21 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| DB00283 | 949 | 33 | None | 16 | 21 | Human | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| 3158 | 56267 | 27 | None | 40 | 20 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | nan | |||
| CHEMBL1628227 | 56267 | 27 | None | 40 | 20 | Human | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | nan | |||
| 2995 | 204405 | 53 | None | -42 | 23 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1021/jm9910369 | |||
| CHEMBL1696 | 204405 | 53 | None | -42 | 23 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1021/jm9910369 | |||
| CHEMBL72 | 204405 | 53 | None | -42 | 23 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1021/jm9910369 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2013.03.016 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2013.03.016 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2013.03.016 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2013.03.016 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2013.03.016 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2013.03.016 | |||
| 1224 | 1432 | 83 | None | 1 | 13 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1021/jm00173a011 | |||
| 3100 | 1432 | 83 | None | 1 | 13 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1021/jm00173a011 | |||
| 8980 | 1432 | 83 | None | 1 | 13 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1021/jm00173a011 | |||
| 916 | 1432 | 83 | None | 1 | 13 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1021/jm00173a011 | |||
| CHEMBL657 | 1432 | 83 | None | 1 | 13 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1021/jm00173a011 | |||
| DB01075 | 1432 | 83 | None | 1 | 13 | Guinea pig | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1021/jm00173a011 | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmc.2011.03.003 | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmc.2011.03.003 | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmc.2011.03.003 | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmc.2011.03.003 | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmcl.2009.03.124 | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmcl.2009.03.124 | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmcl.2009.03.124 | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1016/j.bmcl.2009.03.124 | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm501535r | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm501535r | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm501535r | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm501535r | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm501535r | |||
| 137125256 | 123051 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 328 | 0 | 1 | 4 | 3.3 | CN1CCN(C2=Nc3cc(F)ccc3Nc3ccc(F)cc32)CC1 | 10.1021/acsmedchemlett.5b00102 | |||
| CHEMBL3609328 | 123051 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 328 | 0 | 1 | 4 | 3.3 | CN1CCN(C2=Nc3cc(F)ccc3Nc3ccc(F)cc32)CC1 | 10.1021/acsmedchemlett.5b00102 | |||
| 11976 | 920 | 59 | None | - | 24 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | |||
| 667467 | 920 | 59 | None | - | 24 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | |||
| CHEMBL908 | 920 | 59 | None | - | 24 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | |||
| DB01239 | 920 | 59 | None | - | 24 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1021/jm300671m | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 44318581 | 205916 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3ccccc3Cc3cc(F)ccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL84081 | 205916 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3ccccc3Cc3cc(F)ccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm058018d | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm058018d | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm058018d | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm058018d | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm058018d | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm058018d | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.11.014 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.11.014 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.11.014 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.11.014 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.11.014 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2016.11.014 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 1227 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2010.07.034 | |||
| 2331 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2010.07.034 | |||
| 3957 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2010.07.034 | |||
| 4992 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL511 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2010.07.034 | |||
| DB06691 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmc.2010.07.034 | |||
| 135 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| 1027 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 3241 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 7176 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| CHEMBL1106 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| DB00751 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 44461456 | 205749 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.8 | CN(C)CC1(C)CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL82714 | 205749 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.8 | CN(C)CC1(C)CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 72548703 | 161567 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | |||
| CHEMBL4128926 | 161567 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | |||
| 44318554 | 107079 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3ccccc3Cc3c(F)cccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL315834 | 107079 | 0 | None | - | 0 | Human | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3ccccc3Cc3c(F)cccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm701575k | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm701575k | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm701575k | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm701575k | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm701575k | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm701575k | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2019.126712 | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2019.126712 | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2019.126712 | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2019.126712 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 13726596 | 93948 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 299 | 3 | 0 | 4 | 2.1 | CN(C)CC[C@@H]1CN(C)C(=S)c2cc(Cl)cnc2O1 | 10.1021/jm00108a012 | |||
| CHEMBL24835 | 93948 | 0 | None | - | 0 | Guinea pig | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 299 | 3 | 0 | 4 | 2.1 | CN(C)CC[C@@H]1CN(C)C(=S)c2cc(Cl)cnc2O1 | 10.1021/jm00108a012 | |||
| 19426635 | 205593 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 280 | 2 | 1 | 3 | 3.1 | CNCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL81485 | 205593 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 280 | 2 | 1 | 3 | 3.1 | CNCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 9869791 | 63926 | 20 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 480 | 8 | 1 | 7 | 0.9 | CN1CCN(S(=O)(=O)CCCN2CCC(CNC(=O)c3cccc4c3OCCO4)CC2)CC1 | 10.1016/j.bmcl.2005.01.039 | |||
| CHEMBL180632 | 63926 | 20 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 480 | 8 | 1 | 7 | 0.9 | CN1CCN(S(=O)(=O)CCCN2CCC(CNC(=O)c3cccc4c3OCCO4)CC2)CC1 | 10.1016/j.bmcl.2005.01.039 | |||
| 11453538 | 84744 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 442 | 10 | 1 | 6 | 4.7 | CCOCCn1cc(C2CCN(CCOc3ccsc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL222927 | 84744 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 442 | 10 | 1 | 6 | 4.7 | CCOCCn1cc(C2CCN(CCOc3ccsc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 11396873 | 136985 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 454 | 10 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cc(F)ccc21 | 10.1021/jm0498203 | |||
| CHEMBL374585 | 136985 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 454 | 10 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cc(F)ccc21 | 10.1021/jm0498203 | |||
| 1853 | 3551 | 38 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1021/jm058225d | |||
| 60680 | 3551 | 38 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1021/jm058225d | |||
| CHEMBL10971 | 3551 | 38 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1021/jm058225d | |||
| 1613 | 2348 | 53 | None | - | 44 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1021/jm991005d | |||
| 205 | 2348 | 53 | None | - | 44 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1021/jm991005d | |||
| 3964 | 2348 | 53 | None | - | 44 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1021/jm991005d | |||
| CHEMBL831 | 2348 | 53 | None | - | 44 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1021/jm991005d | |||
| DB00408 | 2348 | 53 | None | - | 44 | Rat | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1021/jm991005d | |||
| 3689 | 102771 | 55 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | 10.1021/jm00114a018 | |||
| CHEMBL1372983 | 102771 | 55 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | 10.1021/jm00114a018 | |||
| CHEMBL305187 | 102771 | 55 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | 10.1021/jm00114a018 | |||
| 11430418 | 18786 | 12 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 432 | 6 | 1 | 7 | 2.5 | Nn1c(CCCCN2CCN(c3ccc4ccccc4n3)CC2)nc2c(c1=O)CCCC2 | 10.1021/jm1002292 | |||
| CHEMBL1278088 | 18786 | 12 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 432 | 6 | 1 | 7 | 2.5 | Nn1c(CCCCN2CCN(c3ccc4ccccc4n3)CC2)nc2c(c1=O)CCCC2 | 10.1021/jm1002292 | |||
| 11459394 | 48166 | 1 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 251 | 12 | 2 | 2 | 3.8 | NCCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| CHEMBL155188 | 48166 | 1 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 251 | 12 | 2 | 2 | 3.8 | NCCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| 5310982 | 93612 | 4 | None | - | 3 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1021/jm030936t | |||
| CHEMBL24665 | 93612 | 4 | None | - | 3 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 255 | 3 | 2 | 2 | 2.6 | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 | 10.1021/jm030936t | |||
| 107782 | 14468 | 18 | None | 1 | 5 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | nan | |||
| 67151996 | 14468 | 18 | None | 1 | 5 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | nan | |||
| CHEMBL1201207 | 14468 | 18 | None | 1 | 5 | Human | 5.0 | pIC50 | = | 5 | Binding | ChEMBL | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | nan | |||
| 44461357 | 104374 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 330 | 2 | 0 | 4 | 4.3 | CN(C)CC1CC2c3ccccc3Oc3ccc(Cl)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL310183 | 104374 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 330 | 2 | 0 | 4 | 4.3 | CN(C)CC1CC2c3ccccc3Oc3ccc(Cl)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 10205121 | 66692 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 464 | 6 | 1 | 4 | 6.5 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)c1 | 10.1021/jm0498203 | |||
| CHEMBL185489 | 66692 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 464 | 6 | 1 | 4 | 6.5 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)c1 | 10.1021/jm0498203 | |||
| 45268185 | 196107 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 535 | 8 | 1 | 9 | 2.9 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(CCC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL560917 | 196107 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 535 | 8 | 1 | 9 | 2.9 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(CCC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 14762577 | 4468 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 336 | 6 | 1 | 2 | 3.7 | Cc1ccccc1C(=O)NCCN1CCC(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| CHEMBL101790 | 4468 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 336 | 6 | 1 | 2 | 3.7 | Cc1ccccc1C(=O)NCCN1CCC(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| 44318841 | 106927 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1cccc2c1C1CC(CN(C)C)ON1c1ccccc1C2 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL314795 | 106927 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1cccc2c1C1CC(CN(C)C)ON1c1ccccc1C2 | 10.1016/s0960-894x(01)00721-1 | |||
| 155554175 | 175693 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccc(OCC(O)CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4581995 | 175693 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccc(OCC(O)CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2019.126712 | |||
| 9904236 | 14076 | 22 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 295 | 0 | 1 | 3 | 3.7 | O=C1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| CHEMBL1197564 | 14076 | 22 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 295 | 0 | 1 | 3 | 3.7 | O=C1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| 9904236 | 14076 | 22 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 295 | 0 | 1 | 3 | 3.7 | O=C1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| CHEMBL1197564 | 14076 | 22 | None | - | 1 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 295 | 0 | 1 | 3 | 3.7 | O=C1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| 118162109 | 186246 | 11 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 447 | 8 | 3 | 9 | 3.1 | CC(F)(F)COc1ncncc1CNc1ncc(C#N)c(N[C@@H]2CC[C@H](O)C(C)(C)C2)n1 | 10.1021/acs.jmedchem.1c00388 | |||
| CHEMBL4873647 | 186246 | 11 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 447 | 8 | 3 | 9 | 3.1 | CC(F)(F)COc1ncncc1CNc1ncc(C#N)c(N[C@@H]2CC[C@H](O)C(C)(C)C2)n1 | 10.1021/acs.jmedchem.1c00388 | |||
| 736282 | 78142 | 12 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 337 | 6 | 1 | 3 | 4.2 | CN1[C@H](CC(=O)c2ccccc2)CCC[C@@H]1C[C@H](O)c1ccccc1 | 10.1021/jm300671m | |||
| CHEMBL2103769 | 78142 | 12 | None | - | 0 | Rat | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 337 | 6 | 1 | 3 | 4.2 | CN1[C@H](CC(=O)c2ccccc2)CCC[C@@H]1C[C@H](O)c1ccccc1 | 10.1021/jm300671m | |||
| 13726595 | 99573 | 0 | None | - | 0 | Guinea pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 299 | 3 | 0 | 4 | 2.1 | CN(C)CC[C@H]1CN(C)C(=S)c2cc(Cl)cnc2O1 | 10.1021/jm00108a012 | |||
| CHEMBL283760 | 99573 | 0 | None | - | 0 | Guinea pig | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 299 | 3 | 0 | 4 | 2.1 | CN(C)CC[C@H]1CN(C)C(=S)c2cc(Cl)cnc2O1 | 10.1021/jm00108a012 | |||
| 2726 | 919 | 68 | None | -2 | 72 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm400856t | |||
| 621 | 919 | 68 | None | -2 | 72 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm400856t | |||
| 83 | 919 | 68 | None | -2 | 72 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm400856t | |||
| CHEMBL71 | 919 | 68 | None | -2 | 72 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm400856t | |||
| DB00477 | 919 | 68 | None | -2 | 72 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm400856t | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm030936t | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm030936t | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm030936t | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm030936t | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm030936t | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm030936t | |||
| 10026300 | 167834 | 17 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 441 | 2 | 0 | 7 | 3.3 | CN1CCN(C2=Nc3ccccc3Oc3ccc(OS(=O)(=O)C(F)(F)F)cc32)CC1 | 10.1021/jm991005d | |||
| CHEMBL430798 | 167834 | 17 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 441 | 2 | 0 | 7 | 3.3 | CN1CCN(C2=Nc3ccccc3Oc3ccc(OS(=O)(=O)C(F)(F)F)cc32)CC1 | 10.1021/jm991005d | |||
| 10141470 | 123557 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 494 | 8 | 1 | 5 | 6.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL361805 | 123557 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 494 | 8 | 1 | 5 | 6.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| 44392633 | 65576 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 454 | 9 | 1 | 4 | 6.1 | CCCCn1cc(C2CCN(CCOc3cc(Cl)ccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL183168 | 65576 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 454 | 9 | 1 | 4 | 6.1 | CCCCn1cc(C2CCN(CCOc3cc(Cl)ccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 9932752 | 141983 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 436 | 8 | 1 | 4 | 5.1 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CC3CC3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL387391 | 141983 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 436 | 8 | 1 | 4 | 5.1 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CC3CC3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| 45485061 | 198754 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 489 | 5 | 2 | 5 | 5.0 | Cc1cc(N(C)C)nc(N[C@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)n1 | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL583014 | 198754 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 489 | 5 | 2 | 5 | 5.0 | Cc1cc(N(C)C)nc(N[C@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)n1 | 10.1016/j.bmcl.2009.09.003 | |||
| 45269073 | 196388 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 563 | 7 | 1 | 9 | 3.7 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(C(C)(C)C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL562676 | 196388 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 563 | 7 | 1 | 9 | 3.7 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(C(C)(C)C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 45269070 | 196616 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 493 | 5 | 1 | 9 | 2.2 | Cn1c(N2CCN(CCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL564168 | 196616 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 493 | 5 | 1 | 9 | 2.2 | Cn1c(N2CCN(CCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 4601 | 206747 | 35 | None | -1 | 16 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | nan | |||
| CHEMBL1201023 | 206747 | 35 | None | -1 | 16 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | nan | |||
| CHEMBL900 | 206747 | 35 | None | -1 | 16 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | nan | |||
| 10226501 | 137874 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 7 | 1 | 5 | 5.8 | COc1ccc(CN2CCC(c3cn(Cc4cccs4)c4ccccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| CHEMBL376202 | 137874 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 460 | 7 | 1 | 5 | 5.8 | COc1ccc(CN2CCC(c3cn(Cc4cccs4)c4ccccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| 2284 | 3182 | 33 | None | -10 | 29 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | |||
| 4926 | 3182 | 33 | None | -10 | 29 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | |||
| 7281 | 3182 | 33 | None | -10 | 29 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | |||
| CHEMBL564 | 3182 | 33 | None | -10 | 29 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | |||
| DB00420 | 3182 | 33 | None | -10 | 29 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1021/jm300671m | |||
| 1197 | 88 | 120 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 122 | 2 | 1 | 2 | 0.6 | NCCc1ccccn1 | 10.1021/jm030936t | |||
| 75919 | 88 | 120 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 122 | 2 | 1 | 2 | 0.6 | NCCc1ccccn1 | 10.1021/jm030936t | |||
| CHEMBL32813 | 88 | 120 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 122 | 2 | 1 | 2 | 0.6 | NCCc1ccccn1 | 10.1021/jm030936t | |||
| 10890691 | 44716 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 262 | 12 | 1 | 2 | 4.5 | NCCCCCCCCCCCCc1cccnc1 | 10.1021/jm030936t | |||
| CHEMBL152122 | 44716 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 262 | 12 | 1 | 2 | 4.5 | NCCCCCCCCCCCCc1cccnc1 | 10.1021/jm030936t | |||
| 11288570 | 49000 | 1 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 265 | 13 | 2 | 2 | 4.2 | NCCCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| CHEMBL156071 | 49000 | 1 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 265 | 13 | 2 | 2 | 4.2 | NCCCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| 2142 | 3096 | 58 | None | -7585 | 36 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1021/jm300671m | |||
| 4920903 | 3096 | 58 | None | -7585 | 36 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1021/jm300671m | |||
| 502 | 3096 | 58 | None | -7585 | 36 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1021/jm300671m | |||
| 5775 | 3096 | 58 | None | -7585 | 36 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1021/jm300671m | |||
| CHEMBL597 | 3096 | 58 | None | -7585 | 36 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1021/jm300671m | |||
| DB00692 | 3096 | 58 | None | -7585 | 36 | Rat | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | 10.1021/jm300671m | |||
| 9802248 | 166243 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 420 | 9 | 1 | 4 | 5.4 | CCCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL426786 | 166243 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 420 | 9 | 1 | 4 | 5.4 | CCCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 14762597 | 4343 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 392 | 4 | 2 | 3 | 3.4 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1F | 10.1021/jm00173a011 | |||
| CHEMBL101029 | 4343 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 392 | 4 | 2 | 3 | 3.4 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1F | 10.1021/jm00173a011 | |||
| 54582401 | 61998 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 533 | 7 | 1 | 9 | 2.3 | Cn1c(N2CCCN(CCCN3c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774493 | 61998 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 533 | 7 | 1 | 9 | 2.3 | Cn1c(N2CCCN(CCCN3c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 54583384 | 61999 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 547 | 7 | 1 | 9 | 2.9 | CC(C(=O)O)c1ccc2c(c1)N(CCCN1CCCN(c3cc(=O)n(C)c(=O)n3C)CC1)c1ccccc1CO2 | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774494 | 61999 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 547 | 7 | 1 | 9 | 2.9 | CC(C(=O)O)c1ccc2c(c1)N(CCCN1CCCN(c3cc(=O)n(C)c(=O)n3C)CC1)c1ccccc1CO2 | 10.1016/j.bmc.2011.03.003 | |||
| 11071079 | 110593 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 496 | 9 | 0 | 3 | 6.0 | O=C(OCCc1ccc(F)cc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
| CHEMBL325516 | 110593 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 496 | 9 | 0 | 3 | 6.0 | O=C(OCCc1ccc(F)cc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| 135398745 | 2914 | 112 | None | -1 | 65 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1073/pnas.0611417104 | |||
| 47 | 2914 | 112 | None | -1 | 65 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1073/pnas.0611417104 | |||
| CHEMBL715 | 2914 | 112 | None | -1 | 65 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1073/pnas.0611417104 | |||
| DB00334 | 2914 | 112 | None | -1 | 65 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1073/pnas.0611417104 | |||
| 44461622 | 205943 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 322 | 4 | 0 | 3 | 4.2 | CCN(CC)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL84293 | 205943 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 322 | 4 | 0 | 3 | 4.2 | CCN(CC)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 11476077 | 136407 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.5 | CCOCCn1cc(C2CCN(Cc3cccc(OCC(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL373534 | 136407 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.5 | CCOCCn1cc(C2CCN(Cc3cccc(OCC(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 137125241 | 123063 | 30 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 479 | 4 | 2 | 4 | 5.1 | CC(C)NC(=O)N1CC[C@H](NC2=Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1 | 10.6019/CHEMBL5212743 | |||
| CHEMBL3609372 | 123063 | 30 | None | - | 0 | Human | 4.9 | pIC50 | = | 4.9 | Binding | ChEMBL | 479 | 4 | 2 | 4 | 5.1 | CC(C)NC(=O)N1CC[C@H](NC2=Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1 | 10.6019/CHEMBL5212743 | |||
| 14762603 | 4196 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 380 | 5 | 1 | 5 | 2.7 | O=C(CCN1CCN2Cc3ccccc3CC2C1)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| CHEMBL100169 | 4196 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 380 | 5 | 1 | 5 | 2.7 | O=C(CCN1CCN2Cc3ccccc3CC2C1)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| 14762570 | 4288 | 3 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 368 | 7 | 1 | 5 | 2.1 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| CHEMBL100695 | 4288 | 3 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 368 | 7 | 1 | 5 | 2.1 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| 771426 | 4384 | 17 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 341 | 6 | 1 | 3 | 3.0 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1F | 10.1021/jm00173a011 | |||
| CHEMBL101312 | 4384 | 17 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 341 | 6 | 1 | 3 | 3.0 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1F | 10.1021/jm00173a011 | |||
| 14762602 | 4171 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 335 | 4 | 1 | 3 | 2.8 | O=C(CCN1CCN2Cc3ccccc3CC2C1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| CHEMBL100064 | 4171 | 0 | None | - | 0 | Guinea pig | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 335 | 4 | 1 | 3 | 2.8 | O=C(CCN1CCN2Cc3ccccc3CC2C1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| 3151 | 1462 | 97 | None | -41 | 27 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| 945 | 1462 | 97 | None | -41 | 27 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| 965 | 1462 | 97 | None | -41 | 27 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| CHEMBL219916 | 1462 | 97 | None | -41 | 27 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| DB01184 | 1462 | 97 | None | -41 | 27 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| 54581387 | 62011 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 528 | 6 | 1 | 7 | 2.8 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4CCc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774506 | 62011 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 528 | 6 | 1 | 7 | 2.8 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4CCc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 44392585 | 122612 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 528 | 8 | 1 | 5 | 7.0 | O=C(O)c1ccc(Cl)cc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL360270 | 122612 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 528 | 8 | 1 | 5 | 7.0 | O=C(O)c1ccc(Cl)cc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| 249 | 505 | 81 | None | -4 | 42 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| 44319119 | 106967 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 324 | 3 | 0 | 4 | 3.4 | COc1ccc2c(c1)C1CC(CN(C)C)ON1c1ccccc1C2 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL315044 | 106967 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 324 | 3 | 0 | 4 | 3.4 | COc1ccc2c(c1)C1CC(CN(C)C)ON1c1ccccc1C2 | 10.1016/s0960-894x(01)00721-1 | |||
| 9823337 | 137264 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 418 | 8 | 1 | 4 | 5.0 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CC3CC3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL375208 | 137264 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 418 | 8 | 1 | 4 | 5.0 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CC3CC3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| 11362693 | 141612 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 440 | 9 | 1 | 5 | 4.4 | COCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| CHEMBL385133 | 141612 | 0 | None | - | 0 | Guinea pig | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 440 | 9 | 1 | 5 | 4.4 | COCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| 54581386 | 61995 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 505 | 6 | 1 | 9 | 2.0 | Cn1c(N2CCN(CCCN3c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774490 | 61995 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 505 | 6 | 1 | 9 | 2.0 | Cn1c(N2CCN(CCCN3c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 9889247 | 84761 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL223024 | 84761 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 10478188 | 122942 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 436 | 9 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL360712 | 122942 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 436 | 9 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 5624 | 32693 | 14 | None | -5 | 10 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 520 | 5 | 1 | 8 | 4.2 | Cc1c(C)c2c(c(C)c1O)CCC(C)(CN1CCN(c3cc(N4CCCC4)nc(N4CCCC4)n3)CC1)O2 | nan | |||
| CHEMBL1203324 | 32693 | 14 | None | -5 | 10 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 520 | 5 | 1 | 8 | 4.2 | Cc1c(C)c2c(c(C)c1O)CCC(C)(CN1CCN(c3cc(N4CCCC4)nc(N4CCCC4)n3)CC1)O2 | nan | |||
| CHEMBL141343 | 32693 | 14 | None | -5 | 10 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 520 | 5 | 1 | 8 | 4.2 | Cc1c(C)c2c(c(C)c1O)CCC(C)(CN1CCN(c3cc(N4CCCC4)nc(N4CCCC4)n3)CC1)O2 | nan | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1021/jm501535r | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1021/jm501535r | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1021/jm501535r | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1021/jm501535r | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1021/jm501535r | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1021/jm501535r | |||
| 44318834 | 106151 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 328 | 2 | 0 | 3 | 4.1 | CN(C)CC1CC2c3ccccc3Cc3cccc(Cl)c3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL313604 | 106151 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 328 | 2 | 0 | 3 | 4.1 | CN(C)CC1CC2c3ccccc3Cc3cccc(Cl)c3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 44318820 | 206038 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1ccc2c(c1)Cc1ccccc1N1OC(CN(C)C)CC21 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL85155 | 206038 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1ccc2c(c1)Cc1ccccc1N1OC(CN(C)C)CC21 | 10.1016/s0960-894x(01)00721-1 | |||
| 2865 | 4143 | 73 | None | -1047 | 53 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 59 | 4143 | 73 | None | -1047 | 53 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 60854 | 4143 | 73 | None | -1047 | 53 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| CHEMBL708 | 4143 | 73 | None | -1047 | 53 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| DB00246 | 4143 | 73 | None | -1047 | 53 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 10279311 | 84351 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 512 | 7 | 1 | 5 | 6.6 | COc1ccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4cc(F)ccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| CHEMBL221730 | 84351 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 512 | 7 | 1 | 5 | 6.6 | COc1ccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4cc(F)ccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| 11212029 | 84619 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 410 | 7 | 1 | 4 | 4.5 | COCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| CHEMBL222142 | 84619 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 410 | 7 | 1 | 4 | 4.5 | COCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| 9889248 | 84730 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccc(C(=O)O)cc3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL222853 | 84730 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccc(C(=O)O)cc3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 11329754 | 141982 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 514 | 10 | 1 | 5 | 5.4 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cc(Br)ccc21 | 10.1021/jm0498203 | |||
| CHEMBL387390 | 141982 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 514 | 10 | 1 | 5 | 5.4 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cc(Br)ccc21 | 10.1021/jm0498203 | |||
| 1305 | 511 | 14 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 4.1 | O=C(c1ccc(c(c1)F)F)N[C@@H]1CC[C@@H](CC1)Nc1nc2ccccc2c(n1)N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| 9934033 | 511 | 14 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 4.1 | O=C(c1ccc(c(c1)F)F)N[C@@H]1CC[C@@H](CC1)Nc1nc2ccccc2c(n1)N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL182150 | 511 | 14 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 4.1 | O=C(c1ccc(c(c1)F)F)N[C@@H]1CC[C@@H](CC1)Nc1nc2ccccc2c(n1)N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| 54586253 | 62000 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 561 | 7 | 1 | 9 | 3.1 | Cn1c(N2CCCN(CCCN3c4ccccc4COc4ccc(C(C)(C)C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774495 | 62000 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 561 | 7 | 1 | 9 | 3.1 | Cn1c(N2CCCN(CCCN3c4ccccc4COc4ccc(C(C)(C)C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 44461613 | 104223 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 350 | 4 | 0 | 3 | 5.0 | CC(C)N(CC1CC2c3ccccc3Cc3ccccc3N2O1)C(C)C | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL309904 | 104223 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 350 | 4 | 0 | 3 | 5.0 | CC(C)N(CC1CC2c3ccccc3Cc3ccccc3N2O1)C(C)C | 10.1016/s0960-894x(01)00721-1 | |||
| 14762593 | 4679 | 7 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 6 | 1 | 2 | 4.0 | O=C(CCN1CCC(Cc2ccccc2)CC1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| CHEMBL103303 | 4679 | 7 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 6 | 1 | 2 | 4.0 | O=C(CCN1CCC(Cc2ccccc2)CC1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| 54587282 | 62012 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 514 | 5 | 1 | 7 | 2.9 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4CCc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774507 | 62012 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 514 | 5 | 1 | 7 | 2.9 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4CCc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 14762579 | 4398 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 6 | 1 | 2 | 3.4 | O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccccc1 | 10.1021/jm00173a011 | |||
| CHEMBL101388 | 4398 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 322 | 6 | 1 | 2 | 3.4 | O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccccc1 | 10.1021/jm00173a011 | |||
| 11351801 | 84349 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 466 | 11 | 1 | 6 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cc(OC)ccc21 | 10.1021/jm0498203 | |||
| CHEMBL221716 | 84349 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 466 | 11 | 1 | 6 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cc(OC)ccc21 | 10.1021/jm0498203 | |||
| 12488 | 1657 | 56 | None | -2 | 23 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| 941361 | 1657 | 56 | None | -2 | 23 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| CHEMBL30008 | 1657 | 56 | None | -2 | 23 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| DB04841 | 1657 | 56 | None | -2 | 23 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm030936t | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm030936t | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm030936t | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm030936t | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm030936t | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm030936t | |||
| 4098 | 32505 | 30 | None | 1 | 11 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | nan | |||
| CHEMBL1255739 | 32505 | 30 | None | 1 | 11 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | nan | |||
| CHEMBL1411979 | 32505 | 30 | None | 1 | 11 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | nan | |||
| 44345317 | 113067 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 295 | 2 | 0 | 4 | 2.8 | CN(C)CC1CC2c3cccnc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(02)00796-5 | |||
| CHEMBL331188 | 113067 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 295 | 2 | 0 | 4 | 2.8 | CN(C)CC1CC2c3cccnc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(02)00796-5 | |||
| 10246054 | 106544 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 330 | 2 | 0 | 3 | 3.7 | CN(C)CC1CC2c3cc(F)ccc3Cc3ccc(F)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL314107 | 106544 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 330 | 2 | 0 | 3 | 3.7 | CN(C)CC1CC2c3cc(F)ccc3Cc3ccc(F)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 1588 | 2325 | 27 | None | -35 | 44 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| 28864 | 2325 | 27 | None | -35 | 44 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| 43 | 2325 | 27 | None | -35 | 44 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| CHEMBL157138 | 2325 | 27 | None | -35 | 44 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| DB00589 | 2325 | 27 | None | -35 | 44 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| 45485062 | 197168 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 367 | 5 | 2 | 5 | 3.3 | Cc1cccc(C(=O)N[C@H]2CC[C@@H](Nc3ncc(C)c(N(C)C)n3)CC2)c1 | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL567993 | 197168 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 367 | 5 | 2 | 5 | 3.3 | Cc1cccc(C(=O)N[C@H]2CC[C@@H](Nc3ncc(C)c(N(C)C)n3)CC2)c1 | 10.1016/j.bmcl.2009.09.003 | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 14762598 | 4314 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 374 | 4 | 2 | 3 | 3.2 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| CHEMBL100865 | 4314 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 374 | 4 | 2 | 3 | 3.2 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| 4601 | 206747 | 35 | None | - | 16 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | 10.1021/jm300671m | |||
| CHEMBL1201023 | 206747 | 35 | None | - | 16 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | 10.1021/jm300671m | |||
| CHEMBL900 | 206747 | 35 | None | - | 16 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | 10.1021/jm300671m | |||
| 11113605 | 10507 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 480 | 9 | 0 | 2 | 5.8 | O=C(CCc1ccc(F)cc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
| CHEMBL116735 | 10507 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 480 | 9 | 0 | 2 | 5.8 | O=C(CCc1ccc(F)cc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
| 2031 | 120433 | 31 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 311 | 8 | 0 | 3 | 3.7 | CCN(CC)CCOC(=O)C(c1ccccc1)c1ccccc1 | 10.1021/jm300671m | |||
| CHEMBL353846 | 120433 | 31 | None | - | 0 | Rat | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 311 | 8 | 0 | 3 | 3.7 | CCN(CC)CCOC(=O)C(c1ccccc1)c1ccccc1 | 10.1021/jm300671m | |||
| 2726 | 919 | 68 | None | -2 | 72 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| 621 | 919 | 68 | None | -2 | 72 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| 83 | 919 | 68 | None | -2 | 72 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| CHEMBL71 | 919 | 68 | None | -2 | 72 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| DB00477 | 919 | 68 | None | -2 | 72 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| 155536195 | 172164 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 504 | 7 | 1 | 5 | 5.6 | CCOc1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4473399 | 172164 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 504 | 7 | 1 | 5 | 5.6 | CCOc1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| 23027035 | 198547 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 367 | 5 | 2 | 5 | 3.3 | Cc1ccc(C(=O)N[C@H]2CC[C@@H](Nc3ncc(C)c(N(C)C)n3)CC2)cc1 | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL578170 | 198547 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 367 | 5 | 2 | 5 | 3.3 | Cc1ccc(C(=O)N[C@H]2CC[C@@H](Nc3ncc(C)c(N(C)C)n3)CC2)cc1 | 10.1016/j.bmcl.2009.09.003 | |||
| 44392612 | 66685 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 474 | 9 | 1 | 6 | 5.2 | COc1ccc(C(=O)O)c(OCCN2CCC(c3cn(Cc4ccoc4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL185454 | 66685 | 0 | None | - | 0 | Guinea pig | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 474 | 9 | 1 | 6 | 5.2 | COc1ccc(C(=O)O)c(OCCN2CCC(c3cn(Cc4ccoc4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| 126963284 | 144774 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 311 | 1 | 1 | 3 | 4.2 | CO[C@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| CHEMBL3909134 | 144774 | 0 | None | - | 1 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 311 | 1 | 1 | 3 | 4.2 | CO[C@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| 121237834 | 147359 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 297 | 0 | 2 | 3 | 3.5 | O[C@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| CHEMBL3929465 | 147359 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 297 | 0 | 2 | 3 | 3.5 | O[C@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| 14762588 | 4360 | 2 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 368 | 7 | 1 | 5 | 2.7 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| CHEMBL101122 | 4360 | 2 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 368 | 7 | 1 | 5 | 2.7 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 14762599 | 4197 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 419 | 5 | 2 | 5 | 3.1 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| CHEMBL100170 | 4197 | 0 | None | - | 0 | Guinea pig | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 419 | 5 | 2 | 5 | 3.1 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1[N+](=O)[O-] | 10.1021/jm00173a011 | |||
| 2712 | 916 | 34 | None | -5 | 4 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| 3370 | 916 | 34 | None | -5 | 4 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| 594 | 916 | 34 | None | -5 | 4 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| CHEMBL451 | 916 | 34 | None | -5 | 4 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| DB00475 | 916 | 34 | None | -5 | 4 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| 10907460 | 9828 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 521 | 11 | 1 | 3 | 5.8 | CCOc1ccc(CCNC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
| CHEMBL113956 | 9828 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 521 | 11 | 1 | 3 | 5.8 | CCOc1ccc(CCNC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
| 11340290 | 64364 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 466 | 11 | 1 | 6 | 4.6 | CCOCCn1cc(C2CCN(CCOc3cc(OC)ccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL181278 | 64364 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 466 | 11 | 1 | 6 | 4.6 | CCOCCn1cc(C2CCN(CCOc3cc(OC)ccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 11282005 | 66066 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL183706 | 66066 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 11730467 | 11028 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 476 | 10 | 0 | 2 | 6.0 | O=C(CCCc1ccccc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
| CHEMBL117537 | 11028 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 476 | 10 | 0 | 2 | 6.0 | O=C(CCCc1ccccc1)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm010878g | |||
| 54586257 | 62010 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 514 | 6 | 1 | 7 | 2.5 | Cn1c(N2CCN(CC/C=C3/c4ccccc4CCc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774505 | 62010 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 514 | 6 | 1 | 7 | 2.5 | Cn1c(N2CCN(CC/C=C3/c4ccccc4CCc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 11430513 | 84631 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.5 | CCOCCn1cc(C2CCN(Cc3ccccc3OCC(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL222217 | 84631 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.5 | CCOCCn1cc(C2CCN(Cc3ccccc3OCC(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 19426632 | 205858 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 266 | 1 | 1 | 3 | 2.8 | NCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL83731 | 205858 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 266 | 1 | 1 | 3 | 2.8 | NCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 1195 | 46 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 221 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)Cl | 10.1021/jm030936t | |||
| 14827778 | 46 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 221 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)Cl | 10.1021/jm030936t | |||
| CHEMBL287052 | 46 | 5 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 221 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)Cl | 10.1021/jm030936t | |||
| 11346501 | 48264 | 1 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 279 | 14 | 2 | 2 | 4.6 | NCCCCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| CHEMBL155314 | 48264 | 1 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 279 | 14 | 2 | 2 | 4.6 | NCCCCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| 11264275 | 119468 | 2 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 209 | 9 | 2 | 2 | 2.6 | NCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| CHEMBL345185 | 119468 | 2 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 209 | 9 | 2 | 2 | 2.6 | NCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| 1164 | 1630 | 26 | None | - | 12 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1021/jm300671m | |||
| 1626 | 1630 | 26 | None | - | 12 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1021/jm300671m | |||
| 3345 | 1630 | 26 | None | - | 12 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1021/jm300671m | |||
| CHEMBL596 | 1630 | 26 | None | - | 12 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1021/jm300671m | |||
| DB00813 | 1630 | 26 | None | - | 12 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1021/jm300671m | |||
| 44290349 | 178537 | 0 | None | 131 | 2 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 2.1 | O=C(c1ccc(F)cc1)C1CCN(CCn2c(=O)[nH]c3cc(O)ccc3c2=O)CC1 | 10.1021/jm00159a017 | |||
| CHEMBL46683 | 178537 | 0 | None | 131 | 2 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 2.1 | O=C(c1ccc(F)cc1)C1CCN(CCn2c(=O)[nH]c3cc(O)ccc3c2=O)CC1 | 10.1021/jm00159a017 | |||
| 44319120 | 205778 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3cccc(F)c3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL82966 | 205778 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3cccc(F)c3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 10381889 | 107069 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 328 | 2 | 0 | 3 | 4.1 | CN(C)CC1CC2c3ccccc3Cc3ccc(Cl)cc3N2O1 | 10.1016/s0960-894x(02)00796-5 | |||
| CHEMBL315772 | 107069 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 328 | 2 | 0 | 3 | 4.1 | CN(C)CC1CC2c3ccccc3Cc3ccc(Cl)cc3N2O1 | 10.1016/s0960-894x(02)00796-5 | |||
| 10381889 | 107069 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 328 | 2 | 0 | 3 | 4.1 | CN(C)CC1CC2c3ccccc3Cc3ccc(Cl)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL315772 | 107069 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 328 | 2 | 0 | 3 | 4.1 | CN(C)CC1CC2c3ccccc3Cc3ccc(Cl)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 44318454 | 206009 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3ccccc3Cc3ccc(F)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL84931 | 206009 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3ccccc3Cc3ccc(F)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 2286 | 3183 | 51 | None | -2 | 30 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| 4927 | 3183 | 51 | None | -2 | 30 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| 7282 | 3183 | 51 | None | -2 | 30 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| CHEMBL643 | 3183 | 51 | None | -2 | 30 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| DB01069 | 3183 | 51 | None | -2 | 30 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| 155518920 | 170324 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4446961 | 170324 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 155541322 | 173008 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 6 | 1 | 5 | 5.4 | CC(=O)c1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4518271 | 173008 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 502 | 6 | 1 | 5 | 5.4 | CC(=O)c1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 10114407 | 123326 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 444 | 7 | 1 | 5 | 5.4 | COc1ccc(CN2CCC(c3cn(Cc4ccoc4)c4ccccc34)CC2)cc1C(=O)O | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL361625 | 123326 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 444 | 7 | 1 | 5 | 5.4 | COc1ccc(CN2CCC(c3cn(Cc4ccoc4)c4ccccc34)CC2)cc1C(=O)O | 10.1016/j.bmcl.2004.12.008 | |||
| 44332016 | 4244 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 261 | 0 | 1 | 2 | 2.4 | ClN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| CHEMBL100442 | 4244 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 261 | 0 | 1 | 2 | 2.4 | ClN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| 13726483 | 95255 | 2 | None | - | 0 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 265 | 3 | 0 | 4 | 1.4 | CN(C)CC[C@H]1CN(C)C(=S)c2cccnc2O1 | 10.1021/jm00108a012 | |||
| CHEMBL25622 | 95255 | 2 | None | - | 0 | Guinea pig | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 265 | 3 | 0 | 4 | 1.4 | CN(C)CC[C@H]1CN(C)C(=S)c2cccnc2O1 | 10.1021/jm00108a012 | |||
| 44392549 | 65356 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 450 | 10 | 1 | 5 | 5.4 | CCCCn1cc(C2CCN(CCOc3cc(OC)ccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL182922 | 65356 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 450 | 10 | 1 | 5 | 5.4 | CCCCn1cc(C2CCN(CCOc3cc(OC)ccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 739984 | 107204 | 15 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 323 | 6 | 1 | 3 | 2.8 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| CHEMBL316616 | 107204 | 15 | None | - | 0 | Guinea pig | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 323 | 6 | 1 | 3 | 2.8 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1 | 10.1021/jm00173a011 | |||
| 9822631 | 122959 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 406 | 8 | 1 | 4 | 4.8 | CCOCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL360791 | 122959 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 406 | 8 | 1 | 4 | 4.8 | CCOCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 11202401 | 137107 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 478 | 11 | 1 | 6 | 4.8 | CCOCCn1cc(C2CCN(CCOc3ccc(C(C)=O)cc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL374755 | 137107 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 478 | 11 | 1 | 6 | 4.8 | CCOCCn1cc(C2CCN(CCOc3ccc(C(C)=O)cc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| 10369004 | 13688 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 508 | 7 | 0 | 8 | 2.5 | Cn1c(=O)c2c(ncn2CCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)n(C)c1=O | 10.1021/jm00020a018 | |||
| CHEMBL1194812 | 13688 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 508 | 7 | 0 | 8 | 2.5 | Cn1c(=O)c2c(ncn2CCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)n(C)c1=O | 10.1021/jm00020a018 | |||
| CHEMBL553331 | 13688 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 508 | 7 | 0 | 8 | 2.5 | Cn1c(=O)c2c(ncn2CCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)n(C)c1=O | 10.1021/jm00020a018 | |||
| 11166846 | 84301 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 450 | 10 | 1 | 5 | 4.9 | CCOCCn1cc(C2CCN(CCOc3ccc(C)cc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL221462 | 84301 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 450 | 10 | 1 | 5 | 4.9 | CCOCCn1cc(C2CCN(CCOc3ccc(C)cc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 11238716 | 84292 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 592 | 10 | 1 | 5 | 6.2 | CCOCCn1cc(C2CCN(CCOc3c(Br)cc(Br)cc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL221414 | 84292 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 592 | 10 | 1 | 5 | 6.2 | CCOCCn1cc(C2CCN(CCOc3c(Br)cc(Br)cc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 10160717 | 168398 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 444 | 8 | 1 | 5 | 5.2 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccoc3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL434709 | 168398 | 0 | None | - | 0 | Guinea pig | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 444 | 8 | 1 | 5 | 5.2 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccoc3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| 135398737 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm991005d | |||
| 38 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm991005d | |||
| 722 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm991005d | |||
| CHEMBL42 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm991005d | |||
| DB00363 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm991005d | |||
| 45267326 | 195966 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 535 | 7 | 1 | 9 | 2.9 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL559665 | 195966 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 535 | 7 | 1 | 9 | 2.9 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 45268181 | 196645 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 521 | 6 | 1 | 9 | 3.0 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL564370 | 196645 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 521 | 6 | 1 | 9 | 3.0 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 135398737 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9704457 | |||
| 38 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9704457 | |||
| 722 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9704457 | |||
| CHEMBL42 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9704457 | |||
| DB00363 | 958 | 93 | None | -4 | 89 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9704457 | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 126963283 | 160963 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 311 | 1 | 1 | 3 | 4.2 | CO[C@@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| CHEMBL4115677 | 160963 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 311 | 1 | 1 | 3 | 4.2 | CO[C@@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| 11638166 | 8147 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | CC(c1ccncc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091790 | 8147 | 0 | None | - | 1 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | CC(c1ccncc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 11335478 | 160965 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 297 | 0 | 2 | 3 | 3.5 | O[C@@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| CHEMBL4115693 | 160965 | 0 | None | - | 0 | Human | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 297 | 0 | 2 | 3 | 3.5 | O[C@@H]1Cc2ccccc2C(=C2CCNCC2)c2ccsc21 | nan | |||
| 9802248 | 166243 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 420 | 9 | 1 | 4 | 5.4 | CCCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL426786 | 166243 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 420 | 9 | 1 | 4 | 5.4 | CCCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 2274 | 3173 | 58 | None | -3 | 31 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| 4917 | 3173 | 58 | None | -3 | 31 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| 7279 | 3173 | 58 | None | -3 | 31 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| CHEMBL728 | 3173 | 58 | None | -3 | 31 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| DB00433 | 3173 | 58 | None | -3 | 31 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| 14842833 | 93303 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 275 | 5 | 0 | 3 | 3.2 | CN(C)CCC(c1ccccn1)c1ccc(Cl)cn1 | 10.1021/jm00108a012 | |||
| CHEMBL24517 | 93303 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 275 | 5 | 0 | 3 | 3.2 | CN(C)CCC(c1ccccn1)c1ccc(Cl)cn1 | 10.1021/jm00108a012 | |||
| 44392620 | 126823 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 524 | 9 | 1 | 6 | 6.4 | COc1ccc(C(=O)O)c(OCCN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL365450 | 126823 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 524 | 9 | 1 | 6 | 6.4 | COc1ccc(C(=O)O)c(OCCN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| 10003369 | 84336 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 440 | 8 | 1 | 5 | 4.5 | COCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| CHEMBL221678 | 84336 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 440 | 8 | 1 | 5 | 4.5 | COCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 11333854 | 51605 | 1 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 237 | 11 | 2 | 2 | 3.4 | NCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| CHEMBL158352 | 51605 | 1 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 237 | 11 | 2 | 2 | 3.4 | NCCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| 11241807 | 51010 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 234 | 10 | 1 | 2 | 3.7 | NCCCCCCCCCCc1cccnc1 | 10.1021/jm030936t | |||
| CHEMBL157842 | 51010 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 234 | 10 | 1 | 2 | 3.7 | NCCCCCCCCCCc1cccnc1 | 10.1021/jm030936t | |||
| 11253315 | 121965 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 234 | 10 | 1 | 2 | 3.7 | NCCCCCCCCCCc1ccncc1 | 10.1021/jm030936t | |||
| CHEMBL359122 | 121965 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 234 | 10 | 1 | 2 | 3.7 | NCCCCCCCCCCc1ccncc1 | 10.1021/jm030936t | |||
| 54586252 | 61997 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 519 | 7 | 1 | 9 | 2.0 | Cn1c(N2CCN(CCCN3c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774492 | 61997 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 519 | 7 | 1 | 9 | 2.0 | Cn1c(N2CCN(CCCN3c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 127049862 | 140257 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 425 | 8 | 1 | 5 | 4.4 | CNC(=O)c1cccc(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)c1 | 10.1016/j.bmcl.2016.04.087 | |||
| CHEMBL3805559 | 140257 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 425 | 8 | 1 | 5 | 4.4 | CNC(=O)c1cccc(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)c1 | 10.1016/j.bmcl.2016.04.087 | |||
| 44461800 | 205297 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 336 | 2 | 0 | 4 | 3.2 | c1ccc2c(c1)Cc1ccccc1N1OC(CN3CCOCC3)CC21 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL79249 | 205297 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 336 | 2 | 0 | 4 | 3.2 | c1ccc2c(c1)Cc1ccccc1N1OC(CN3CCOCC3)CC21 | 10.1016/s0960-894x(01)00721-1 | |||
| 1427 | 2013 | 54 | None | -5 | 27 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm400856t | |||
| 357 | 2013 | 54 | None | -5 | 27 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm400856t | |||
| 3696 | 2013 | 54 | None | -5 | 27 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm400856t | |||
| CHEMBL11 | 2013 | 54 | None | -5 | 27 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm400856t | |||
| DB00458 | 2013 | 54 | None | -5 | 27 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1021/jm400856t | |||
| 6075 | 150108 | 42 | None | 2 | 16 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 310 | 2 | 0 | 3 | 4.6 | CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 | nan | |||
| CHEMBL395110 | 150108 | 42 | None | 2 | 16 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 310 | 2 | 0 | 3 | 4.6 | CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 | nan | |||
| 155545724 | 173471 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 526 | 6 | 1 | 5 | 5.5 | COc1c(OCC(O)CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)ccc(F)c1F | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4529928 | 173471 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 526 | 6 | 1 | 5 | 5.5 | COc1c(OCC(O)CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)ccc(F)c1F | 10.1016/j.bmcl.2019.126712 | |||
| 44392599 | 65175 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 390 | 7 | 1 | 3 | 5.5 | CCCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL182474 | 65175 | 0 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 390 | 7 | 1 | 3 | 5.5 | CCCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 11785584 | 136964 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 512 | 8 | 1 | 5 | 6.5 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL374459 | 136964 | 0 | None | - | 0 | Guinea pig | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 512 | 8 | 1 | 5 | 6.5 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| 22322323 | 196017 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 440 | 7 | 1 | 7 | 2.7 | Cn1c(NCCCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL560120 | 196017 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 440 | 7 | 1 | 7 | 2.7 | Cn1c(NCCCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 3191 | 102858 | 97 | None | 2 | 25 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | nan | |||
| CHEMBL305660 | 102858 | 97 | None | 2 | 25 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | nan | |||
| 155549722 | 173849 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 494 | 5 | 1 | 4 | 5.8 | OC(COc1ccccc1Cl)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4539056 | 173849 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 494 | 5 | 1 | 4 | 5.8 | OC(COc1ccccc1Cl)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 10894144 | 110559 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 3.5 | N#Cc1ccc(CCOC(=O)N2CCN(CCCc3ccccc3)CC2)cc1 | 10.1021/jm010878g | |||
| CHEMBL325258 | 110559 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 3.5 | N#Cc1ccc(CCOC(=O)N2CCN(CCCc3ccccc3)CC2)cc1 | 10.1021/jm010878g | |||
| 3038952 | 108911 | 2 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 241 | 0 | 1 | 2 | 1.8 | CN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| CHEMBL321104 | 108911 | 2 | None | - | 0 | Guinea pig | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 241 | 0 | 1 | 2 | 1.8 | CN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| 76319448 | 85388 | 2 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 221 | 4 | 4 | 4 | 0.7 | CC(CO)(CO)Nc1nc2ccccc2[nH]1 | 10.1007/s00044-008-9119-y | |||
| CHEMBL2262478 | 85388 | 2 | None | - | 0 | Guinea pig | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 221 | 4 | 4 | 4 | 0.7 | CC(CO)(CO)Nc1nc2ccccc2[nH]1 | 10.1007/s00044-008-9119-y | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| 2812 | 4779 | 101 | None | -28 | 34 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
| CHEMBL104 | 4779 | 101 | None | -28 | 34 | Human | 4.5 | pIC50 | = | 4.5 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
| 2600 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00121a022 | |||
| 2608 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00121a022 | |||
| 5405 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00121a022 | |||
| CHEMBL17157 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00121a022 | |||
| DB00342 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00121a022 | |||
| 10141470 | 123557 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 494 | 8 | 1 | 5 | 6.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL361805 | 123557 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 494 | 8 | 1 | 5 | 6.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccc(Cl)s3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| 153996 | 112668 | 2 | None | - | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1021/jm058225d | |||
| CHEMBL330366 | 112668 | 2 | None | - | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1021/jm058225d | |||
| CHEMBL539021 | 112668 | 2 | None | - | 3 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 639 | 10 | 1 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@](CCN3CCC(C(N)=O)(c4ccccc4)CC3)(c3ccc(Cl)c(Cl)c3)C2)cc(OC)c1OC | 10.1021/jm058225d | |||
| 19426644 | 107174 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 320 | 2 | 0 | 3 | 3.9 | c1ccc2c(c1)Cc1ccccc1N1OC(CN3CCCC3)CC21 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL316438 | 107174 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 320 | 2 | 0 | 3 | 3.9 | c1ccc2c(c1)Cc1ccccc1N1OC(CN3CCCC3)CC21 | 10.1016/s0960-894x(01)00721-1 | |||
| 1201549 | 597 | 24 | None | -1 | 20 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 333 | 597 | 24 | None | -1 | 20 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 7601 | 597 | 24 | None | -1 | 20 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL1201203 | 597 | 24 | None | -1 | 20 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL438151 | 597 | 24 | None | -1 | 20 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| DB00245 | 597 | 24 | None | -1 | 20 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 45269436 | 196656 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 422 | 5 | 0 | 5 | 4.3 | CN(C1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL564446 | 196656 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 422 | 5 | 0 | 5 | 4.3 | CN(C1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 135 | 2532 | 43 | None | -1 | 58 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1016/s0960-894x(01)00721-1 | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1016/s0960-894x(01)00721-1 | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1016/s0960-894x(01)00721-1 | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1016/s0960-894x(01)00721-1 | |||
| 2284 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| 4926 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| 7281 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| CHEMBL564 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| DB00420 | 3182 | 33 | None | 1 | 29 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| 11539632 | 70561 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 447 | 8 | 1 | 5 | 4.8 | Cc1cc(OCCN(C)C)nc2ccc(NC(=O)COc3ccc(Cl)cc3Cl)cc12 | 10.1021/jm050103y | |||
| CHEMBL194837 | 70561 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 447 | 8 | 1 | 5 | 4.8 | Cc1cc(OCCN(C)C)nc2ccc(NC(=O)COc3ccc(Cl)cc3Cl)cc12 | 10.1021/jm050103y | |||
| 155568607 | 176112 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccccc1OC[C@H](O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4591702 | 176112 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccccc1OC[C@H](O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 277 | 1301 | 62 | None | -2 | 50 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| 2913 | 1301 | 62 | None | -2 | 50 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| 765 | 1301 | 62 | None | -2 | 50 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| CHEMBL516 | 1301 | 62 | None | -2 | 50 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| DB00434 | 1301 | 62 | None | -2 | 50 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 44319133 | 106941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3cc(F)ccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL314885 | 106941 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 312 | 2 | 0 | 3 | 3.5 | CN(C)CC1CC2c3cc(F)ccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 10103 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| 133017 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| 2413 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| CHEMBL91397 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| DB11614 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm058225d | |||
| 13726485 | 91424 | 1 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 265 | 3 | 0 | 4 | 1.4 | CN(C)CC[C@@H]1CN(C)C(=S)c2cccnc2O1 | 10.1021/jm00108a012 | |||
| CHEMBL24031 | 91424 | 1 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 265 | 3 | 0 | 4 | 1.4 | CN(C)CC[C@@H]1CN(C)C(=S)c2cccnc2O1 | 10.1021/jm00108a012 | |||
| 11247290 | 136703 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 424 | 8 | 1 | 4 | 4.9 | CCOCCn1cc(C2CCN(Cc3ccc(F)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL374059 | 136703 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 424 | 8 | 1 | 4 | 4.9 | CCOCCn1cc(C2CCN(Cc3ccc(F)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 9918576 | 207337 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1021/jm058225d | |||
| CHEMBL93556 | 207337 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 764 | 14 | 0 | 10 | 7.0 | COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC | 10.1021/jm058225d | |||
| 10420190 | 206760 | 0 | None | - | 3 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 195 | 8 | 2 | 2 | 2.3 | NCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| CHEMBL90063 | 206760 | 0 | None | - | 3 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 195 | 8 | 2 | 2 | 2.3 | NCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| 10660 | 14416 | 58 | None | 2 | 12 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 469 | 6 | 1 | 7 | 3.0 | CN(C)CCOC(c1ccccc1)c1ccccc1.Cn1c(=O)c2[nH]c(Cl)nc2n(C)c1=O | nan | |||
| CHEMBL1200406 | 14416 | 58 | None | 2 | 12 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 469 | 6 | 1 | 7 | 3.0 | CN(C)CCOC(c1ccccc1)c1ccccc1.Cn1c(=O)c2[nH]c(Cl)nc2n(C)c1=O | nan | |||
| 2771 | 195017 | 74 | None | -2 | 27 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | nan | |||
| CHEMBL1200781 | 195017 | 74 | None | -2 | 27 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | nan | |||
| CHEMBL549 | 195017 | 74 | None | -2 | 27 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | nan | |||
| 11259138 | 85012 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.5 | CCOCCn1cc(C2CCN(Cc3ccc(OCC(=O)O)cc3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL223882 | 85012 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.5 | CCOCCn1cc(C2CCN(Cc3ccc(OCC(=O)O)cc3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 45272487 | 196402 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 547 | 7 | 1 | 9 | 3.4 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(/C=C\C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL562792 | 196402 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 547 | 7 | 1 | 9 | 3.4 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(/C=C\C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 54582402 | 62008 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 502 | 5 | 1 | 8 | 2.3 | Cn1c(N2CCN(CC/C=C3/c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774503 | 62008 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 502 | 5 | 1 | 8 | 2.3 | Cn1c(N2CCN(CC/C=C3/c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 11211919 | 84753 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 406 | 8 | 1 | 4 | 4.8 | CCOCCn1cc(C2CCN(Cc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL222984 | 84753 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 406 | 8 | 1 | 4 | 4.8 | CCOCCn1cc(C2CCN(Cc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 10205121 | 66692 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 464 | 6 | 1 | 4 | 6.5 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL185489 | 66692 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 464 | 6 | 1 | 4 | 6.5 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| 11340290 | 64364 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 466 | 11 | 1 | 6 | 4.6 | CCOCCn1cc(C2CCN(CCOc3cc(OC)ccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL181278 | 64364 | 0 | None | - | 0 | Guinea pig | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 466 | 11 | 1 | 6 | 4.6 | CCOCCn1cc(C2CCN(CCOc3cc(OC)ccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 14762564 | 4311 | 2 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 449 | 6 | 1 | 3 | 2.8 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1I | 10.1021/jm00173a011 | |||
| CHEMBL100858 | 4311 | 2 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 449 | 6 | 1 | 3 | 2.8 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1I | 10.1021/jm00173a011 | |||
| 11363750 | 84630 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 484 | 8 | 1 | 4 | 5.5 | CCOCCn1cc(C2CCN(Cc3cc(C(=O)O)ccc3Br)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL222214 | 84630 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 484 | 8 | 1 | 4 | 5.5 | CCOCCn1cc(C2CCN(Cc3cc(C(=O)O)ccc3Br)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 45270753 | 195400 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 3.0 | Cn1c(N2CCN(CCCCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL552057 | 195400 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 3.0 | Cn1c(N2CCN(CCCCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 11659592 | 8143 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@H](c1cccnc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091777 | 8143 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@H](c1cccnc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 10161929 | 137187 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 464 | 9 | 1 | 6 | 4.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CCC3OCCO3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL374869 | 137187 | 0 | None | - | 0 | Guinea pig | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 464 | 9 | 1 | 6 | 4.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CCC3OCCO3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| 149227688 | 174629 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 544 | 6 | 1 | 5 | 6.1 | OC(COc1ccccc1OC(F)(F)F)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4557928 | 174629 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 544 | 6 | 1 | 5 | 6.1 | OC(COc1ccccc1OC(F)(F)F)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 44566054 | 187141 | 2 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 350 | 9 | 0 | 3 | 5.1 | CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc21 | 10.1128/aac.00669-07 | |||
| CHEMBL491889 | 187141 | 2 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 350 | 9 | 0 | 3 | 5.1 | CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc21 | 10.1128/aac.00669-07 | |||
| 213 | 3853 | 55 | None | -8 | 44 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| 2717 | 3853 | 55 | None | -8 | 44 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| 5533 | 3853 | 55 | None | -8 | 44 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| CHEMBL621 | 3853 | 55 | None | -8 | 44 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| DB00656 | 3853 | 55 | None | -8 | 44 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| 44332061 | 4415 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 257 | 1 | 1 | 3 | 1.8 | CON1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| CHEMBL101490 | 4415 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 257 | 1 | 1 | 3 | 1.8 | CON1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| 44392588 | 66653 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 494 | 7 | 1 | 5 | 6.5 | COc1ccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)cc1C(=O)O | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL185289 | 66653 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 494 | 7 | 1 | 5 | 6.5 | COc1ccc(CN2CCC(c3cn(Cc4ccc(Cl)s4)c4ccccc34)CC2)cc1C(=O)O | 10.1016/j.bmcl.2004.12.008 | |||
| 10139592 | 85004 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccco3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL223837 | 85004 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccco3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| 45270750 | 195305 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 507 | 6 | 1 | 9 | 2.6 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL551457 | 195305 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 507 | 6 | 1 | 9 | 2.6 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 44319098 | 205785 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 362 | 2 | 0 | 3 | 4.4 | CN(C)CC1CC2c3cccc(C(F)(F)F)c3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL83073 | 205785 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 362 | 2 | 0 | 3 | 4.4 | CN(C)CC1CC2c3cccc(C(F)(F)F)c3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 44332031 | 208113 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 272 | 1 | 1 | 3 | 1.4 | O=[N+]([O-])N1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| CHEMBL97938 | 208113 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 272 | 1 | 1 | 3 | 1.4 | O=[N+]([O-])N1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| 6726 | 1280 | 51 | None | 3 | 13 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 7151 | 1280 | 51 | None | 3 | 13 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 749 | 1280 | 51 | None | 3 | 13 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL648 | 1280 | 51 | None | 3 | 13 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| DB01176 | 1280 | 51 | None | 3 | 13 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 2762 | 3863 | 31 | None | -9 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1021/jm030936t | |||
| 5587 | 3863 | 31 | None | -9 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1021/jm030936t | |||
| 7318 | 3863 | 31 | None | -9 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1021/jm030936t | |||
| CHEMBL1241 | 3863 | 31 | None | -9 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1021/jm030936t | |||
| DB00792 | 3863 | 31 | None | -9 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 10.1021/jm030936t | |||
| 10140544 | 141639 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 478 | 9 | 1 | 6 | 4.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CCC3COCCO3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL385311 | 141639 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 478 | 9 | 1 | 6 | 4.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CCC3COCCO3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| 23027211 | 197250 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 421 | 5 | 2 | 5 | 4.3 | Cc1cc(N(C)C)nc(N[C@H]2CC[C@@H](NC(=O)c3ccc(Cl)c(Cl)c3)CC2)n1 | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL568400 | 197250 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 421 | 5 | 2 | 5 | 4.3 | Cc1cc(N(C)C)nc(N[C@H]2CC[C@@H](NC(=O)c3ccc(Cl)c(Cl)c3)CC2)n1 | 10.1016/j.bmcl.2009.09.003 | |||
| 11231249 | 50338 | 1 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 277 | 11 | 1 | 2 | 4.2 | c1nc(CCCCCCCCCCN2CCCC2)c[nH]1 | 10.1021/jm030936t | |||
| CHEMBL157217 | 50338 | 1 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 277 | 11 | 1 | 2 | 4.2 | c1nc(CCCCCCCCCCN2CCCC2)c[nH]1 | 10.1021/jm030936t | |||
| 10264715 | 50398 | 1 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 262 | 12 | 1 | 2 | 4.5 | NCCCCCCCCCCCCc1ccncc1 | 10.1021/jm030936t | |||
| CHEMBL157273 | 50398 | 1 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 262 | 12 | 1 | 2 | 4.5 | NCCCCCCCCCCCCc1ccncc1 | 10.1021/jm030936t | |||
| 11358657 | 44834 | 1 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 305 | 13 | 1 | 2 | 4.9 | c1nc(CCCCCCCCCCCCN2CCCC2)c[nH]1 | 10.1021/jm030936t | |||
| CHEMBL152221 | 44834 | 1 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 305 | 13 | 1 | 2 | 4.9 | c1nc(CCCCCCCCCCCCN2CCCC2)c[nH]1 | 10.1021/jm030936t | |||
| 45270350 | 195074 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 434 | 6 | 0 | 4 | 5.7 | CN(CC1CCCCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL549598 | 195074 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 434 | 6 | 0 | 4 | 5.7 | CN(CC1CCCCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 155532375 | 171780 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccccc1OC[C@@H](O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4467816 | 171780 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1ccccc1OC[C@@H](O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 155557098 | 174569 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 478 | 5 | 1 | 4 | 5.3 | OC(COc1ccccc1F)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4556553 | 174569 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 478 | 5 | 1 | 4 | 5.3 | OC(COc1ccccc1F)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 180 | 401 | 56 | None | -1 | 40 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| 200 | 401 | 56 | None | -1 | 40 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| 2160 | 401 | 56 | None | -1 | 40 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| CHEMBL629 | 401 | 56 | None | -1 | 40 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| DB00321 | 401 | 56 | None | -1 | 40 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 11753159 | 547 | 6 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1021/jm300682j | |||
| 7679 | 547 | 6 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1021/jm300682j | |||
| CHEMBL2158814 | 547 | 6 | None | -1 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1021/jm300682j | |||
| 1212 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| 204 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| 3372 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| CHEMBL726 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| DB00623 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| 2337 | 3256 | 77 | None | -1 | 62 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 50 | 3256 | 77 | None | -1 | 62 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 5002 | 3256 | 77 | None | -1 | 62 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| CHEMBL716 | 3256 | 77 | None | -1 | 62 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| DB01224 | 3256 | 77 | None | -1 | 62 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 44189144 | 195965 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 2.5 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL559664 | 195965 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 2.5 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 44189144 | 195965 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 2.5 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL559664 | 195965 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 521 | 7 | 1 | 9 | 2.5 | Cn1c(N2CCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 155526952 | 171176 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 538 | 5 | 1 | 4 | 5.9 | OC(COc1ccccc1Br)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4458953 | 171176 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 538 | 5 | 1 | 4 | 5.9 | OC(COc1ccccc1Br)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 9822631 | 122959 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 406 | 8 | 1 | 4 | 4.8 | CCOCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL360791 | 122959 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 406 | 8 | 1 | 4 | 4.8 | CCOCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 16722760 | 61996 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 519 | 6 | 1 | 9 | 2.4 | Cn1c(N2CCCN(CCCN3c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774491 | 61996 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 519 | 6 | 1 | 9 | 2.4 | Cn1c(N2CCCN(CCCN3c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 45269933 | 195295 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 518 | 7 | 1 | 8 | 3.5 | Cn1c(C2=CCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL551394 | 195295 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 518 | 7 | 1 | 8 | 3.5 | Cn1c(C2=CCN(CCCN3c4ccccc4Sc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 45268186 | 196530 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 563 | 8 | 1 | 9 | 3.9 | CCC(C(=O)O)c1ccc2c(c1)N(CCCN1CCCN(c3cc(=O)n(C)c(=O)n3C)CC1)c1ccccc1S2 | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL563647 | 196530 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 563 | 8 | 1 | 9 | 3.9 | CCC(C(=O)O)c1ccc2c(c1)N(CCCN1CCCN(c3cc(=O)n(C)c(=O)n3C)CC1)c1ccccc1S2 | 10.1016/j.bmcl.2009.03.124 | |||
| 133 | 2496 | 52 | None | -102 | 42 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| 1723 | 2496 | 52 | None | -102 | 42 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| 28693 | 2496 | 52 | None | -102 | 42 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| CHEMBL19215 | 2496 | 52 | None | -102 | 42 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| DB13520 | 2496 | 52 | None | -102 | 42 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| 155544367 | 173374 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 508 | 3 | 0 | 4 | 6.0 | CC[C@]12CCCN(C(=O)c3cccc(Br)c3)CCc3c(n(c4ccccc34)C(=O)C1)[C@@H]2OC | 10.1021/acs.jmedchem.9b01924 | |||
| CHEMBL4527708 | 173374 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 508 | 3 | 0 | 4 | 6.0 | CC[C@]12CCCN(C(=O)c3cccc(Br)c3)CCc3c(n(c4ccccc34)C(=O)C1)[C@@H]2OC | 10.1021/acs.jmedchem.9b01924 | |||
| 11385692 | 137049 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccoc3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL374675 | 137049 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 462 | 8 | 1 | 5 | 5.4 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccoc3)c3cc(F)ccc23)CC1 | 10.1021/jm0498203 | |||
| 14407121 | 60085 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 473 | 10 | 1 | 5 | 5.3 | COc1cc(C(C)=O)ccc1OCCCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 | 10.1021/jm00121a022 | |||
| CHEMBL17390 | 60085 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 473 | 10 | 1 | 5 | 5.3 | COc1cc(C(C)=O)ccc1OCCCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 | 10.1021/jm00121a022 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2016.04.087 | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2016.04.087 | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2016.04.087 | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2016.04.087 | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2016.04.087 | |||
| 14762566 | 107735 | 7 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 3.0 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1Br | 10.1021/jm00173a011 | |||
| CHEMBL319123 | 107735 | 7 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 3.0 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1Br | 10.1021/jm00173a011 | |||
| 14842830 | 98986 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 308 | 5 | 0 | 2 | 4.5 | CN(C)CCC(c1ccc(Cl)cc1)c1ccc(Cl)cn1 | 10.1021/jm00108a012 | |||
| CHEMBL279907 | 98986 | 0 | None | - | 0 | Guinea pig | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 308 | 5 | 0 | 2 | 4.5 | CN(C)CCC(c1ccc(Cl)cc1)c1ccc(Cl)cn1 | 10.1021/jm00108a012 | |||
| 15181802 | 12165 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 471 | 7 | 0 | 7 | 3.4 | Cn1c(=O)c2c(ncn2CCCN2CCC(C(c3ccccc3)c3ccccc3)CC2)n(C)c1=O | 10.1021/jm00020a018 | |||
| CHEMBL1184199 | 12165 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 471 | 7 | 0 | 7 | 3.4 | Cn1c(=O)c2c(ncn2CCCN2CCC(C(c3ccccc3)c3ccccc3)CC2)n(C)c1=O | 10.1021/jm00020a018 | |||
| CHEMBL338611 | 12165 | 0 | None | - | 0 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 471 | 7 | 0 | 7 | 3.4 | Cn1c(=O)c2c(ncn2CCCN2CCC(C(c3ccccc3)c3ccccc3)CC2)n(C)c1=O | 10.1021/jm00020a018 | |||
| 3191 | 102858 | 97 | None | - | 25 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1021/jm00020a018 | |||
| CHEMBL305660 | 102858 | 97 | None | - | 25 | Guinea pig | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1021/jm00020a018 | |||
| 3168 | 9262 | 92 | None | -87 | 21 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 3.7 | O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1 | nan | |||
| CHEMBL1108 | 9262 | 92 | None | -87 | 21 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 3.7 | O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1 | nan | |||
| 11005810 | 10466 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 517 | 10 | 1 | 4 | 6.2 | N#Cc1ccc(CCOC(=O)NC2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
| CHEMBL116463 | 10466 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 517 | 10 | 1 | 4 | 6.2 | N#Cc1ccc(CCOC(=O)NC2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
| 45269062 | 196512 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 535 | 8 | 2 | 9 | 3.6 | Cn1c(NCCCN2CCC(CN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL563520 | 196512 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 535 | 8 | 2 | 9 | 3.6 | Cn1c(NCCCN2CCC(CN3c4ccccc4Sc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 9954899 | 204463 | 17 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3ccccc3Nc3ccc(OS(=O)(=O)C(F)(F)F)cc32)CC1 | 10.1021/jm991005d | |||
| CHEMBL72292 | 204463 | 17 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3ccccc3Nc3ccc(OS(=O)(=O)C(F)(F)F)cc32)CC1 | 10.1021/jm991005d | |||
| 11189839 | 84334 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 438 | 9 | 1 | 4 | 5.5 | CCCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| CHEMBL221664 | 84334 | 0 | None | - | 0 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 438 | 9 | 1 | 4 | 5.5 | CCCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| 9954899 | 204463 | 17 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3ccccc3Nc3ccc(OS(=O)(=O)C(F)(F)F)cc32)CC1 | 10.1021/jm9704457 | |||
| CHEMBL72292 | 204463 | 17 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3ccccc3Nc3ccc(OS(=O)(=O)C(F)(F)F)cc32)CC1 | 10.1021/jm9704457 | |||
| 44319134 | 205993 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 362 | 2 | 0 | 3 | 4.4 | CN(C)CC1CC2c3c(cccc3C(F)(F)F)Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL84810 | 205993 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 362 | 2 | 0 | 3 | 4.4 | CN(C)CC1CC2c3c(cccc3C(F)(F)F)Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 9979651 | 84762 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 422 | 8 | 1 | 5 | 4.4 | COCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL223025 | 84762 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 422 | 8 | 1 | 5 | 4.4 | COCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 10409896 | 65577 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 420 | 8 | 1 | 4 | 5.5 | CCCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL183169 | 65577 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 420 | 8 | 1 | 4 | 5.5 | CCCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 14762590 | 4489 | 1 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 7 | 1 | 2 | 4.5 | CCc1ccccc1NC(=O)CCN1CCC(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| CHEMBL101973 | 4489 | 1 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 350 | 7 | 1 | 2 | 4.5 | CCc1ccccc1NC(=O)CCN1CCC(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| 11811722 | 10065 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 413 | 5 | 1 | 4 | 4.4 | O=C1NCN(c2ccccc2)C12CCN(Cc1cccc(Oc3ccccc3)c1)CC2 | 10.1021/jm010878g | |||
| CHEMBL115280 | 10065 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 413 | 5 | 1 | 4 | 4.4 | O=C1NCN(c2ccccc2)C12CCN(Cc1cccc(Oc3ccccc3)c1)CC2 | 10.1021/jm010878g | |||
| 2286 | 3183 | 51 | None | -2 | 30 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1021/jm400856t | |||
| 4927 | 3183 | 51 | None | -2 | 30 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1021/jm400856t | |||
| 7282 | 3183 | 51 | None | -2 | 30 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1021/jm400856t | |||
| CHEMBL643 | 3183 | 51 | None | -2 | 30 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1021/jm400856t | |||
| DB01069 | 3183 | 51 | None | -2 | 30 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1021/jm400856t | |||
| 1227 | 2489 | 43 | None | -5 | 12 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | |||
| 2331 | 2489 | 43 | None | -5 | 12 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | |||
| 3957 | 2489 | 43 | None | -5 | 12 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | |||
| 4992 | 2489 | 43 | None | -5 | 12 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | |||
| CHEMBL511 | 2489 | 43 | None | -5 | 12 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | |||
| DB06691 | 2489 | 43 | None | -5 | 12 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm300671m | |||
| 44318842 | 206108 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1ccc2c(c1)N1OC(CN(C)C)CC1c1ccccc1C2 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL85735 | 206108 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1ccc2c(c1)N1OC(CN(C)C)CC1c1ccccc1C2 | 10.1016/s0960-894x(01)00721-1 | |||
| 1971 | 2866 | 38 | None | -1 | 30 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| 2404 | 2866 | 38 | None | -1 | 30 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| 4543 | 2866 | 38 | None | -1 | 30 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| CHEMBL445 | 2866 | 38 | None | -1 | 30 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| DB00540 | 2866 | 38 | None | -1 | 30 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| 11247939 | 137105 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 450 | 10 | 1 | 5 | 4.9 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cccc(C)c21 | 10.1021/jm0498203 | |||
| CHEMBL374754 | 137105 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 450 | 10 | 1 | 5 | 4.9 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cccc(C)c21 | 10.1021/jm0498203 | |||
| 11328514 | 137858 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 454 | 10 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(CCOc3cccc(F)c3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL376025 | 137858 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 454 | 10 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(CCOc3cccc(F)c3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 11373970 | 141973 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 436 | 9 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2cc(OC)ccc21 | 10.1021/jm0498203 | |||
| CHEMBL387325 | 141973 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 436 | 9 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(Cc3cccc(C(=O)O)c3)CC2)c2cc(OC)ccc21 | 10.1021/jm0498203 | |||
| 10263017 | 207462 | 2 | None | - | 3 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 223 | 10 | 2 | 2 | 3.0 | NCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| CHEMBL94249 | 207462 | 2 | None | - | 3 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 223 | 10 | 2 | 2 | 3.0 | NCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm030936t | |||
| 44369359 | 46881 | 1 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 255 | 3 | 2 | 2 | 2.9 | NCCc1c[nH]c(-c2ccc(Cl)c(Cl)c2)n1 | 10.1021/jm030936t | |||
| CHEMBL154068 | 46881 | 1 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 255 | 3 | 2 | 2 | 2.9 | NCCc1c[nH]c(-c2ccc(Cl)c(Cl)c2)n1 | 10.1021/jm030936t | |||
| 657255 | 199084 | 34 | None | -18 | 15 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 337 | 12 | 2 | 3 | 5.6 | CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1 | nan | |||
| CHEMBL588119 | 199084 | 34 | None | -18 | 15 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 337 | 12 | 2 | 3 | 5.6 | CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1 | nan | |||
| 148123909 | 170233 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 505 | 6 | 1 | 6 | 5.1 | O=[N+]([O-])c1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4445636 | 170233 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 505 | 6 | 1 | 6 | 5.1 | O=[N+]([O-])c1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 14762600 | 164451 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.3 | CCc1ccccc1NC(=O)CCN1CCN2Cc3ccccc3CC2C1 | 10.1021/jm00173a011 | |||
| CHEMBL421393 | 164451 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.3 | CCc1ccccc1NC(=O)CCN1CCN2Cc3ccccc3CC2C1 | 10.1021/jm00173a011 | |||
| 45269063 | 196186 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 549 | 8 | 1 | 9 | 3.6 | CN(CCCN1CCC(CN2c3ccccc3Sc3ccc(C(=O)O)cc32)CC1)c1cc(=O)n(C)c(=O)n1C | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL561377 | 196186 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 549 | 8 | 1 | 9 | 3.6 | CN(CCCN1CCC(CN2c3ccccc3Sc3ccc(C(=O)O)cc32)CC1)c1cc(=O)n(C)c(=O)n1C | 10.1016/j.bmcl.2009.03.124 | |||
| 52953079 | 62001 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 6 | 1 | 9 | 2.4 | Cn1c(N2CCCN(CCCN3c4cc(C(=O)O)ccc4COc4ccccc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774496 | 62001 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 519 | 6 | 1 | 9 | 2.4 | Cn1c(N2CCCN(CCCN3c4cc(C(=O)O)ccc4COc4ccccc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 286016 | 4416 | 8 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 227 | 0 | 2 | 2 | 1.5 | c1ccc2c3c([nH]c2c1)CN1CCNCC1C3 | 10.1021/jm00173a011 | |||
| CHEMBL101491 | 4416 | 8 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 227 | 0 | 2 | 2 | 1.5 | c1ccc2c3c([nH]c2c1)CN1CCNCC1C3 | 10.1021/jm00173a011 | |||
| 54586254 | 62003 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 531 | 7 | 1 | 8 | 2.6 | Cn1c(N2CCCN(CCCN3c4ccccc4CCc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774498 | 62003 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 531 | 7 | 1 | 8 | 2.6 | Cn1c(N2CCCN(CCCN3c4ccccc4CCc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 54584335 | 62006 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 516 | 6 | 1 | 8 | 2.2 | Cn1c(N2CCN(CC/C=C3\c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774501 | 62006 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 516 | 6 | 1 | 8 | 2.2 | Cn1c(N2CCN(CC/C=C3\c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 17964355 | 126453 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 414 | 6 | 1 | 4 | 5.4 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccoc4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL365197 | 126453 | 0 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 414 | 6 | 1 | 4 | 5.4 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccoc4)c4ccccc34)CC2)c1 | 10.1016/j.bmcl.2004.12.008 | |||
| 14762591 | 4216 | 2 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 356 | 6 | 1 | 2 | 4.6 | O=C(CCN1CCC(Cc2ccccc2)CC1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| CHEMBL100276 | 4216 | 2 | None | - | 0 | Guinea pig | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 356 | 6 | 1 | 2 | 4.6 | O=C(CCN1CCC(Cc2ccccc2)CC1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| 10298838 | 168794 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 469 | 9 | 1 | 5 | 5.2 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CCc3ccccn3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL437519 | 168794 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 469 | 9 | 1 | 5 | 5.2 | O=C(O)c1ccccc1OCCN1CCC(c2cn(CCc3ccccn3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| 22322323 | 196017 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 440 | 7 | 1 | 7 | 2.7 | Cn1c(NCCCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL560120 | 196017 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 440 | 7 | 1 | 7 | 2.7 | Cn1c(NCCCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 10917690 | 207605 | 1 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1021/jm058225d | |||
| CHEMBL95051 | 207605 | 1 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 471 | 8 | 0 | 5 | 5.4 | COc1ccc(CCN2CCC(C(=O)c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 | 10.1021/jm058225d | |||
| 44318461 | 205735 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1cccc2c1Cc1ccccc1C1CC(CN(C)C)ON21 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL82635 | 205735 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.7 | Cc1cccc2c1Cc1ccccc1C1CC(CN(C)C)ON21 | 10.1016/s0960-894x(01)00721-1 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 147863431 | 175939 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 460 | 5 | 1 | 4 | 5.2 | OC(COc1ccccc1)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4587694 | 175939 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 460 | 5 | 1 | 4 | 5.2 | OC(COc1ccccc1)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 9904205 | 205850 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(02)00796-5 | |||
| CHEMBL83658 | 205850 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(02)00796-5 | |||
| 9904205 | 205850 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL83658 | 205850 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 9904205 | 205850 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL83658 | 205850 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)CC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 16005860 | 187406 | 7 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 388 | 5 | 1 | 2 | 4.8 | CC(C)(C)CCN1CC[C@H](CNC(=O)c2cc(Cl)cc(Cl)c2)[C@H](F)C1 | 10.1021/jm800830n | |||
| CHEMBL493677 | 187406 | 7 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 388 | 5 | 1 | 2 | 4.8 | CC(C)(C)CCN1CC[C@H](CNC(=O)c2cc(Cl)cc(Cl)c2)[C@H](F)C1 | 10.1021/jm800830n | |||
| 44461456 | 205749 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.8 | CN(C)CC1(C)CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL82714 | 205749 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.8 | CN(C)CC1(C)CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 11508317 | 8140 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 336 | 5 | 0 | 3 | 5.1 | C[C@@H](c1ccccn1)c1c(CCN2CCCC2)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091774 | 8140 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 336 | 5 | 0 | 3 | 5.1 | C[C@@H](c1ccccn1)c1c(CCN2CCCC2)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 40466858 | 16155 | 67 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | 10.1007/s00044-008-9119-y | |||
| 5284514 | 16155 | 67 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | 10.1007/s00044-008-9119-y | |||
| CHEMBL1224 | 16155 | 67 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 348 | 6 | 1 | 3 | 4.0 | Cc1ccc(/C(=C\CN2CCCC2)c2cccc(/C=C/C(=O)O)n2)cc1 | 10.1007/s00044-008-9119-y | |||
| 136224310 | 85389 | 0 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 227 | 3 | 4 | 5 | -1.4 | CC(C)(CO)NC=C1C(=O)NC(=O)NC1=O | 10.1007/s00044-008-9119-y | |||
| CHEMBL2262481 | 85389 | 0 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 227 | 3 | 4 | 5 | -1.4 | CC(C)(CO)NC=C1C(=O)NC(=O)NC1=O | 10.1007/s00044-008-9119-y | |||
| 54586256 | 62009 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 516 | 5 | 1 | 8 | 2.7 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774504 | 62009 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 516 | 5 | 1 | 8 | 2.7 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4COc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 44271504 | 59717 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 495 | 9 | 1 | 5 | 5.2 | COC(=O)c1ccc(OCCCN2CCC(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm00121a022 | |||
| CHEMBL17237 | 59717 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 495 | 9 | 1 | 5 | 5.2 | COC(=O)c1ccc(OCCCN2CCC(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm00121a022 | |||
| 11230427 | 44721 | 1 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 249 | 9 | 1 | 2 | 3.4 | c1nc(CCCCCCCCN2CCCC2)c[nH]1 | 10.1021/jm030936t | |||
| CHEMBL152126 | 44721 | 1 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 249 | 9 | 1 | 2 | 3.4 | c1nc(CCCCCCCCN2CCCC2)c[nH]1 | 10.1021/jm030936t | |||
| 14762595 | 4444 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 402 | 5 | 2 | 3 | 3.8 | CCc1ccccc1NC(=O)CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| CHEMBL101625 | 4444 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 402 | 5 | 2 | 3 | 3.8 | CCc1ccccc1NC(=O)CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1128/aac.00669-07 | |||
| 14762575 | 4184 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 400 | 6 | 1 | 2 | 4.1 | O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccccc1Br | 10.1021/jm00173a011 | |||
| CHEMBL100125 | 4184 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 400 | 6 | 1 | 2 | 4.1 | O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccccc1Br | 10.1021/jm00173a011 | |||
| 44461565 | 104350 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 322 | 4 | 0 | 3 | 4.2 | CN(C)CCCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL310018 | 104350 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 322 | 4 | 0 | 3 | 4.2 | CN(C)CCCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 4919 | 206234 | 23 | None | - | 8 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1021/jm300671m | |||
| CHEMBL86715 | 206234 | 23 | None | - | 8 | Rat | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1021/jm300671m | |||
| 14762601 | 108361 | 1 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 369 | 4 | 1 | 3 | 3.4 | O=C(CCN1CCN2Cc3ccccc3CC2C1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| CHEMBL319817 | 108361 | 1 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 369 | 4 | 1 | 3 | 3.4 | O=C(CCN1CCN2Cc3ccccc3CC2C1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| 45267329 | 196008 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 549 | 8 | 1 | 9 | 3.3 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(CCC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL560061 | 196008 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 549 | 8 | 1 | 9 | 3.3 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(CCC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 10478188 | 122942 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 436 | 9 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL360712 | 122942 | 0 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 436 | 9 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(Cc3ccc(OC)c(C(=O)O)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 14762573 | 4482 | 2 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 323 | 6 | 1 | 3 | 2.2 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1 | 10.1021/jm00173a011 | |||
| CHEMBL101927 | 4482 | 2 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 323 | 6 | 1 | 3 | 2.2 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1 | 10.1021/jm00173a011 | |||
| 14762568 | 109222 | 2 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 357 | 6 | 1 | 3 | 2.9 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1Cl | 10.1021/jm00173a011 | |||
| CHEMBL321738 | 109222 | 2 | None | - | 0 | Guinea pig | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 357 | 6 | 1 | 3 | 2.9 | O=C(NCCN1CCN(Cc2ccccc2)CC1)c1ccccc1Cl | 10.1021/jm00173a011 | |||
| 44318695 | 107005 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 370 | 3 | 0 | 3 | 5.1 | CN(C)CC1CC2c3ccccc3Cc3ccc(-c4ccccc4)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL315308 | 107005 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 370 | 3 | 0 | 3 | 5.1 | CN(C)CC1CC2c3ccccc3Cc3ccc(-c4ccccc4)cc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 16722761 | 62002 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 517 | 6 | 1 | 8 | 2.6 | Cn1c(N2CCCN(CCCN3c4ccccc4CCc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774497 | 62002 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 517 | 6 | 1 | 8 | 2.6 | Cn1c(N2CCCN(CCCN3c4ccccc4CCc4ccc(C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 44392642 | 65252 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 478 | 8 | 1 | 5 | 5.9 | O=C(O)c1ccc(Cl)cc1OCCN1CCC(c2cn(Cc3ccoc3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL182758 | 65252 | 0 | None | - | 0 | Guinea pig | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 478 | 8 | 1 | 5 | 5.9 | O=C(O)c1ccc(Cl)cc1OCCN1CCC(c2cn(Cc3ccoc3)c3ccccc23)CC1 | 10.1016/j.bmcl.2004.12.008 | |||
| 2253940 | 67254 | 11 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 237 | 2 | 3 | 4 | 0.2 | O=C1NC(=O)C(=CNC2CCCCC2)C(=O)N1 | 10.1007/s00044-008-9119-y | |||
| CHEMBL1880624 | 67254 | 11 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 237 | 2 | 3 | 4 | 0.2 | O=C1NC(=O)C(=CNC2CCCCC2)C(=O)N1 | 10.1007/s00044-008-9119-y | |||
| 14762572 | 111578 | 1 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 337 | 6 | 1 | 3 | 2.5 | Cc1ccccc1C(=O)NCCN1CCN(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| CHEMBL328170 | 111578 | 1 | None | - | 0 | Guinea pig | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 337 | 6 | 1 | 3 | 2.5 | Cc1ccccc1C(=O)NCCN1CCN(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| 100 | 3805 | 58 | None | -7 | 55 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| 2637 | 3805 | 58 | None | -7 | 55 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| 5452 | 3805 | 58 | None | -7 | 55 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| CHEMBL479 | 3805 | 58 | None | -7 | 55 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| DB00679 | 3805 | 58 | None | -7 | 55 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| 45270755 | 196736 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 549 | 7 | 1 | 9 | 3.5 | CC(C(=O)O)c1ccc2c(c1)N(CCCN1CCCN(c3cc(=O)n(C)c(=O)n3C)CC1)c1ccccc1S2 | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL565083 | 196736 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 549 | 7 | 1 | 9 | 3.5 | CC(C(=O)O)c1ccc2c(c1)N(CCCN1CCCN(c3cc(=O)n(C)c(=O)n3C)CC1)c1ccccc1S2 | 10.1016/j.bmcl.2009.03.124 | |||
| 135515198 | 104750 | 8 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3cc(OS(=O)(=O)C(F)(F)F)ccc3Nc3ccccc32)CC1 | 10.1021/jm991005d | |||
| CHEMBL310712 | 104750 | 8 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3cc(OS(=O)(=O)C(F)(F)F)ccc3Nc3ccccc32)CC1 | 10.1021/jm991005d | |||
| 135515198 | 104750 | 8 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3cc(OS(=O)(=O)C(F)(F)F)ccc3Nc3ccccc32)CC1 | 10.1021/jm9704457 | |||
| CHEMBL310712 | 104750 | 8 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 440 | 2 | 1 | 7 | 3.3 | CN1CCN(C2=Nc3cc(OS(=O)(=O)C(F)(F)F)ccc3Nc3ccccc32)CC1 | 10.1021/jm9704457 | |||
| 1547484 | 940 | 74 | None | -1 | 20 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 654 | 940 | 74 | None | -1 | 20 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 9072 | 940 | 74 | None | -1 | 20 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL43064 | 940 | 74 | None | -1 | 20 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| DB00568 | 940 | 74 | None | -1 | 20 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 54586255 | 62004 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 559 | 7 | 1 | 8 | 3.3 | Cn1c(N2CCCN(CCCN3c4ccccc4CCc4ccc(C(C)(C)C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774499 | 62004 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 559 | 7 | 1 | 8 | 3.3 | Cn1c(N2CCCN(CCCN3c4ccccc4CCc4ccc(C(C)(C)C(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 11293983 | 84291 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 454 | 10 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| CHEMBL221413 | 84291 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 454 | 10 | 1 | 5 | 4.8 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccc(F)cc21 | 10.1021/jm0498203 | |||
| 23027411 | 198520 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 387 | 5 | 2 | 5 | 3.7 | Cc1cnc(N[C@H]2CC[C@@H](NC(=O)c3ccc(Cl)cc3)CC2)nc1N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL577912 | 198520 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 387 | 5 | 2 | 5 | 3.7 | Cc1cnc(N[C@H]2CC[C@@H](NC(=O)c3ccc(Cl)cc3)CC2)nc1N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| 14762584 | 4357 | 1 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 351 | 7 | 1 | 3 | 3.4 | CCc1ccccc1NC(=O)CCN1CCN(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| CHEMBL101088 | 4357 | 1 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 351 | 7 | 1 | 3 | 3.4 | CCc1ccccc1NC(=O)CCN1CCN(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmc.2011.03.003 | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmc.2011.03.003 | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmc.2011.03.003 | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmc.2011.03.003 | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmc.2011.03.003 | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.03.124 | |||
| 10447834 | 1933 | 4 | None | -1862 | 5 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm030936t | |||
| 4026 | 1933 | 4 | None | -1862 | 5 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm030936t | |||
| CHEMBL275507 | 1933 | 4 | None | -1862 | 5 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 10.1021/jm030936t | |||
| 11816882 | 47504 | 1 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 220 | 9 | 1 | 2 | 3.3 | NCCCCCCCCCc1ccccn1 | 10.1021/jm030936t | |||
| CHEMBL154566 | 47504 | 1 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 220 | 9 | 1 | 2 | 3.3 | NCCCCCCCCCc1ccccn1 | 10.1021/jm030936t | |||
| 10885636 | 111016 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 503 | 9 | 0 | 4 | 5.7 | N#Cc1ccc(CCOC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
| CHEMBL326263 | 111016 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 503 | 9 | 0 | 4 | 5.7 | N#Cc1ccc(CCOC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm010878g | |||
| 14762576 | 4465 | 1 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 356 | 6 | 1 | 2 | 4.0 | O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccccc1Cl | 10.1021/jm00173a011 | |||
| CHEMBL101758 | 4465 | 1 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 356 | 6 | 1 | 2 | 4.0 | O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccccc1Cl | 10.1021/jm00173a011 | |||
| 173727 | 60299 | 15 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 509 | 10 | 1 | 5 | 5.6 | COc1cc(C(C)=O)ccc1OCCCN1CCC(C(O)(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm00121a022 | |||
| CHEMBL17436 | 60299 | 15 | None | - | 0 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 509 | 10 | 1 | 5 | 5.6 | COc1cc(C(C)=O)ccc1OCCCN1CCC(C(O)(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1021/jm00121a022 | |||
| 155522480 | 170649 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1cccc(OCC(O)CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)c1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4451332 | 170649 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 490 | 6 | 1 | 5 | 5.2 | COc1cccc(OCC(O)CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)c1 | 10.1016/j.bmcl.2019.126712 | |||
| 4011 | 82408 | 49 | None | 6 | 24 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | nan | |||
| CHEMBL21731 | 82408 | 49 | None | 6 | 24 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | nan | |||
| 1210 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 1213 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 2725 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 33036 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 4411 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 616 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 6976 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 716121 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| CHEMBL1201353 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| CHEMBL1554789 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| CHEMBL505 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| DB01114 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| DB13679 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00108a012 | |||
| 155549599 | 173853 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 474 | 5 | 1 | 4 | 5.5 | Cc1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4539150 | 173853 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 474 | 5 | 1 | 4 | 5.5 | Cc1ccccc1OCC(O)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 2389 | 3331 | 118 | None | -346 | 67 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1073/pnas.0611417104 | |||
| 5073 | 3331 | 118 | None | -346 | 67 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1073/pnas.0611417104 | |||
| 96 | 3331 | 118 | None | -346 | 67 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1073/pnas.0611417104 | |||
| CHEMBL85 | 3331 | 118 | None | -346 | 67 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1073/pnas.0611417104 | |||
| DB00734 | 3331 | 118 | None | -346 | 67 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1073/pnas.0611417104 | |||
| 11329753 | 84563 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 514 | 10 | 1 | 5 | 5.4 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cccc(Br)c21 | 10.1021/jm0498203 | |||
| CHEMBL222083 | 84563 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 514 | 10 | 1 | 5 | 5.4 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2cccc(Br)c21 | 10.1021/jm0498203 | |||
| 45267775 | 196232 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 414 | 5 | 0 | 4 | 5.3 | CN(c1ccccc1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL561690 | 196232 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 414 | 5 | 0 | 4 | 5.3 | CN(c1ccccc1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 23027245 | 197128 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 387 | 5 | 2 | 5 | 3.7 | Cc1cc(N(C)C)nc(N[C@H]2CC[C@@H](NC(=O)c3ccc(Cl)cc3)CC2)n1 | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL567791 | 197128 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 387 | 5 | 2 | 5 | 3.7 | Cc1cc(N(C)C)nc(N[C@H]2CC[C@@H](NC(=O)c3ccc(Cl)cc3)CC2)n1 | 10.1016/j.bmcl.2009.09.003 | |||
| 10915140 | 29474 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 351 | 5 | 0 | 3 | 4.2 | COC1Cc2ccccc2C2(CCN(CCCc3ccccc3)CC2)O1 | 10.1021/jm010992z | |||
| CHEMBL138458 | 29474 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 351 | 5 | 0 | 3 | 4.2 | COC1Cc2ccccc2C2(CCN(CCCc3ccccc3)CC2)O1 | 10.1021/jm010992z | |||
| 76323071 | 85391 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 292 | 7 | 3 | 5 | 0.0 | CC(CO)(CO)NCCCN1C(=O)c2ccccc2C1=O | 10.1007/s00044-008-9119-y | |||
| CHEMBL2262485 | 85391 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 292 | 7 | 3 | 5 | 0.0 | CC(CO)(CO)NCCCN1C(=O)c2ccccc2C1=O | 10.1007/s00044-008-9119-y | |||
| 155545274 | 174953 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 528 | 5 | 1 | 4 | 6.2 | OC(COc1ccccc1C(F)(F)F)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4565774 | 174953 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 528 | 5 | 1 | 4 | 6.2 | OC(COc1ccccc1C(F)(F)F)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 23027527 | 196792 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 371 | 5 | 2 | 5 | 3.1 | Cc1cnc(N[C@H]2CC[C@@H](NC(=O)c3ccc(F)cc3)CC2)nc1N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL565551 | 196792 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 371 | 5 | 2 | 5 | 3.1 | Cc1cnc(N[C@H]2CC[C@@H](NC(=O)c3ccc(F)cc3)CC2)nc1N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| 46182745 | 57327 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 461 | 6 | 1 | 3 | 6.2 | O=C(O)c1cc(-c2cccc(COc3ccc4c(c3)CN(C3CCCC3)C4=O)c2)ccc1Cl | 10.1021/jm3005306 | |||
| CHEMBL1651208 | 57327 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 461 | 6 | 1 | 3 | 6.2 | O=C(O)c1cc(-c2cccc(COc3ccc4c(c3)CN(C3CCCC3)C4=O)c2)ccc1Cl | 10.1021/jm3005306 | |||
| 11487026 | 85015 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 422 | 9 | 1 | 5 | 4.2 | COCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL223889 | 85015 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 422 | 9 | 1 | 5 | 4.2 | COCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 44461606 | 105995 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 308 | 3 | 0 | 3 | 3.8 | CN(C)CCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| CHEMBL313189 | 105995 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 308 | 3 | 0 | 3 | 3.8 | CN(C)CCC1CC2c3ccccc3Cc3ccccc3N2O1 | 10.1016/s0960-894x(01)00721-1 | |||
| 14762592 | 4363 | 4 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 340 | 6 | 1 | 2 | 4.1 | O=C(CCN1CCC(Cc2ccccc2)CC1)Nc1ccccc1F | 10.1021/jm00173a011 | |||
| CHEMBL101133 | 4363 | 4 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 340 | 6 | 1 | 2 | 4.1 | O=C(CCN1CCC(Cc2ccccc2)CC1)Nc1ccccc1F | 10.1021/jm00173a011 | |||
| 1342605 | 4397 | 16 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 357 | 6 | 1 | 3 | 3.5 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| CHEMBL101387 | 4397 | 16 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 357 | 6 | 1 | 3 | 3.5 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| 54587281 | 62005 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 516 | 6 | 1 | 8 | 2.2 | Cn1c(N2CCN(CC/C=C3/c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774500 | 62005 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 516 | 6 | 1 | 8 | 2.2 | Cn1c(N2CCN(CC/C=C3/c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 2398 | 954 | 62 | None | -1 | 29 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| 2801 | 954 | 62 | None | -1 | 29 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| 701 | 954 | 62 | None | -1 | 29 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| CHEMBL415 | 954 | 62 | None | -1 | 29 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| DB01242 | 954 | 62 | None | -1 | 29 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| 11282005 | 66066 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL183706 | 66066 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 10 | 1 | 5 | 4.6 | CCOCCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 44392621 | 66324 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 420 | 10 | 0 | 5 | 4.7 | CCOCCn1cc(C2CCN(CCOc3ccccc3C=O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| CHEMBL184989 | 66324 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 420 | 10 | 0 | 5 | 4.7 | CCOCCn1cc(C2CCN(CCOc3ccccc3C=O)CC2)c2ccccc21 | 10.1016/j.bmcl.2004.12.008 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2016.04.087 | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2016.04.087 | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2016.04.087 | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2016.04.087 | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2016.04.087 | |||
| 21177786 | 85390 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 225 | 1 | 2 | 5 | -1.4 | O=C1NC(=O)C(=CN2CCOCC2)C(=O)N1 | 10.1007/s00044-008-9119-y | |||
| CHEMBL2262482 | 85390 | 0 | None | - | 0 | Guinea pig | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 225 | 1 | 2 | 5 | -1.4 | O=C1NC(=O)C(=CN2CCOCC2)C(=O)N1 | 10.1007/s00044-008-9119-y | |||
| 10273238 | 84754 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 414 | 6 | 1 | 4 | 5.4 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccco4)c4ccccc34)CC2)c1 | 10.1021/jm0498203 | |||
| CHEMBL222985 | 84754 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 414 | 6 | 1 | 4 | 5.4 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4ccco4)c4ccccc34)CC2)c1 | 10.1021/jm0498203 | |||
| 13726622 | 94578 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 311 | 3 | 0 | 4 | 2.2 | CN1C[C@H](CCN2CCC2)Oc2ncc(Cl)cc2C1=S | 10.1021/jm00108a012 | |||
| CHEMBL25198 | 94578 | 0 | None | - | 0 | Guinea pig | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 311 | 3 | 0 | 4 | 2.2 | CN1C[C@H](CCN2CCC2)Oc2ncc(Cl)cc2C1=S | 10.1021/jm00108a012 | |||
| 45273362 | 196473 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 551 | 8 | 1 | 10 | 2.8 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(OCC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| CHEMBL563271 | 196473 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 551 | 8 | 1 | 10 | 2.8 | Cn1c(N2CCCN(CCCN3c4ccccc4Sc4ccc(OCC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmcl.2009.03.124 | |||
| 135398737 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 38 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 722 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| CHEMBL42 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| DB00363 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1073/pnas.0611417104 | |||
| 1385580 | 29276 | 76 | None | - | 5 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1021/jm00121a022 | |||
| 4615 | 29276 | 76 | None | - | 5 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1021/jm00121a022 | |||
| CHEMBL13828 | 29276 | 76 | None | - | 5 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1021/jm00121a022 | |||
| 150575506 | 172171 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.2 | COc1ccccc1OCCCN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| CHEMBL4473466 | 172171 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.2 | COc1ccccc1OCCCN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/j.bmcl.2019.126712 | |||
| 6761 | 67799 | 19 | None | -1 | 18 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 401 | 5 | 1 | 4 | 4.5 | NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 | nan | |||
| CHEMBL1909072 | 67799 | 19 | None | -1 | 18 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 401 | 5 | 1 | 4 | 4.5 | NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 | nan | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 10202996 | 84642 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 5.8 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4cccs4)c4ccccc34)CC2)c1 | 10.1021/jm0498203 | |||
| CHEMBL222372 | 84642 | 0 | None | - | 0 | Guinea pig | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 5.8 | O=C(O)c1cccc(CN2CCC(c3cn(Cc4cccs4)c4ccccc34)CC2)c1 | 10.1021/jm0498203 | |||
| 10162727 | 84618 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 478 | 7 | 1 | 5 | 6.0 | COc1ccc(CN2CCC(c3cn(Cc4cccs4)c4cc(F)ccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| CHEMBL222139 | 84618 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 478 | 7 | 1 | 5 | 6.0 | COc1ccc(CN2CCC(c3cn(Cc4cccs4)c4cc(F)ccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| 54580386 | 62007 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 530 | 6 | 1 | 8 | 2.6 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| CHEMBL1774502 | 62007 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 530 | 6 | 1 | 8 | 2.6 | Cn1c(N2CCCN(CC/C=C3/c4ccccc4COc4ccc(CC(=O)O)cc43)CC2)cc(=O)n(C)c1=O | 10.1016/j.bmc.2011.03.003 | |||
| 45484995 | 198519 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 403 | 6 | 2 | 5 | 3.5 | Cc1cnc(N[C@H]2CC[C@@H](CNC(=O)c3ccc(F)c(F)c3)CC2)nc1N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| CHEMBL577904 | 198519 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 403 | 6 | 2 | 5 | 3.5 | Cc1cnc(N[C@H]2CC[C@@H](CNC(=O)c3ccc(F)c(F)c3)CC2)nc1N(C)C | 10.1016/j.bmcl.2009.09.003 | |||
| 44332030 | 111488 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 242 | 0 | 2 | 3 | 1.1 | NN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| CHEMBL327724 | 111488 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 242 | 0 | 2 | 3 | 1.1 | NN1CCN2Cc3[nH]c4ccccc4c3CC2C1 | 10.1021/jm00173a011 | |||
| 2600 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00020a018 | |||
| 2608 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00020a018 | |||
| 5405 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00020a018 | |||
| CHEMBL17157 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00020a018 | |||
| DB00342 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00020a018 | |||
| 14407102 | 13854 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 509 | 10 | 1 | 5 | 5.6 | CCOC(=O)c1ccc(OCCCN2CCC(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm00121a022 | |||
| CHEMBL1195925 | 13854 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 509 | 10 | 1 | 5 | 5.6 | CCOC(=O)c1ccc(OCCCN2CCC(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm00121a022 | |||
| CHEMBL555593 | 13854 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 509 | 10 | 1 | 5 | 5.6 | CCOC(=O)c1ccc(OCCCN2CCC(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1021/jm00121a022 | |||
| 10139591 | 84640 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 462 | 7 | 1 | 5 | 5.5 | COc1ccc(CN2CCC(c3cn(Cc4ccoc4)c4cc(F)ccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| CHEMBL222356 | 84640 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 462 | 7 | 1 | 5 | 5.5 | COc1ccc(CN2CCC(c3cn(Cc4ccoc4)c4cc(F)ccc34)CC2)cc1C(=O)O | 10.1021/jm0498203 | |||
| 14762594 | 111442 | 3 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 352 | 7 | 1 | 3 | 4.0 | COc1ccccc1NC(=O)CCN1CCC(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| CHEMBL327517 | 111442 | 3 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 352 | 7 | 1 | 3 | 4.0 | COc1ccccc1NC(=O)CCN1CCC(Cc2ccccc2)CC1 | 10.1021/jm00173a011 | |||
| 11338659 | 84302 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 404 | 8 | 1 | 4 | 4.8 | C=CCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| CHEMBL221463 | 84302 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 404 | 8 | 1 | 4 | 4.8 | C=CCn1cc(C2CCN(CCOc3ccccc3C(=O)O)CC2)c2ccccc21 | 10.1021/jm0498203 | |||
| 127049863 | 140252 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 443 | 8 | 1 | 5 | 4.5 | CNC(=O)c1cc(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)ccc1F | 10.1016/j.bmcl.2016.04.087 | |||
| CHEMBL3805518 | 140252 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 443 | 8 | 1 | 5 | 4.5 | CNC(=O)c1cc(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)ccc1F | 10.1016/j.bmcl.2016.04.087 | |||
| 14762596 | 4373 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 408 | 4 | 2 | 3 | 3.9 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| CHEMBL101217 | 4373 | 0 | None | - | 0 | Guinea pig | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 408 | 4 | 2 | 3 | 3.9 | O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1Cl | 10.1021/jm00173a011 | |||
| 10204866 | 84736 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 460 | 8 | 1 | 5 | 5.7 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3cccs3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL222881 | 84736 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 460 | 8 | 1 | 5 | 5.7 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3cccs3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| 10138404 | 136882 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 444 | 8 | 1 | 5 | 5.2 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccco3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| CHEMBL374218 | 136882 | 0 | None | - | 0 | Guinea pig | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 444 | 8 | 1 | 5 | 5.2 | O=C(O)c1ccccc1OCCN1CCC(c2cn(Cc3ccco3)c3ccccc23)CC1 | 10.1021/jm0498203 | |||
| 100 | 3805 | 58 | None | -23 | 55 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1021/jm00153a010 | |||
| 2637 | 3805 | 58 | None | -23 | 55 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1021/jm00153a010 | |||
| 5452 | 3805 | 58 | None | -23 | 55 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1021/jm00153a010 | |||
| CHEMBL479 | 3805 | 58 | None | -23 | 55 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1021/jm00153a010 | |||
| DB00679 | 3805 | 58 | None | -23 | 55 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1021/jm00153a010 | |||
| 191 | 403 | 98 | None | -56 | 29 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| 201 | 403 | 98 | None | -56 | 29 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| 2170 | 403 | 98 | None | -56 | 29 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| CHEMBL1113 | 403 | 98 | None | -56 | 29 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| DB00543 | 403 | 98 | None | -56 | 29 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 10.1 | pKd | = | 10.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm100064d | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 10.1 | pKd | = | 10.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm100064d | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 10.1 | pKd | = | 10.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm100064d | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 10.1 | pKd | = | 10.1 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm100064d | |||
| CHEMBL5284242 | 194615 | 0 | None | 56 | 3 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 510 | 11 | 0 | 6 | 4.0 | COCCCC(=O)N(C)CCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315342 | 194615 | 0 | None | 56 | 3 | Human | 10.0 | pKd | = | 10 | Binding | ChEMBL | 510 | 11 | 0 | 6 | 4.0 | COCCCC(=O)N(C)CCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 1228 | 3866 | 34 | None | 5 | 4 | Guinea pig | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| 2763 | 3866 | 34 | None | 5 | 4 | Guinea pig | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| 5282443 | 3866 | 34 | None | 5 | 4 | Guinea pig | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| CHEMBL855 | 3866 | 34 | None | 5 | 4 | Guinea pig | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| DB00427 | 3866 | 34 | None | 5 | 4 | Guinea pig | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| CHEMBL5275284 | 194654 | 0 | None | 5 | 3 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 466 | 8 | 1 | 5 | 3.9 | CC(C)C(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315872 | 194654 | 0 | None | 5 | 3 | Human | 9.9 | pKd | = | 9.9 | Binding | ChEMBL | 466 | 8 | 1 | 5 | 3.9 | CC(C)C(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5272464 | 194625 | 0 | None | 11 | 3 | Human | 9.8 | pKd | = | 9.8 | Binding | ChEMBL | 480 | 10 | 1 | 5 | 4.4 | CCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315453 | 194625 | 0 | None | 11 | 3 | Human | 9.8 | pKd | = | 9.8 | Binding | ChEMBL | 480 | 10 | 1 | 5 | 4.4 | CCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 24824726 | 161109 | 1 | None | 2 | 6 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4060529 | 161109 | 1 | None | 2 | 6 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4117079 | 161109 | 1 | None | 2 | 6 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5282336 | 161109 | 1 | None | 2 | 6 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5286389 | 161109 | 1 | None | 2 | 6 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 2267 | 559 | 71 | None | 10 | 7 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| 271 | 559 | 71 | None | 10 | 7 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| 7121 | 559 | 71 | None | 10 | 7 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL639 | 559 | 71 | None | 10 | 7 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| DB00972 | 559 | 71 | None | 10 | 7 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5273244 | 194616 | 0 | None | 63 | 3 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 2.9 | COCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315364 | 194616 | 0 | None | 63 | 3 | Human | 9.7 | pKd | = | 9.7 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 2.9 | COCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5270515 | 194609 | 0 | None | 39 | 3 | Human | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.6 | CCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315265 | 194609 | 0 | None | 39 | 3 | Human | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.6 | CCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 1227 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1007/s00044-012-0090-2 | |||
| 2331 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1007/s00044-012-0090-2 | |||
| 3957 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1007/s00044-012-0090-2 | |||
| 4992 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1007/s00044-012-0090-2 | |||
| CHEMBL511 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1007/s00044-012-0090-2 | |||
| DB06691 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1007/s00044-012-0090-2 | |||
| CHEMBL5276489 | 194643 | 0 | None | 70 | 3 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 4.4 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315725 | 194643 | 0 | None | 70 | 3 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 4.4 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| 24824726 | 161109 | 1 | None | 2 | 6 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4060529 | 161109 | 1 | None | 2 | 6 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4117079 | 161109 | 1 | None | 2 | 6 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5282336 | 161109 | 1 | None | 2 | 6 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5286389 | 161109 | 1 | None | 2 | 6 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5272034 | 194611 | 0 | None | 10 | 3 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315277 | 194611 | 0 | None | 10 | 3 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5286701 | 194629 | 0 | None | 12 | 3 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.3 | COCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315483 | 194629 | 0 | None | 12 | 3 | Human | 9.3 | pKd | = | 9.3 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.3 | COCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5269671 | 194600 | 0 | None | 44 | 3 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 466 | 9 | 1 | 5 | 4.0 | CCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315170 | 194600 | 0 | None | 44 | 3 | Human | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 466 | 9 | 1 | 5 | 4.0 | CCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 1227 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1039/C8MD00527C | |||
| 2331 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1039/C8MD00527C | |||
| 3957 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1039/C8MD00527C | |||
| 4992 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1039/C8MD00527C | |||
| CHEMBL511 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1039/C8MD00527C | |||
| DB06691 | 2489 | 43 | None | 2 | 12 | Guinea pig | 9.2 | pKd | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1039/C8MD00527C | |||
| CHEMBL5291469 | 194640 | 0 | None | 70 | 2 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 508 | 8 | 1 | 6 | 3.6 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCOCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315702 | 194640 | 0 | None | 70 | 2 | Human | 9.1 | pKd | = | 9.1 | Binding | ChEMBL | 508 | 8 | 1 | 6 | 3.6 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCOCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| 277 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.0 | pKd | = | 9 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| 2913 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.0 | pKd | = | 9 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| 765 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.0 | pKd | = | 9 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| CHEMBL516 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.0 | pKd | = | 9 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| DB00434 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.0 | pKd | = | 9 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| 1227 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2015.02.037 | |||
| 2331 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2015.02.037 | |||
| 3957 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2015.02.037 | |||
| 4992 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2015.02.037 | |||
| CHEMBL511 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2015.02.037 | |||
| DB06691 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2015.02.037 | |||
| 11291 | 98796 | 25 | None | 4 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1021/jm00017a019 | |||
| CHEMBL278398 | 98796 | 25 | None | 4 | 2 | Guinea pig | 8.8 | pKd | = | 8.8 | Binding | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1021/jm00017a019 | |||
| 24824726 | 161109 | 1 | None | -2 | 6 | Guinea pig | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4060529 | 161109 | 1 | None | -2 | 6 | Guinea pig | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4117079 | 161109 | 1 | None | -2 | 6 | Guinea pig | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5282336 | 161109 | 1 | None | -2 | 6 | Guinea pig | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5286389 | 161109 | 1 | None | -2 | 6 | Guinea pig | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 11097588 | 202138 | 2 | None | - | 1 | Guinea pig | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| CHEMBL609131 | 202138 | 2 | None | - | 1 | Guinea pig | 8.7 | pKd | = | 8.7 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| 168279703 | 191138 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 1372 | 37 | 8 | 13 | 7.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5188259 | 191138 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8 | Binding | ChEMBL | 1372 | 37 | 8 | 13 | 7.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168279703 | 191138 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 1372 | 37 | 8 | 13 | 7.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5188259 | 191138 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 1372 | 37 | 8 | 13 | 7.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168282752 | 191096 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 1303 | 32 | 8 | 13 | 7.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5187728 | 191096 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 1303 | 32 | 8 | 13 | 7.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 11826604 | 39706 | 0 | None | -7585 | 3 | Guinea pig | 5.0 | pKd | = | 5 | Binding | ChEMBL | 457 | 10 | 1 | 4 | 6.4 | c1ccc2c(NCCCc3ccc(OCCCN4CCCCC4)cc3)c3c(nc2c1)CCCC3 | 10.1021/jm0110845 | |||
| CHEMBL14754 | 39706 | 0 | None | -7585 | 3 | Guinea pig | 5.0 | pKd | = | 5 | Binding | ChEMBL | 457 | 10 | 1 | 4 | 6.4 | c1ccc2c(NCCCc3ccc(OCCCN4CCCCC4)cc3)c3c(nc2c1)CCCC3 | 10.1021/jm0110845 | |||
| 11004759 | 43164 | 1 | None | -30902 | 3 | Guinea pig | 5.0 | pKd | = | 5 | Binding | ChEMBL | 443 | 9 | 1 | 4 | 6.0 | c1ccc2c(NCCc3ccc(OCCCN4CCCCC4)cc3)c3c(nc2c1)CCCC3 | 10.1021/jm0110845 | |||
| CHEMBL15056 | 43164 | 1 | None | -30902 | 3 | Guinea pig | 5.0 | pKd | = | 5 | Binding | ChEMBL | 443 | 9 | 1 | 4 | 6.0 | c1ccc2c(NCCc3ccc(OCCCN4CCCCC4)cc3)c3c(nc2c1)CCCC3 | 10.1021/jm0110845 | |||
| 44352460 | 20957 | 0 | None | -707 | 3 | Guinea pig | 5.0 | pKd | = | 5 | Binding | ChEMBL | 238 | 8 | 1 | 2 | 3.6 | CC(C)(C)CCCCOCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| CHEMBL131117 | 20957 | 0 | None | -707 | 3 | Guinea pig | 5.0 | pKd | = | 5 | Binding | ChEMBL | 238 | 8 | 1 | 2 | 3.6 | CC(C)(C)CCCCOCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| 155541141 | 176664 | 0 | None | -2 | 2 | Guinea pig | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 504 | 16 | 1 | 5 | 4.7 | N#C/N=C(\N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| CHEMBL4517581 | 176664 | 0 | None | -2 | 2 | Guinea pig | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 504 | 16 | 1 | 5 | 4.7 | N#C/N=C(\N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| CHEMBL4598140 | 176664 | 0 | None | -2 | 2 | Guinea pig | 7.0 | pKd | = | 7.0 | Binding | ChEMBL | 504 | 16 | 1 | 5 | 4.7 | N#C/N=C(\N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| 168282752 | 191096 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 1303 | 32 | 8 | 13 | 7.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5187728 | 191096 | 0 | None | - | 1 | Human | 8.0 | pKd | = | 8.0 | Binding | ChEMBL | 1303 | 32 | 8 | 13 | 7.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 90667434 | 109489 | 0 | None | - | 1 | Guinea pig | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 313 | 7 | 2 | 3 | 1.9 | CC(CC(=O)/N=C(\N)NCCCn1ccnc1)c1ccccc1 | 10.1039/C3MD00245D | |||
| CHEMBL3220892 | 109489 | 0 | None | - | 1 | Guinea pig | 6.0 | pKd | = | 6.0 | Binding | ChEMBL | 313 | 7 | 2 | 3 | 1.9 | CC(CC(=O)/N=C(\N)NCCCn1ccnc1)c1ccccc1 | 10.1039/C3MD00245D | |||
| 168288124 | 191727 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1259 | 31 | 7 | 12 | 6.9 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5197183 | 191727 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1259 | 31 | 7 | 12 | 6.9 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168288124 | 191727 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1259 | 31 | 7 | 12 | 6.9 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5197183 | 191727 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1259 | 31 | 7 | 12 | 6.9 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 155540438 | 172541 | 0 | None | -7 | 2 | Guinea pig | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 290 | 3 | 1 | 6 | 1.3 | CN1CCN(c2nc(N)nc(CC3CCCCC3)n2)CC1 | 10.1016/j.bmc.2019.02.020 | |||
| CHEMBL4483783 | 172541 | 0 | None | -7 | 2 | Guinea pig | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 290 | 3 | 1 | 6 | 1.3 | CN1CCN(c2nc(N)nc(CC3CCCCC3)n2)CC1 | 10.1016/j.bmc.2019.02.020 | |||
| 155561756 | 176416 | 0 | None | -28 | 2 | Guinea pig | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 546 | 16 | 2 | 3 | 7.3 | N=C(N)N(CCCCC1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4585110 | 176416 | 0 | None | -28 | 2 | Guinea pig | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 546 | 16 | 2 | 3 | 7.3 | N=C(N)N(CCCCC1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4596105 | 176416 | 0 | None | -28 | 2 | Guinea pig | 6.9 | pKd | = | 6.9 | Binding | ChEMBL | 546 | 16 | 2 | 3 | 7.3 | N=C(N)N(CCCCC1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| 10902522 | 18976 | 0 | None | -1000 | 3 | Guinea pig | 4.9 | pKd | = | 4.9 | Binding | ChEMBL | 295 | 5 | 2 | 3 | 3.5 | CC(C)(C)C(NC(=O)OCCCc1c[nH]cn1)C(C)(C)C | 10.1021/jm020910m | |||
| CHEMBL128773 | 18976 | 0 | None | -1000 | 3 | Guinea pig | 4.9 | pKd | = | 4.9 | Binding | ChEMBL | 295 | 5 | 2 | 3 | 3.5 | CC(C)(C)C(NC(=O)OCCCc1c[nH]cn1)C(C)(C)C | 10.1021/jm020910m | |||
| 168284216 | 190877 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 1112 | 30 | 9 | 12 | 1.8 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5184842 | 190877 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 1112 | 30 | 9 | 12 | 1.8 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 168284216 | 190877 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 1112 | 30 | 9 | 12 | 1.8 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5184842 | 190877 | 0 | None | - | 1 | Human | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 1112 | 30 | 9 | 12 | 1.8 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 168269144 | 189998 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1193 | 28 | 6 | 14 | 6.0 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5171227 | 189998 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1193 | 28 | 6 | 14 | 6.0 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 25149335 | 184225 | 0 | None | - | 1 | Guinea pig | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1039/C3MD00245D | |||
| CHEMBL483406 | 184225 | 0 | None | - | 1 | Guinea pig | 5.9 | pKd | = | 5.9 | Binding | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1039/C3MD00245D | |||
| 168269144 | 189998 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1193 | 28 | 6 | 14 | 6.0 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5171227 | 189998 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 1193 | 28 | 6 | 14 | 6.0 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168282405 | 191207 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 1101 | 28 | 7 | 10 | 4.5 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5189492 | 191207 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 1101 | 28 | 7 | 10 | 4.5 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 168282405 | 191207 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 1101 | 28 | 7 | 10 | 4.5 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5189492 | 191207 | 0 | None | - | 1 | Human | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 1101 | 28 | 7 | 10 | 4.5 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 90667234 | 109473 | 0 | None | - | 1 | Guinea pig | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 314 | 7 | 3 | 3 | 1.4 | CC(CC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1039/C3MD00245D | |||
| CHEMBL3220635 | 109473 | 0 | None | - | 1 | Guinea pig | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 314 | 7 | 3 | 3 | 1.4 | CC(CC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1039/C3MD00245D | |||
| 168281594 | 191269 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 1319 | 33 | 9 | 14 | 6.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5190566 | 191269 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 1319 | 33 | 9 | 14 | 6.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 102596130 | 117699 | 21 | None | - | 1 | Guinea pig | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 405 | 0 | 0 | 5 | 4.0 | O=C(N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1)n1cncn1 | 10.1016/j.bmcl.2015.02.037 | |||
| CHEMBL3401455 | 117699 | 21 | None | - | 1 | Guinea pig | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 405 | 0 | 0 | 5 | 4.0 | O=C(N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1)n1cncn1 | 10.1016/j.bmcl.2015.02.037 | |||
| 155554852 | 176612 | 0 | None | 10 | 2 | Guinea pig | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 339 | 11 | 2 | 2 | 4.4 | N=C(N)N(CCCCCCCOc1ccccc1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| CHEMBL4550675 | 176612 | 0 | None | 10 | 2 | Guinea pig | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 339 | 11 | 2 | 2 | 4.4 | N=C(N)N(CCCCCCCOc1ccccc1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| CHEMBL4597766 | 176612 | 0 | None | 10 | 2 | Guinea pig | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 339 | 11 | 2 | 2 | 4.4 | N=C(N)N(CCCCCCCOc1ccccc1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| 11437142 | 202606 | 2 | None | - | 1 | Guinea pig | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| CHEMBL612084 | 202606 | 2 | None | - | 1 | Guinea pig | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| 168281594 | 191269 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 1319 | 33 | 9 | 14 | 6.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5190566 | 191269 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 1319 | 33 | 9 | 14 | 6.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168297910 | 192453 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 1223 | 29 | 7 | 15 | 5.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208512 | 192453 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 1223 | 29 | 7 | 15 | 5.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168297910 | 192453 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 1223 | 29 | 7 | 15 | 5.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208512 | 192453 | 0 | None | - | 1 | Human | 6.8 | pKd | = | 6.8 | Binding | ChEMBL | 1223 | 29 | 7 | 15 | 5.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 90667235 | 109474 | 0 | None | - | 1 | Guinea pig | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 376 | 8 | 3 | 3 | 2.4 | N/C(=N\C(=O)CC(c1ccccc1)c1ccccc1)NCCCc1ncn[nH]1 | 10.1039/C3MD00245D | |||
| CHEMBL3220636 | 109474 | 0 | None | - | 1 | Guinea pig | 5.8 | pKd | = | 5.8 | Binding | ChEMBL | 376 | 8 | 3 | 3 | 2.4 | N/C(=N\C(=O)CC(c1ccccc1)c1ccccc1)NCCCc1ncn[nH]1 | 10.1039/C3MD00245D | |||
| 168280897 | 190786 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 1383 | 39 | 10 | 15 | 4.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5183511 | 190786 | 0 | None | - | 1 | Human | 7.8 | pKd | = | 7.8 | Binding | ChEMBL | 1383 | 39 | 10 | 15 | 4.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168280897 | 190786 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1383 | 39 | 10 | 15 | 4.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5183511 | 190786 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1383 | 39 | 10 | 15 | 4.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168285825 | 191547 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1278 | 31 | 8 | 16 | 4.7 | CC(C)[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5194541 | 191547 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1278 | 31 | 8 | 16 | 4.7 | CC(C)[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168285825 | 191547 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1278 | 31 | 8 | 16 | 4.7 | CC(C)[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5194541 | 191547 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1278 | 31 | 8 | 16 | 4.7 | CC(C)[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168280529 | 190784 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1280 | 32 | 8 | 16 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5183487 | 190784 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1280 | 32 | 8 | 16 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168292310 | 191974 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1093 | 23 | 5 | 13 | 5.7 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5201153 | 191974 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1093 | 23 | 5 | 13 | 5.7 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 4161540 | 116089 | 26 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 412 | 2 | 1 | 4 | 4.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(CO)ccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL3357022 | 116089 | 26 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 412 | 2 | 1 | 4 | 4.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(CO)ccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 60150162 | 173866 | 0 | None | -32 | 5 | Guinea pig | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 479 | 16 | 2 | 4 | 4.8 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| CHEMBL4539444 | 173866 | 0 | None | -32 | 5 | Guinea pig | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 479 | 16 | 2 | 4 | 4.8 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccccc1 | 10.1039/C8MD00527C | |||
| 10933521 | 163465 | 0 | None | -100 | 3 | Guinea pig | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 237 | 6 | 2 | 3 | 1.9 | CC(NC(=O)OCCCc1c[nH]cn1)C1CC1 | 10.1021/jm020910m | |||
| CHEMBL419975 | 163465 | 0 | None | -100 | 3 | Guinea pig | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 237 | 6 | 2 | 3 | 1.9 | CC(NC(=O)OCCCc1c[nH]cn1)C1CC1 | 10.1021/jm020910m | |||
| 10977121 | 20784 | 2 | None | -3715 | 3 | Guinea pig | 4.7 | pKd | = | 4.7 | Binding | ChEMBL | 224 | 7 | 1 | 2 | 3.2 | CC(C)(C)CCCOCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| CHEMBL130958 | 20784 | 2 | None | -3715 | 3 | Guinea pig | 4.7 | pKd | = | 4.7 | Binding | ChEMBL | 224 | 7 | 1 | 2 | 3.2 | CC(C)(C)CCCOCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| 168280529 | 190784 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1280 | 32 | 8 | 16 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5183487 | 190784 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1280 | 32 | 8 | 16 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168292310 | 191974 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1093 | 23 | 5 | 13 | 5.7 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5201153 | 191974 | 0 | None | - | 1 | Human | 7.7 | pKd | = | 7.7 | Binding | ChEMBL | 1093 | 23 | 5 | 13 | 5.7 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 12884174 | 177738 | 2 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 348 | 1 | 0 | 3 | 4.2 | CCOC(=O)N1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4642460 | 177738 | 2 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 348 | 1 | 0 | 3 | 4.2 | CCOC(=O)N1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 168269973 | 189926 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 1166 | 31 | 9 | 13 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5169978 | 189926 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 1166 | 31 | 9 | 13 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168269973 | 189926 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 1166 | 31 | 9 | 13 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5169978 | 189926 | 0 | None | - | 1 | Human | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 1166 | 31 | 9 | 13 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 6604035 | 168075 | 6 | None | - | 1 | Guinea pig | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | CC(C)(C)c1ccc([C@@H](O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/S0960-894X(00)80261-9 | |||
| CHEMBL432527 | 168075 | 6 | None | - | 1 | Guinea pig | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | CC(C)(C)c1ccc([C@@H](O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/S0960-894X(00)80261-9 | |||
| 168280244 | 190971 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1462 | 38 | 10 | 17 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5186049 | 190971 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1462 | 38 | 10 | 17 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168284928 | 191384 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1451 | 36 | 8 | 15 | 7.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192377 | 191384 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1451 | 36 | 8 | 15 | 7.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168280244 | 190971 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1462 | 38 | 10 | 17 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5186049 | 190971 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1462 | 38 | 10 | 17 | 4.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168284928 | 191384 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1451 | 36 | 8 | 15 | 7.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192377 | 191384 | 0 | None | - | 1 | Human | 5.7 | pKd | = | 5.7 | Binding | ChEMBL | 1451 | 36 | 8 | 15 | 7.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C2/N(C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 60150166 | 174724 | 0 | None | -60 | 5 | Guinea pig | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 524 | 17 | 2 | 6 | 4.7 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc([N+](=O)[O-])cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4560123 | 174724 | 0 | None | -60 | 5 | Guinea pig | 6.7 | pKd | = | 6.7 | Binding | ChEMBL | 524 | 17 | 2 | 6 | 4.7 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc([N+](=O)[O-])cc1 | 10.1039/C8MD00527C | |||
| 156012610 | 177394 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 400 | 1 | 0 | 3 | 5.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CC(F)c3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4638183 | 177394 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 400 | 1 | 0 | 3 | 5.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CC(F)c3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 90667227 | 109468 | 0 | None | - | 1 | Guinea pig | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 375 | 8 | 2 | 3 | 2.9 | N/C(=N\C(=O)CC(c1ccccc1)c1ccccc1)NCCCn1ccnc1 | 10.1039/C3MD00245D | |||
| CHEMBL3220628 | 109468 | 0 | None | - | 1 | Guinea pig | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 375 | 8 | 2 | 3 | 2.9 | N/C(=N\C(=O)CC(c1ccccc1)c1ccccc1)NCCCn1ccnc1 | 10.1039/C3MD00245D | |||
| 155540201 | 172908 | 0 | None | -15 | 5 | Guinea pig | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 513 | 16 | 2 | 4 | 5.5 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(Cl)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4516173 | 172908 | 0 | None | -15 | 5 | Guinea pig | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 513 | 16 | 2 | 4 | 5.5 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(Cl)cc1 | 10.1039/C8MD00527C | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.0c00483 | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.0c00483 | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.0c00483 | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.0c00483 | |||
| 10916261 | 35292 | 0 | None | -30902 | 3 | Guinea pig | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 395 | 7 | 1 | 4 | 5.9 | Clc1ccc2c(Nc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| CHEMBL14364 | 35292 | 0 | None | -30902 | 3 | Guinea pig | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 395 | 7 | 1 | 4 | 5.9 | Clc1ccc2c(Nc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| 9794557 | 19999 | 0 | None | -83 | 3 | Guinea pig | 4.6 | pKd | = | 4.6 | Binding | ChEMBL | 227 | 6 | 0 | 2 | 3.3 | CC(C)(C)CCOCCCN1CCCCC1 | 10.1021/jm020910m | |||
| CHEMBL130331 | 19999 | 0 | None | -83 | 3 | Guinea pig | 4.6 | pKd | = | 4.6 | Binding | ChEMBL | 227 | 6 | 0 | 2 | 3.3 | CC(C)(C)CCOCCCN1CCCCC1 | 10.1021/jm020910m | |||
| 156013234 | 177503 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 398 | 1 | 1 | 4 | 4.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3C(O)Cc3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4639563 | 177503 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 398 | 1 | 1 | 4 | 4.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3C(O)Cc3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 90667233 | 109472 | 0 | None | - | 1 | Guinea pig | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 375 | 8 | 3 | 2 | 3.0 | N/C(=N\C(=O)CC(c1ccccc1)c1ccccc1)NCCCc1cn[nH]c1 | 10.1039/C3MD00245D | |||
| CHEMBL3220634 | 109472 | 0 | None | - | 1 | Guinea pig | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 375 | 8 | 3 | 2 | 3.0 | N/C(=N\C(=O)CC(c1ccccc1)c1ccccc1)NCCCc1cn[nH]c1 | 10.1039/C3MD00245D | |||
| 168281433 | 190959 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 1214 | 34 | 8 | 11 | 5.2 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185960 | 190959 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 1214 | 34 | 8 | 11 | 5.2 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 168281433 | 190959 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 1214 | 34 | 8 | 11 | 5.2 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185960 | 190959 | 0 | None | - | 1 | Human | 5.6 | pKd | = | 5.6 | Binding | ChEMBL | 1214 | 34 | 8 | 11 | 5.2 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 156010880 | 177143 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 432 | 2 | 0 | 3 | 5.8 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(C(F)F)ccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4633975 | 177143 | 0 | None | - | 1 | Human | 6.6 | pKd | = | 6.6 | Binding | ChEMBL | 432 | 2 | 0 | 3 | 5.8 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(C(F)F)ccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 168290008 | 191817 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 1180 | 27 | 7 | 15 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5198557 | 191817 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 1180 | 27 | 7 | 15 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 14637775 | 178038 | 25 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 326 | 0 | 2 | 3 | 3.5 | OC1Cc2cc(Cl)ccc2C(=C2CCNCC2)c2ncccc21 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4647038 | 178038 | 25 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 326 | 0 | 2 | 3 | 3.5 | OC1Cc2cc(Cl)ccc2C(=C2CCNCC2)c2ncccc21 | 10.1021/acs.jmedchem.0c00483 | |||
| 168290008 | 191817 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 1180 | 27 | 7 | 15 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5198557 | 191817 | 0 | None | - | 1 | Human | 7.6 | pKd | = | 7.6 | Binding | ChEMBL | 1180 | 27 | 7 | 15 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 155550732 | 176629 | 0 | None | -11 | 3 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 323 | 8 | 0 | 2 | 5.4 | c1ccc(-c2ccc(OCCCCCN3CCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL4540849 | 176629 | 0 | None | -11 | 3 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 323 | 8 | 0 | 2 | 5.4 | c1ccc(-c2ccc(OCCCCCN3CCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL4597895 | 176629 | 0 | None | -11 | 3 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 323 | 8 | 0 | 2 | 5.4 | c1ccc(-c2ccc(OCCCCCN3CCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm100064d | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm100064d | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm100064d | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm100064d | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm100064d | |||
| 168280938 | 190830 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 1270 | 33 | 9 | 14 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5184108 | 190830 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 1270 | 33 | 9 | 14 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 90667430 | 109488 | 0 | None | - | 1 | Guinea pig | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 370 | 9 | 2 | 3 | 2.9 | CC(CC(=O)/N=C(\N)NCCCc1ccc(CN(C)C)o1)c1ccccc1 | 10.1039/C3MD00245D | |||
| CHEMBL3220888 | 109488 | 0 | None | - | 1 | Guinea pig | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 370 | 9 | 2 | 3 | 2.9 | CC(CC(=O)/N=C(\N)NCCCc1ccc(CN(C)C)o1)c1ccccc1 | 10.1039/C3MD00245D | |||
| 2600 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(00)80261-9 | |||
| 2608 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(00)80261-9 | |||
| 5405 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(00)80261-9 | |||
| CHEMBL17157 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(00)80261-9 | |||
| DB00342 | 3779 | 74 | None | -3 | 13 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/S0960-894X(00)80261-9 | |||
| 118729369 | 117846 | 0 | None | - | 1 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 368 | 0 | 0 | 4 | 4.3 | O=C(N1CCC(=C2c3ccccc3C=Cc3ccccc32)CC1)n1cncn1 | 10.1016/j.bmcl.2015.02.037 | |||
| CHEMBL3402827 | 117846 | 0 | None | - | 1 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 368 | 0 | 0 | 4 | 4.3 | O=C(N1CCC(=C2c3ccccc3C=Cc3ccccc32)CC1)n1cncn1 | 10.1016/j.bmcl.2015.02.037 | |||
| 11080253 | 36582 | 0 | None | -2041 | 3 | Guinea pig | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 417 | 11 | 1 | 4 | 5.9 | c1ccc2c(NCCCCc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| CHEMBL14484 | 36582 | 0 | None | -2041 | 3 | Guinea pig | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 417 | 11 | 1 | 4 | 5.9 | c1ccc2c(NCCCCc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| 11748564 | 18933 | 0 | None | -1584 | 3 | Guinea pig | 4.5 | pKd | = | 4.5 | Binding | ChEMBL | 299 | 7 | 2 | 3 | 3.2 | O=C(NC(c1ccccc1)C1CC1)OCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| CHEMBL128585 | 18933 | 0 | None | -1584 | 3 | Guinea pig | 4.5 | pKd | = | 4.5 | Binding | ChEMBL | 299 | 7 | 2 | 3 | 3.2 | O=C(NC(c1ccccc1)C1CC1)OCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| 60150164 | 175759 | 0 | None | -107 | 2 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 547 | 16 | 2 | 4 | 5.8 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4583515 | 175759 | 0 | None | -107 | 2 | Guinea pig | 6.5 | pKd | = | 6.5 | Binding | ChEMBL | 547 | 16 | 2 | 4 | 5.8 | N=C(N)N(CCCCN1CCN(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| 11725577 | 11183 | 0 | None | -26 | 3 | Guinea pig | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 352 | 7 | 0 | 4 | 4.6 | CO/N=C(\C)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| CHEMBL1178642 | 11183 | 0 | None | -26 | 3 | Guinea pig | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 352 | 7 | 0 | 4 | 4.6 | CO/N=C(\C)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| CHEMBL35869 | 11183 | 0 | None | -26 | 3 | Guinea pig | 5.5 | pKd | = | 5.5 | Binding | ChEMBL | 352 | 7 | 0 | 4 | 4.6 | CO/N=C(\C)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| 2600 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00013a023 | |||
| 2608 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00013a023 | |||
| 5405 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00013a023 | |||
| CHEMBL17157 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00013a023 | |||
| DB00342 | 3779 | 74 | None | -3 | 13 | Guinea pig | 7.5 | pKd | = | 7.5 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm00013a023 | |||
| 7048803 | 102303 | 4 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | CC(C)(C)c1ccc([C@H](O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/S0960-894X(00)80261-9 | |||
| CHEMBL303454 | 102303 | 4 | None | - | 1 | Guinea pig | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | CC(C)(C)c1ccc([C@H](O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/S0960-894X(00)80261-9 | |||
| 90667232 | 109471 | 0 | None | - | 1 | Guinea pig | 5.4 | pKd | = | 5.4 | Binding | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1cn[nH]c1)c1ccccc1 | 10.1039/C3MD00245D | |||
| CHEMBL3220633 | 109471 | 0 | None | - | 1 | Guinea pig | 5.4 | pKd | = | 5.4 | Binding | ChEMBL | 313 | 7 | 3 | 2 | 2.0 | CC(CC(=O)/N=C(\N)NCCCc1cn[nH]c1)c1ccccc1 | 10.1039/C3MD00245D | |||
| 10949464 | 98189 | 0 | None | -5128 | 3 | Guinea pig | 5.4 | pKd | = | 5.4 | Binding | ChEMBL | 403 | 10 | 1 | 4 | 5.5 | c1ccc2c(NCCCc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| CHEMBL274041 | 98189 | 0 | None | -5128 | 3 | Guinea pig | 5.4 | pKd | = | 5.4 | Binding | ChEMBL | 403 | 10 | 1 | 4 | 5.5 | c1ccc2c(NCCCc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| 44352410 | 19585 | 0 | None | -10 | 2 | Guinea pig | 4.4 | pKd | = | 4.4 | Binding | ChEMBL | 270 | 5 | 1 | 3 | 3.0 | CC(NC(=O)OCCCN1CCCCC1)C(C)(C)C | 10.1021/jm020910m | |||
| CHEMBL130005 | 19585 | 0 | None | -10 | 2 | Guinea pig | 4.4 | pKd | = | 4.4 | Binding | ChEMBL | 270 | 5 | 1 | 3 | 3.0 | CC(NC(=O)OCCCN1CCCCC1)C(C)(C)C | 10.1021/jm020910m | |||
| 168280938 | 190830 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 1270 | 33 | 9 | 14 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5184108 | 190830 | 0 | None | - | 1 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 1270 | 33 | 9 | 14 | 4.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 119570 | 3159 | 96 | None | -162 | 40 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | 10.1021/acs.jmedchem.1c00692 | |||
| 2233 | 3159 | 96 | None | -162 | 40 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | 10.1021/acs.jmedchem.1c00692 | |||
| 953 | 3159 | 96 | None | -162 | 40 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL301265 | 3159 | 96 | None | -162 | 40 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | 10.1021/acs.jmedchem.1c00692 | |||
| DB00413 | 3159 | 96 | None | -162 | 40 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | 10.1021/acs.jmedchem.1c00692 | |||
| 168268716 | 192762 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 372 | 3 | 4 | 4 | 3.5 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NC2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5170276 | 192762 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 372 | 3 | 4 | 4 | 3.5 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NC2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221176 | 192762 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 372 | 3 | 4 | 4 | 3.5 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NC2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168268680 | 192766 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5172675 | 192766 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221210 | 192766 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168268827 | 192779 | 0 | None | -4 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5179906 | 192779 | 0 | None | -4 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221314 | 192779 | 0 | None | -4 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168268853 | 192785 | 0 | None | -19 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 389 | 8 | 4 | 5 | 1.9 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5180504 | 192785 | 0 | None | -19 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 389 | 8 | 4 | 5 | 1.9 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221353 | 192785 | 0 | None | -19 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 389 | 8 | 4 | 5 | 1.9 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168273471 | 192801 | 0 | None | -12 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 596 | 17 | 8 | 10 | 0.7 | N/C(=N\C(=O)NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5173079 | 192801 | 0 | None | -12 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 596 | 17 | 8 | 10 | 0.7 | N/C(=N\C(=O)NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221433 | 192801 | 0 | None | -12 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 596 | 17 | 8 | 10 | 0.7 | N/C(=N\C(=O)NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168273549 | 192803 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5174342 | 192803 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221438 | 192803 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168273640 | 192805 | 0 | None | -100 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 568 | 15 | 8 | 10 | -0.1 | N/C(=N\C(=O)NCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5176229 | 192805 | 0 | None | -100 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 568 | 15 | 8 | 10 | -0.1 | N/C(=N\C(=O)NCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221444 | 192805 | 0 | None | -100 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 568 | 15 | 8 | 10 | -0.1 | N/C(=N\C(=O)NCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168273745 | 192808 | 0 | None | -114 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 332 | 6 | 4 | 4 | 1.5 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5178472 | 192808 | 0 | None | -114 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 332 | 6 | 4 | 4 | 1.5 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221451 | 192808 | 0 | None | -114 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 332 | 6 | 4 | 4 | 1.5 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168274129 | 192809 | 0 | None | -16 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 370 | 12 | 5 | 6 | 1.0 | NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5176780 | 192809 | 0 | None | -16 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 370 | 12 | 5 | 6 | 1.0 | NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221468 | 192809 | 0 | None | -16 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 370 | 12 | 5 | 6 | 1.0 | NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168275750 | 192826 | 0 | None | -72 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 332 | 6 | 3 | 4 | 1.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCc2ccccc2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5175558 | 192826 | 0 | None | -72 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 332 | 6 | 3 | 4 | 1.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCc2ccccc2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221581 | 192826 | 0 | None | -72 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 332 | 6 | 3 | 4 | 1.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCc2ccccc2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168276867 | 192835 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5174278 | 192835 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221653 | 192835 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168277996 | 192846 | 0 | None | -60 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5173373 | 192846 | 0 | None | -60 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221736 | 192846 | 0 | None | -60 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168278471 | 192848 | 0 | None | -229 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 312 | 8 | 4 | 4 | 1.5 | CCCCCNC(=O)/N=C(\N)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5183205 | 192848 | 0 | None | -229 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 312 | 8 | 4 | 4 | 1.5 | CCCCCNC(=O)/N=C(\N)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221757 | 192848 | 0 | None | -229 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 312 | 8 | 4 | 4 | 1.5 | CCCCCNC(=O)/N=C(\N)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168278543 | 192851 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 358 | 4 | 4 | 4 | 1.6 | N/C(=N\C(=O)NCc1ccccc1)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5184846 | 192851 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 358 | 4 | 4 | 4 | 1.6 | N/C(=N\C(=O)NCc1ccccc1)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221764 | 192851 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 358 | 4 | 4 | 4 | 1.6 | N/C(=N\C(=O)NCc1ccccc1)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168280339 | 192865 | 0 | None | 3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 372 | 8 | 3 | 5 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCn1cc(CN(C)C)nn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5188592 | 192865 | 0 | None | 3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 372 | 8 | 3 | 5 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCn1cc(CN(C)C)nn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221885 | 192865 | 0 | None | 3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 372 | 8 | 3 | 5 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCn1cc(CN(C)C)nn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168281536 | 192881 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 369 | 12 | 4 | 5 | 1.7 | Cc1nnc(CCCN/C(N)=N/C(=O)NCCCCCCCCN)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5189006 | 192881 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 369 | 12 | 4 | 5 | 1.7 | Cc1nnc(CCCN/C(N)=N/C(=O)NCCCCCCCCN)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221966 | 192881 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 369 | 12 | 4 | 5 | 1.7 | Cc1nnc(CCCN/C(N)=N/C(=O)NCCCCCCCCN)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168281746 | 192882 | 0 | None | -14454 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 365 | 6 | 4 | 5 | 1.6 | CC(NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1cccc(F)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5184911 | 192882 | 0 | None | -14454 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 365 | 6 | 4 | 5 | 1.6 | CC(NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1cccc(F)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221974 | 192882 | 0 | None | -14454 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 365 | 6 | 4 | 5 | 1.6 | CC(NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1cccc(F)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168283097 | 192893 | 0 | None | -66 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 311 | 9 | 4 | 5 | 0.8 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)o1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5186770 | 192893 | 0 | None | -66 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 311 | 9 | 4 | 5 | 0.8 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)o1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222043 | 192893 | 0 | None | -66 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 311 | 9 | 4 | 5 | 0.8 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)o1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168283321 | 192895 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 364 | 7 | 4 | 4 | 2.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5183015 | 192895 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 364 | 7 | 4 | 4 | 2.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222057 | 192895 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 364 | 7 | 4 | 4 | 2.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168283536 | 192900 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 312 | 8 | 3 | 4 | 1.6 | CCCCCNC(=O)/N=C(/N)NCCCc1nnc(C)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5187758 | 192900 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 312 | 8 | 3 | 4 | 1.6 | CCCCCNC(=O)/N=C(/N)NCCCc1nnc(C)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222074 | 192900 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 312 | 8 | 3 | 4 | 1.6 | CCCCCNC(=O)/N=C(/N)NCCCc1nnc(C)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168284289 | 192906 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 428 | 8 | 4 | 4 | 3.1 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5194860 | 192906 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 428 | 8 | 4 | 4 | 3.1 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222123 | 192906 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 428 | 8 | 4 | 4 | 3.1 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168284480 | 192910 | 0 | None | -66 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 330 | 6 | 4 | 4 | 1.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5197548 | 192910 | 0 | None | -66 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 330 | 6 | 4 | 4 | 1.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222137 | 192910 | 0 | None | -66 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 330 | 6 | 4 | 4 | 1.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168286141 | 192924 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5192993 | 192924 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222231 | 192924 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168286426 | 192926 | 0 | None | -58 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 403 | 10 | 4 | 5 | 2.3 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5198795 | 192926 | 0 | None | -58 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 403 | 10 | 4 | 5 | 2.3 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222241 | 192926 | 0 | None | -58 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 403 | 10 | 4 | 5 | 2.3 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168290235 | 192968 | 0 | None | -12882 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 315 | 6 | 4 | 3 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5201074 | 192968 | 0 | None | -12882 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 315 | 6 | 4 | 3 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222491 | 192968 | 0 | None | -12882 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 315 | 6 | 4 | 3 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168290815 | 192973 | 0 | None | -10232 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 327 | 9 | 4 | 5 | 1.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5200771 | 192973 | 0 | None | -10232 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 327 | 9 | 4 | 5 | 1.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222529 | 192973 | 0 | None | -10232 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 327 | 9 | 4 | 5 | 1.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168291233 | 192979 | 0 | None | -6 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 373 | 8 | 4 | 5 | 1.4 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)o2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5200106 | 192979 | 0 | None | -6 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 373 | 8 | 4 | 5 | 1.4 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)o2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222556 | 192979 | 0 | None | -6 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 373 | 8 | 4 | 5 | 1.4 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)o2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168292954 | 192997 | 0 | None | -44 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.5 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2cnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5202592 | 192997 | 0 | None | -44 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.5 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2cnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222660 | 192997 | 0 | None | -44 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.5 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2cnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294161 | 193006 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1cccc(-c2sc(N)nc2C)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5204739 | 193006 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1cccc(-c2sc(N)nc2C)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222742 | 193006 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1cccc(-c2sc(N)nc2C)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294445 | 193010 | 0 | None | 1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.6 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCC2CCc3nc(N)sc3C2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5208113 | 193010 | 0 | None | 1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.6 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCC2CCc3nc(N)sc3C2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222768 | 193010 | 0 | None | 1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.6 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCC2CCc3nc(N)sc3C2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294166 | 193014 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1ccc(-c2sc(N)nc2C)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5209081 | 193014 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1ccc(-c2sc(N)nc2C)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222775 | 193014 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1ccc(-c2sc(N)nc2C)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294449 | 193018 | 0 | None | -74 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 367 | 7 | 4 | 5 | 1.9 | CC(CNC(=O)/N=C(\N)NCCCc1nnc(N)s1)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5204599 | 193018 | 0 | None | -74 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 367 | 7 | 4 | 5 | 1.9 | CC(CNC(=O)/N=C(\N)NCCCc1nnc(N)s1)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222793 | 193018 | 0 | None | -74 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 367 | 7 | 4 | 5 | 1.9 | CC(CNC(=O)/N=C(\N)NCCCc1nnc(N)s1)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294767 | 193019 | 0 | None | -3235 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 313 | 8 | 4 | 5 | 0.9 | CCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5207281 | 193019 | 0 | None | -3235 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 313 | 8 | 4 | 5 | 0.9 | CCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222802 | 193019 | 0 | None | -3235 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 313 | 8 | 4 | 5 | 0.9 | CCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294770 | 193020 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5208327 | 193020 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222806 | 193020 | 0 | None | -2 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294776 | 193026 | 0 | None | -11 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 366 | 7 | 3 | 4 | 2.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCC(C)C2CCCCC2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5209479 | 193026 | 0 | None | -11 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 366 | 7 | 3 | 4 | 2.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCC(C)C2CCCCC2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222831 | 193026 | 0 | None | -11 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 366 | 7 | 3 | 4 | 2.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCC(C)C2CCCCC2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168295528 | 193031 | 0 | None | -2951 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 333 | 6 | 4 | 5 | 0.9 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5206565 | 193031 | 0 | None | -2951 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 333 | 6 | 4 | 5 | 0.9 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222872 | 193031 | 0 | None | -2951 | 20 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 333 | 6 | 4 | 5 | 0.9 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294178 | 193035 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 414 | 5 | 4 | 4 | 4.4 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)C2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5205197 | 193035 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 414 | 5 | 4 | 4 | 4.4 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)C2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222887 | 193035 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 414 | 5 | 4 | 4 | 4.4 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)C2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168295541 | 193040 | 0 | None | -301 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 347 | 6 | 4 | 5 | 1.4 | C[C@@H](NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5208845 | 193040 | 0 | None | -301 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 347 | 6 | 4 | 5 | 1.4 | C[C@@H](NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222926 | 193040 | 0 | None | -301 | 6 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 347 | 6 | 4 | 5 | 1.4 | C[C@@H](NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168295543 | 193041 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5209021 | 193041 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222929 | 193041 | 0 | None | -1 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168295803 | 193045 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.6 | CCCCCNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5207206 | 193045 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.6 | CCCCCNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222937 | 193045 | 0 | None | -3 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.6 | CCCCCNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294182 | 193048 | 0 | None | -57 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 314 | 6 | 4 | 2 | 1.7 | C[C@@H](NC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5208722 | 193048 | 0 | None | -57 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 314 | 6 | 4 | 2 | 1.7 | C[C@@H](NC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222960 | 193048 | 0 | None | -57 | 4 | Human | 8.4 | pKd | = | 8.4 | Binding | ChEMBL | 314 | 6 | 4 | 2 | 1.7 | C[C@@H](NC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168286984 | 191392 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1254 | 32 | 8 | 13 | 5.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192474 | 191392 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1254 | 32 | 8 | 13 | 5.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168289844 | 191333 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC[C@H](C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5191552 | 191333 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC[C@H](C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 10744393 | 71464 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 514 | 8 | 2 | 5 | 4.7 | O=C(N[C@H](CN1CCC(OC2c3ccccc3CCc3ccccc32)CC1)C(=O)O)OCc1ccccc1 | 10.1021/jm058225d | |||
| CHEMBL196220 | 71464 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 514 | 8 | 2 | 5 | 4.7 | O=C(N[C@H](CN1CCC(OC2c3ccccc3CCc3ccccc32)CC1)C(=O)O)OCc1ccccc1 | 10.1021/jm058225d | |||
| 156021916 | 178190 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 398 | 1 | 1 | 4 | 3.9 | CCOC(=O)N1CC/C(=C2/c3ccc(Cl)cc3CCc3cccnc32)C(O)C1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4649344 | 178190 | 0 | None | - | 1 | Human | 6.4 | pKd | = | 6.4 | Binding | ChEMBL | 398 | 1 | 1 | 4 | 3.9 | CCOC(=O)N1CC/C(=C2/c3ccc(Cl)cc3CCc3cccnc32)C(O)C1 | 10.1021/acs.jmedchem.0c00483 | |||
| 168269233 | 189915 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 1205 | 30 | 7 | 11 | 5.8 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc4ccccc4)NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5169872 | 189915 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 1205 | 30 | 7 | 11 | 5.8 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc4ccccc4)NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 168269233 | 189915 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 1205 | 30 | 7 | 11 | 5.8 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc4ccccc4)NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5169872 | 189915 | 0 | None | - | 1 | Human | 7.4 | pKd | = | 7.4 | Binding | ChEMBL | 1205 | 30 | 7 | 11 | 5.8 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc4ccccc4)NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 156016191 | 177700 | 2 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 380 | 1 | 0 | 3 | 5.0 | CCOC(=O)N1C=C/C(=C2/c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4642056 | 177700 | 2 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 380 | 1 | 0 | 3 | 5.0 | CCOC(=O)N1C=C/C(=C2/c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 156019460 | 177943 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 398 | 1 | 1 | 4 | 4.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CC(O)c3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4645629 | 177943 | 0 | None | - | 1 | Human | 6.3 | pKd | = | 6.3 | Binding | ChEMBL | 398 | 1 | 1 | 4 | 4.4 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CC(O)c3cccnc32)CC1 | 10.1021/acs.jmedchem.0c00483 | |||
| 10936212 | 11211 | 1 | None | -74 | 3 | Guinea pig | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 323 | 6 | 0 | 3 | 4.5 | CC(=O)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| CHEMBL1178750 | 11211 | 1 | None | -74 | 3 | Guinea pig | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 323 | 6 | 0 | 3 | 4.5 | CC(=O)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| CHEMBL39603 | 11211 | 1 | None | -74 | 3 | Guinea pig | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 323 | 6 | 0 | 3 | 4.5 | CC(=O)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| 14637770 | 178097 | 25 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 326 | 0 | 2 | 3 | 3.5 | OC1Cc2cccnc2C(=C2CCNCC2)c2ccc(Cl)cc21 | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4647890 | 178097 | 25 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 326 | 0 | 2 | 3 | 3.5 | OC1Cc2cccnc2C(=C2CCNCC2)c2ccc(Cl)cc21 | 10.1021/acs.jmedchem.0c00483 | |||
| 168272779 | 190564 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1191 | 27 | 6 | 14 | 6.2 | C[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5180096 | 190564 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1191 | 27 | 6 | 14 | 6.2 | C[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168283831 | 190930 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1256 | 32 | 9 | 14 | 3.9 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185508 | 190930 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1256 | 32 | 9 | 14 | 3.9 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168289844 | 191333 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC[C@H](C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5191552 | 191333 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC[C@H](C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168286984 | 191392 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1254 | 32 | 8 | 13 | 5.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192474 | 191392 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1254 | 32 | 8 | 13 | 5.2 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168283831 | 190930 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1256 | 32 | 9 | 14 | 3.9 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185508 | 190930 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1256 | 32 | 9 | 14 | 3.9 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168272779 | 190564 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1191 | 27 | 6 | 14 | 6.2 | C[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5180096 | 190564 | 0 | None | - | 1 | Human | 8.3 | pKd | = | 8.3 | Binding | ChEMBL | 1191 | 27 | 6 | 14 | 6.2 | C[C@H](NC(=O)CCN(C)CC/C=C1\c2ccccc2COc2ccccc21)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCCC(=O)N[C@@H](CCCn1cc(COc2ccc(/C=C/C3=[N+]4C(=Cc5ccc(-c6cccs6)n5[B-]4(F)F)C=C3)cc2)nn1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168289771 | 191813 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC(C)C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5198492 | 191813 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC(C)C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168297510 | 192479 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1305 | 32 | 9 | 14 | 6.0 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208869 | 192479 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1305 | 32 | 9 | 14 | 6.0 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44461723 | 205955 | 0 | None | 398 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 519 | 8 | 0 | 8 | 7.0 | O=c1cc(C2N=NN=N2)oc2cc(OCCCN3CCC(=C(c4ccccc4)c4ccccc4)CC3)ccc12 | 10.1021/jm00013a023 | |||
| CHEMBL84407 | 205955 | 0 | None | 398 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 519 | 8 | 0 | 8 | 7.0 | O=c1cc(C2N=NN=N2)oc2cc(OCCCN3CCC(=C(c4ccccc4)c4ccccc4)CC3)ccc12 | 10.1021/jm00013a023 | |||
| 10435880 | 205360 | 0 | None | 707 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 495 | 8 | 1 | 5 | 5.9 | O=C(O)c1cc(=O)c2cc(OCCCN3CCC(=C(c4ccccc4)c4ccccc4)CC3)ccc2o1 | 10.1021/jm00013a023 | |||
| CHEMBL79732 | 205360 | 0 | None | 707 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 495 | 8 | 1 | 5 | 5.9 | O=C(O)c1cc(=O)c2cc(OCCCN3CCC(=C(c4ccccc4)c4ccccc4)CC3)ccc2o1 | 10.1021/jm00013a023 | |||
| 10067161 | 44119 | 1 | None | -30199 | 3 | Guinea pig | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 361 | 7 | 1 | 4 | 5.2 | c1ccc2c(Nc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| CHEMBL15153 | 44119 | 1 | None | -30199 | 3 | Guinea pig | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 361 | 7 | 1 | 4 | 5.2 | c1ccc2c(Nc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| 11107010 | 18965 | 2 | None | -1000 | 3 | Guinea pig | 4.3 | pKd | = | 4.3 | Binding | ChEMBL | 224 | 6 | 1 | 2 | 3.2 | CC(CC(C)(C)C)OCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| CHEMBL128714 | 18965 | 2 | None | -1000 | 3 | Guinea pig | 4.3 | pKd | = | 4.3 | Binding | ChEMBL | 224 | 6 | 1 | 2 | 3.2 | CC(CC(C)(C)C)OCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| 10956869 | 63052 | 0 | None | -5128 | 3 | Guinea pig | 4.3 | pKd | = | 4.3 | Binding | ChEMBL | 279 | 6 | 2 | 3 | 3.0 | C[C@@H](NC(=O)OCCCc1c[nH]cn1)C1CCCCC1 | 10.1021/jm020910m | |||
| CHEMBL1788247 | 63052 | 0 | None | -5128 | 3 | Guinea pig | 4.3 | pKd | = | 4.3 | Binding | ChEMBL | 279 | 6 | 2 | 3 | 3.0 | C[C@@H](NC(=O)OCCCc1c[nH]cn1)C1CCCCC1 | 10.1021/jm020910m | |||
| 156012578 | 177359 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 414 | 1 | 2 | 5 | 3.5 | CCOC(=O)N1C(O)CC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1O | 10.1021/acs.jmedchem.0c00483 | |||
| CHEMBL4637657 | 177359 | 0 | None | - | 1 | Human | 7.3 | pKd | = | 7.3 | Binding | ChEMBL | 414 | 1 | 2 | 5 | 3.5 | CCOC(=O)N1C(O)CC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1O | 10.1021/acs.jmedchem.0c00483 | |||
| 168297282 | 192477 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 1225 | 36 | 10 | 13 | 2.4 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208850 | 192477 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 1225 | 36 | 10 | 13 | 2.4 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 168297282 | 192477 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 1225 | 36 | 10 | 13 | 2.4 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208850 | 192477 | 0 | None | - | 1 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 1225 | 36 | 10 | 13 | 2.4 | Cc1cc(C)n2c1C=C1C=CC(CCC(=O)NCCCCCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN3CCC(Oc4ccccc4Cc4ccccc4)CC3)C(C)C)C(N)=O)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 277 | 1301 | 62 | None | -2 | 50 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm058225d | |||
| 2913 | 1301 | 62 | None | -2 | 50 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm058225d | |||
| 765 | 1301 | 62 | None | -2 | 50 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm058225d | |||
| CHEMBL516 | 1301 | 62 | None | -2 | 50 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm058225d | |||
| DB00434 | 1301 | 62 | None | -2 | 50 | Human | 5.3 | pKd | = | 5.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm058225d | |||
| 168289021 | 191777 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1272 | 33 | 10 | 15 | 2.9 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5197990 | 191777 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1272 | 33 | 10 | 15 | 2.9 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168289771 | 191813 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC(C)C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5198492 | 191813 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1284 | 34 | 9 | 14 | 4.6 | CC(C)C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168297510 | 192479 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1305 | 32 | 9 | 14 | 6.0 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208869 | 192479 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1305 | 32 | 9 | 14 | 6.0 | C[C@H](NC(=O)[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 24824726 | 161109 | 1 | None | 2 | 6 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4060529 | 161109 | 1 | None | 2 | 6 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4117079 | 161109 | 1 | None | 2 | 6 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5282336 | 161109 | 1 | None | 2 | 6 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5286389 | 161109 | 1 | None | 2 | 6 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 168289021 | 191777 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1272 | 33 | 10 | 15 | 2.9 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5197990 | 191777 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1272 | 33 | 10 | 15 | 2.9 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168295200 | 192389 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1321 | 33 | 10 | 15 | 5.0 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5207609 | 192389 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1321 | 33 | 10 | 15 | 5.0 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 155539314 | 176380 | 0 | None | -5 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 628 | 14 | 4 | 4 | 5.0 | N=C(N)N(CCCCN1CCN(CCCCN(Cc2ccc(C(F)(F)F)cc2)C(=N)N)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4514561 | 176380 | 0 | None | -5 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 628 | 14 | 4 | 4 | 5.0 | N=C(N)N(CCCCN1CCN(CCCCN(Cc2ccc(C(F)(F)F)cc2)C(=N)N)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4595855 | 176380 | 0 | None | -5 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 628 | 14 | 4 | 4 | 5.0 | N=C(N)N(CCCCN1CCN(CCCCN(Cc2ccc(C(F)(F)F)cc2)C(=N)N)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| 155553524 | 176519 | 0 | None | -5 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 546 | 16 | 2 | 3 | 7.3 | N=C(N)N(CCCCN1CCC(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4546027 | 176519 | 0 | None | -5 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 546 | 16 | 2 | 3 | 7.3 | N=C(N)N(CCCCN1CCC(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4596938 | 176519 | 0 | None | -5 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 546 | 16 | 2 | 3 | 7.3 | N=C(N)N(CCCCN1CCC(CCCCCCCOc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| 168283519 | 191064 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 1216 | 32 | 9 | 13 | 3.1 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(C)C)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5187345 | 191064 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 1216 | 32 | 9 | 13 | 3.1 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(C)C)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 155565680 | 176245 | 0 | None | -6 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 547 | 16 | 3 | 4 | 5.7 | N=C(NCCCCN1CCN(CCCCCCCOc2ccccc2)CC1)NCc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4579190 | 176245 | 0 | None | -6 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 547 | 16 | 3 | 4 | 5.7 | N=C(NCCCCN1CCN(CCCCCCCOc2ccccc2)CC1)NCc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| CHEMBL4594800 | 176245 | 0 | None | -6 | 2 | Guinea pig | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 547 | 16 | 3 | 4 | 5.7 | N=C(NCCCCN1CCN(CCCCCCCOc2ccccc2)CC1)NCc1ccc(C(F)(F)F)cc1 | 10.1039/C8MD00527C | |||
| 168283519 | 191064 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 1216 | 32 | 9 | 13 | 3.1 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(C)C)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5187345 | 191064 | 0 | None | - | 1 | Human | 7.2 | pKd | = | 7.2 | Binding | ChEMBL | 1216 | 32 | 9 | 13 | 3.1 | Cc1cc(C)n2c1C=C1C=CC(/C=C/c3ccc(OCC(=O)NCCCC[C@H](NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCN4CCC(Oc5ccccc5Cc5ccccc5)CC4)C(C)C)C(N)=O)cc3)=[N+]1[B-]2(F)F | 10.1021/acs.jmedchem.2c00125 | |||
| 168295200 | 192389 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1321 | 33 | 10 | 15 | 5.0 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5207609 | 192389 | 0 | None | - | 1 | Human | 8.2 | pKd | = | 8.2 | Binding | ChEMBL | 1321 | 33 | 10 | 15 | 5.0 | C[C@@H](O)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168276508 | 190266 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 1140 | 28 | 6 | 11 | 6.9 | C[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)NCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1 | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5175488 | 190266 | 0 | None | - | 1 | Human | 8.1 | pKd | = | 8.1 | Binding | ChEMBL | 1140 | 28 | 6 | 11 | 6.9 | C[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)NCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1 | 10.1021/acs.jmedchem.2c00125 | |||
| 2200 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.ejmech.2018.04.043 | |||
| CHEMBL1256819 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.ejmech.2018.04.043 | |||
| CHEMBL1305 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.ejmech.2018.04.043 | |||
| 1605 | 2342 | 117 | None | 1 | 4 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2015.02.037 | |||
| 3957 | 2342 | 117 | None | 1 | 4 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2015.02.037 | |||
| 7216 | 2342 | 117 | None | 1 | 4 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2015.02.037 | |||
| CHEMBL998 | 2342 | 117 | None | 1 | 4 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2015.02.037 | |||
| DB00455 | 2342 | 117 | None | 1 | 4 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2015.02.037 | |||
| 2200 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2019.02.020 | |||
| CHEMBL1256819 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2019.02.020 | |||
| CHEMBL1305 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2019.02.020 | |||
| 2200 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL1256819 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL1305 | 20203 | 61 | None | 26 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| 168296109 | 192423 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 1155 | 29 | 7 | 11 | 5.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208169 | 192423 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 1155 | 29 | 7 | 11 | 5.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 155567030 | 176417 | 0 | None | -21 | 4 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 337 | 8 | 0 | 2 | 5.8 | c1ccc(-c2ccc(OCCCCCN3CCCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL4586133 | 176417 | 0 | None | -21 | 4 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 337 | 8 | 0 | 2 | 5.8 | c1ccc(-c2ccc(OCCCCCN3CCCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL4596108 | 176417 | 0 | None | -21 | 4 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 337 | 8 | 0 | 2 | 5.8 | c1ccc(-c2ccc(OCCCCCN3CCCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| 168296109 | 192423 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 1155 | 29 | 7 | 11 | 5.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5208169 | 192423 | 0 | None | - | 1 | Human | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 1155 | 29 | 7 | 11 | 5.6 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 1278 | 2150 | 84 | None | -288 | 8 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmc.2019.02.020 | |||
| 1279 | 2150 | 84 | None | -288 | 8 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmc.2019.02.020 | |||
| 4908365 | 2150 | 84 | None | -288 | 8 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmc.2019.02.020 | |||
| CHEMBL129198 | 2150 | 84 | None | -288 | 8 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmc.2019.02.020 | |||
| 155540474 | 176273 | 0 | None | -10 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 479 | 16 | 3 | 4 | 4.7 | N=C(NCCCCN1CCN(CCCCCCCOc2ccccc2)CC1)NCc1ccccc1 | 10.1039/C8MD00527C | |||
| CHEMBL4482871 | 176273 | 0 | None | -10 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 479 | 16 | 3 | 4 | 4.7 | N=C(NCCCCN1CCN(CCCCCCCOc2ccccc2)CC1)NCc1ccccc1 | 10.1039/C8MD00527C | |||
| CHEMBL4595050 | 176273 | 0 | None | -10 | 2 | Guinea pig | 7.1 | pKd | = | 7.1 | Binding | ChEMBL | 479 | 16 | 3 | 4 | 4.7 | N=C(NCCCCN1CCN(CCCCCCCOc2ccccc2)CC1)NCc1ccccc1 | 10.1039/C8MD00527C | |||
| 10873565 | 37836 | 0 | None | -1584 | 3 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 423 | 9 | 1 | 4 | 5.8 | Clc1ccc2c(NCCc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| CHEMBL14587 | 37836 | 0 | None | -1584 | 3 | Guinea pig | 6.1 | pKd | = | 6.1 | Binding | ChEMBL | 423 | 9 | 1 | 4 | 5.8 | Clc1ccc2c(NCCc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1 | 10.1021/jm0110845 | |||
| 11048988 | 40949 | 0 | None | -3981 | 3 | Guinea pig | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 471 | 11 | 1 | 4 | 6.8 | c1ccc2c(NCCCCc3ccc(OCCCN4CCCCC4)cc3)c3c(nc2c1)CCCC3 | 10.1021/jm0110845 | |||
| CHEMBL14868 | 40949 | 0 | None | -3981 | 3 | Guinea pig | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 471 | 11 | 1 | 4 | 6.8 | c1ccc2c(NCCCCc3ccc(OCCCN4CCCCC4)cc3)c3c(nc2c1)CCCC3 | 10.1021/jm0110845 | |||
| 11046028 | 152538 | 0 | None | -144 | 3 | Guinea pig | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 338 | 6 | 1 | 4 | 4.5 | C/C(=N\O)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| CHEMBL39716 | 152538 | 0 | None | -144 | 3 | Guinea pig | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 338 | 6 | 1 | 4 | 4.5 | C/C(=N\O)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| 11089134 | 21404 | 0 | None | -151 | 3 | Guinea pig | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 341 | 7 | 2 | 3 | 4.4 | O=C(NC(c1ccccc1)C1CCCCC1)OCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| CHEMBL131476 | 21404 | 0 | None | -151 | 3 | Guinea pig | 5.1 | pKd | = | 5.1 | Binding | ChEMBL | 341 | 7 | 2 | 3 | 4.4 | O=C(NC(c1ccccc1)C1CCCCC1)OCCCc1c[nH]cn1 | 10.1021/jm020910m | |||
| 9866657 | 12018 | 0 | None | -512 | 3 | Guinea pig | 5.0 | pKd | = | 5.0 | Binding | ChEMBL | 309 | 6 | 0 | 3 | 4.1 | CC(=O)c1ccc(OCc2ccc(CN3CCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| CHEMBL1183328 | 12018 | 0 | None | -512 | 3 | Guinea pig | 5.0 | pKd | = | 5.0 | Binding | ChEMBL | 309 | 6 | 0 | 3 | 4.1 | CC(=O)c1ccc(OCc2ccc(CN3CCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| CHEMBL290613 | 12018 | 0 | None | -512 | 3 | Guinea pig | 5.0 | pKd | = | 5.0 | Binding | ChEMBL | 309 | 6 | 0 | 3 | 4.1 | CC(=O)c1ccc(OCc2ccc(CN3CCCC3)cc2)cc1 | 10.1021/jm021084k | |||
| 26987 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| 6063 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| 671 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| CHEMBL1626 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| DB00283 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | nan | |||
| 3158 | 56267 | 27 | None | 40 | 20 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | nan | |||
| CHEMBL1628227 | 56267 | 27 | None | 40 | 20 | Human | 10.2 | pKi | = | 10.2 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | nan | |||
| 15749406 | 12274 | 0 | None | - | 1 | Guinea pig | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 293 | 3 | 0 | 2 | 4.3 | Cc1ccc2c(c1)/C(=C/CCN(C)C)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| CHEMBL1184758 | 12274 | 0 | None | - | 1 | Guinea pig | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 293 | 3 | 0 | 2 | 4.3 | Cc1ccc2c(c1)/C(=C/CCN(C)C)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| CHEMBL366965 | 12274 | 0 | None | - | 1 | Guinea pig | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 293 | 3 | 0 | 2 | 4.3 | Cc1ccc2c(c1)/C(=C/CCN(C)C)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 9.9 | pKi | = | 9.9 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | nan | |||
| 135 | 2532 | 43 | None | -1 | 58 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | nan | |||
| 1225 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 10.1021/acs.jmedchem.2c00125 | |||
| 3958 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 10.1021/acs.jmedchem.2c00125 | |||
| 667477 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL860 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 10.1021/acs.jmedchem.2c00125 | |||
| DB01142 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 10.1021/acs.jmedchem.2c00125 | |||
| 3158 | 56267 | 27 | None | 40 | 20 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1021/jm2011589 | |||
| CHEMBL1628227 | 56267 | 27 | None | 40 | 20 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1021/jm2011589 | |||
| 1238 | 203174 | 24 | None | -38 | 16 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 344 | 1 | 0 | 3 | 4.3 | CN1CCN(C2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm100652h | |||
| CHEMBL64249 | 203174 | 24 | None | -38 | 16 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 344 | 1 | 0 | 3 | 4.3 | CN1CCN(C2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm100652h | |||
| 3158 | 56267 | 27 | None | 40 | 20 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL1628227 | 56267 | 27 | None | 40 | 20 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1021/acs.jmedchem.6b00981 | |||
| 46884735 | 7973 | 0 | None | 11481 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 316 | 5 | 0 | 3 | 4.3 | C[C@H](C1=C(CCN(C)C)Cc2cc(F)ccc21)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090527 | 7973 | 0 | None | 11481 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 316 | 5 | 0 | 3 | 4.3 | C[C@H](C1=C(CCN(C)C)Cc2cc(F)ccc21)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| 135398745 | 2914 | 112 | None | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm010982y | |||
| 47 | 2914 | 112 | None | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm010982y | |||
| CHEMBL715 | 2914 | 112 | None | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm010982y | |||
| DB00334 | 2914 | 112 | None | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm010982y | |||
| 1530 | 2182 | 50 | None | 5 | 21 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00089a020 | |||
| 3827 | 2182 | 50 | None | 5 | 21 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00089a020 | |||
| 7206 | 2182 | 50 | None | 5 | 21 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00089a020 | |||
| CHEMBL534 | 2182 | 50 | None | 5 | 21 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00089a020 | |||
| DB00920 | 2182 | 50 | None | 5 | 21 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1021/jm00089a020 | |||
| 71452601 | 84207 | 0 | None | 100 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 434 | 8 | 1 | 5 | 4.5 | N#Cc1cccc(OC[C@@H](O)CCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208424 | 84207 | 0 | None | 100 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 434 | 8 | 1 | 5 | 4.5 | N#Cc1cccc(OC[C@@H](O)CCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 2286 | 3183 | 51 | None | -2 | 30 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| 4927 | 3183 | 51 | None | -2 | 30 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| 7282 | 3183 | 51 | None | -2 | 30 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| CHEMBL643 | 3183 | 51 | None | -2 | 30 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| DB01069 | 3183 | 51 | None | -2 | 30 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | nan | |||
| 1201549 | 597 | 24 | None | -1 | 20 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 333 | 597 | 24 | None | -1 | 20 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 7601 | 597 | 24 | None | -1 | 20 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL1201203 | 597 | 24 | None | -1 | 20 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL438151 | 597 | 24 | None | -1 | 20 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| DB00245 | 597 | 24 | None | -1 | 20 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 31843 | 163565 | 83 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 324 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL420316 | 163565 | 83 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 324 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4551989 | 163565 | 83 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 324 | 0 | 0 | 2 | 4.4 | CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 2284 | 3182 | 33 | None | 1 | 29 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| 4926 | 3182 | 33 | None | 1 | 29 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| 7281 | 3182 | 33 | None | 1 | 29 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| CHEMBL564 | 3182 | 33 | None | 1 | 29 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| DB00420 | 3182 | 33 | None | 1 | 29 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | nan | |||
| 12963076 | 196625 | 4 | None | 162 | 7 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm900933k | |||
| CHEMBL564226 | 196625 | 4 | None | 162 | 7 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm900933k | |||
| 10315110 | 171857 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 338 | 1 | 0 | 2 | 4.8 | CCN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4469024 | 171857 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 338 | 1 | 0 | 2 | 4.8 | CCN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 277 | 1301 | 62 | None | -2 | 50 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| 2913 | 1301 | 62 | None | -2 | 50 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| 765 | 1301 | 62 | None | -2 | 50 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| CHEMBL516 | 1301 | 62 | None | -2 | 50 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| DB00434 | 1301 | 62 | None | -2 | 50 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | nan | |||
| 9839050 | 112379 | 0 | None | 1 | 9 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@H]1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL329566 | 112379 | 0 | None | 1 | 9 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@H]1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1021/jm049632c | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | nan | |||
| 12963076 | 196625 | 4 | None | 162 | 7 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| CHEMBL564226 | 196625 | 4 | None | 162 | 7 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| 15749404 | 203414 | 3 | None | - | 1 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 323 | 5 | 1 | 3 | 3.5 | CN(C)CC/C=C1\c2ccccc2COc2ccc(CCO)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL65612 | 203414 | 3 | None | - | 1 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 323 | 5 | 1 | 3 | 3.5 | CN(C)CC/C=C1\c2ccccc2COc2ccc(CCO)cc21 | 10.1021/jm00089a020 | |||
| 10333104 | 119589 | 0 | None | 43 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 265 | 4 | 0 | 1 | 4.1 | CN(C)CCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL346230 | 119589 | 0 | None | 43 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 265 | 4 | 0 | 1 | 4.1 | CN(C)CCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 11832931 | 161791 | 1 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 283 | 3 | 1 | 2 | 3.0 | Cc1[nH]cnc1CCC(=O)N1CC(C)(C)c2ccccc21 | 10.1016/S0960-894X(00)80418-7 | |||
| CHEMBL414174 | 161791 | 1 | None | - | 1 | Rat | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 283 | 3 | 1 | 2 | 3.0 | Cc1[nH]cnc1CCC(=O)N1CC(C)(C)c2ccccc21 | 10.1016/S0960-894X(00)80418-7 | |||
| 2435 | 3590 | 83 | None | -95 | 48 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm100652h | |||
| 60149 | 3590 | 83 | None | -95 | 48 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm100652h | |||
| 98 | 3590 | 83 | None | -95 | 48 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm100652h | |||
| CHEMBL12713 | 3590 | 83 | None | -95 | 48 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm100652h | |||
| DB06144 | 3590 | 83 | None | -95 | 48 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm100652h | |||
| 44401164 | 69816 | 0 | None | -2 | 9 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL193639 | 69816 | 0 | None | -2 | 9 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 277 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| 2913 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| 765 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| CHEMBL516 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| DB00434 | 1301 | 62 | None | 2 | 50 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 10.1021/jm00017a019 | |||
| 9839050 | 112379 | 0 | None | 1 | 9 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@H]1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL329566 | 112379 | 0 | None | 1 | 9 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@H]1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 180 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| 200 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| 2160 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| CHEMBL629 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| DB00321 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | nan | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 42631003 | 199618 | 13 | None | -2 | 8 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 304 | 3 | 0 | 2 | 4.2 | Cc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.ejmech.2022.114464 | |||
| CHEMBL592752 | 199618 | 13 | None | -2 | 8 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 304 | 3 | 0 | 2 | 4.2 | Cc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 | 10.1016/j.ejmech.2022.114464 | |||
| 44247803 | 196086 | 0 | None | -4 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 295 | 5 | 0 | 1 | 4.3 | CN(C)CCC1=C(Cc2ccc(F)cc2)c2ccccc2C1 | 10.1021/jm900933k | |||
| CHEMBL560741 | 196086 | 0 | None | -4 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 295 | 5 | 0 | 1 | 4.3 | CN(C)CCC1=C(Cc2ccc(F)cc2)c2ccccc2C1 | 10.1021/jm900933k | |||
| 44401164 | 69816 | 0 | None | -2 | 9 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL193639 | 69816 | 0 | None | -2 | 9 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 103 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm0002432 | |||
| 2875 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm0002432 | |||
| 5736 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm0002432 | |||
| CHEMBL285802 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm0002432 | |||
| DB09225 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm0002432 | |||
| 44326705 | 112323 | 0 | None | 5 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@@H]1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL329268 | 112323 | 0 | None | 5 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@@H]1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 15749405 | 101063 | 14 | None | - | 1 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 323 | 5 | 1 | 3 | 3.5 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CCO)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL294777 | 101063 | 14 | None | - | 1 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 323 | 5 | 1 | 3 | 3.5 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CCO)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL5270515 | 194609 | 0 | None | 39 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.6 | CCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315265 | 194609 | 0 | None | 39 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 452 | 8 | 1 | 5 | 3.6 | CCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 155519275 | 170433 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 364 | 2 | 0 | 2 | 5.1 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4448535 | 170433 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 364 | 2 | 0 | 2 | 5.1 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 9839081 | 111646 | 0 | None | 1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)C[C@@H]1C[C@@H]2c3ccccc3Cc3ccccc3N2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL328573 | 111646 | 0 | None | 1 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 294 | 2 | 0 | 3 | 3.4 | CN(C)C[C@@H]1C[C@@H]2c3ccccc3Cc3ccccc3N2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 21855 | 84246 | 42 | None | 7 | 6 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | CC(C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| CHEMBL22108 | 84246 | 42 | None | 7 | 6 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | CC(C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| 44326319 | 207211 | 0 | None | 9 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)CC1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL92667 | 207211 | 0 | None | 9 | 3 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)CC1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 46884734 | 7972 | 0 | None | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 341 | 6 | 0 | 4 | 3.7 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(F)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090526 | 7972 | 0 | None | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 341 | 6 | 0 | 4 | 3.7 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(F)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| 46884734 | 7972 | 0 | None | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 341 | 6 | 0 | 4 | 3.7 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(F)ccc21 | 10.1016/j.bmcl.2010.07.117 | |||
| CHEMBL1090526 | 7972 | 0 | None | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 341 | 6 | 0 | 4 | 3.7 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(F)ccc21 | 10.1016/j.bmcl.2010.07.117 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | nan | |||
| CHEMBL5269671 | 194600 | 0 | None | 44 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 466 | 9 | 1 | 5 | 4.0 | CCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315170 | 194600 | 0 | None | 44 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 466 | 9 | 1 | 5 | 4.0 | CCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5272034 | 194611 | 0 | None | 10 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315277 | 194611 | 0 | None | 10 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5286701 | 194629 | 0 | None | 12 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.3 | COCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315483 | 194629 | 0 | None | 12 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 482 | 10 | 1 | 6 | 3.3 | COCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 155567541 | 175992 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 378 | 2 | 0 | 2 | 5.5 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4588983 | 175992 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 378 | 2 | 0 | 2 | 5.5 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 46884666 | 8286 | 0 | None | 3019 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 298 | 5 | 0 | 3 | 4.2 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092598 | 8286 | 0 | None | 3019 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 298 | 5 | 0 | 3 | 4.2 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| 11515387 | 8301 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 327 | 6 | 0 | 4 | 3.1 | COc1nccnc1CC1=C(CCN(C)C)Cc2cc(F)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092651 | 8301 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 327 | 6 | 0 | 4 | 3.1 | COc1nccnc1CC1=C(CCN(C)C)Cc2cc(F)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| 652557 | 59458 | 13 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 330 | 6 | 1 | 5 | 2.3 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1nccs1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL1712377 | 59458 | 13 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 330 | 6 | 1 | 5 | 2.3 | O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1nccs1 | 10.1021/acs.jmedchem.8b00718 | |||
| 11759212 | 57892 | 0 | None | 40 | 6 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 326 | 5 | 0 | 2 | 4.8 | CC(C1=C(CCN(C)C)Cc2cc(Cl)ccc21)c1ccccn1 | 10.1021/jm020895l | |||
| CHEMBL167223 | 57892 | 0 | None | 40 | 6 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 326 | 5 | 0 | 2 | 4.8 | CC(C1=C(CCN(C)C)Cc2cc(Cl)ccc21)c1ccccn1 | 10.1021/jm020895l | |||
| 135 | 2532 | 43 | None | -1 | 58 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 44247935 | 196577 | 0 | None | -2 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 294 | 5 | 0 | 3 | 4.1 | C[C@@H](c1ccccn1)c1c(CCN(C)C)oc2ccccc12 | 10.1021/jm900933k | |||
| CHEMBL563920 | 196577 | 0 | None | -2 | 3 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 294 | 5 | 0 | 3 | 4.1 | C[C@@H](c1ccccn1)c1c(CCN(C)C)oc2ccccc12 | 10.1021/jm900933k | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | nan | |||
| 46865650 | 8285 | 0 | None | 3715 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 323 | 6 | 0 | 4 | 3.6 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2ccccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092597 | 8285 | 0 | None | 3715 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 323 | 6 | 0 | 4 | 3.6 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2ccccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| 163091 | 494 | 34 | None | -6 | 10 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 285 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)[C@H]1CN(C[C@@H]1c1c(O2)cccc1)C | 10.1016/j.bmcl.2020.127681 | |||
| 22 | 494 | 34 | None | -6 | 10 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 285 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)[C@H]1CN(C[C@@H]1c1c(O2)cccc1)C | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL504548 | 494 | 34 | None | -6 | 10 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 285 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)[C@H]1CN(C[C@@H]1c1c(O2)cccc1)C | 10.1016/j.bmcl.2020.127681 | |||
| 68168663 | 175695 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 1 | 0 | 2 | 5.1 | CC(C)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4582006 | 175695 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 1 | 0 | 2 | 5.1 | CC(C)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 15662541 | 67772 | 0 | None | - | 1 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 322 | 2 | 0 | 3 | 4.8 | c1ccc2c(c1)Sc1ccccc1N2CC12CCN(CC1)CC2 | 10.1021/jm00017a019 | |||
| CHEMBL1908311 | 67772 | 0 | None | - | 1 | Guinea pig | 9.0 | pKi | = | 9 | Binding | ChEMBL | 322 | 2 | 0 | 3 | 4.8 | c1ccc2c(c1)Sc1ccccc1N2CC12CCN(CC1)CC2 | 10.1021/jm00017a019 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm401958n | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm401958n | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm401958n | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm401958n | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm401958n | |||
| 4011 | 82408 | 49 | None | 6 | 24 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | nan | |||
| CHEMBL21731 | 82408 | 49 | None | 6 | 24 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | nan | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm049632c | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm049632c | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm049632c | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm049632c | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm049632c | |||
| 180 | 401 | 56 | None | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| 200 | 401 | 56 | None | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| 2160 | 401 | 56 | None | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL629 | 401 | 56 | None | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| DB00321 | 401 | 56 | None | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| 6761 | 67799 | 19 | None | -1 | 18 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 401 | 5 | 1 | 4 | 4.5 | NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 | nan | |||
| CHEMBL1909072 | 67799 | 19 | None | -1 | 18 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 401 | 5 | 1 | 4 | 4.5 | NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 | nan | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | nan | |||
| 44326442 | 107120 | 0 | None | 14 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 366 | 2 | 0 | 4 | 4.0 | CN1CCN(CC2C[C@@H]3c4ccccc4Sc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL316068 | 107120 | 0 | None | 14 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 366 | 2 | 0 | 4 | 4.0 | CN1CCN(CC2C[C@@H]3c4ccccc4Sc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm049632c | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm049632c | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm049632c | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm049632c | |||
| 44401106 | 124327 | 0 | None | -1 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL363581 | 124327 | 0 | None | -1 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 44290349 | 178537 | 0 | None | 131 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 2.1 | O=C(c1ccc(F)cc1)C1CCN(CCn2c(=O)[nH]c3cc(O)ccc3c2=O)CC1 | 10.1021/jm00159a017 | |||
| CHEMBL46683 | 178537 | 0 | None | 131 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 411 | 5 | 2 | 6 | 2.1 | O=C(c1ccc(F)cc1)C1CCN(CCn2c(=O)[nH]c3cc(O)ccc3c2=O)CC1 | 10.1021/jm00159a017 | |||
| 2267 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| 271 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| 7121 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL639 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| DB00972 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5273244 | 194616 | 0 | None | 63 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 2.9 | COCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315364 | 194616 | 0 | None | 63 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 468 | 9 | 1 | 6 | 2.9 | COCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 155536963 | 172238 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 392 | 2 | 0 | 2 | 5.9 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4474226 | 172238 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 392 | 2 | 0 | 2 | 5.9 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b00981 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b00981 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b00981 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b00981 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/acs.jmedchem.6b00981 | |||
| 46884733 | 7911 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 353 | 7 | 0 | 5 | 3.6 | COc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1nccnc1OC | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090186 | 7911 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 353 | 7 | 0 | 5 | 3.6 | COc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1nccnc1OC | 10.1016/j.bmcl.2010.02.055 | |||
| 44247806 | 195668 | 2 | None | 14454 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL556506 | 195668 | 2 | None | 14454 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| 44247806 | 195668 | 2 | None | 14454 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL556506 | 195668 | 2 | None | 14454 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 45272894 | 195655 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 375 | 4 | 0 | 5 | 4.3 | Fc1ccc(Cn2c(N3CCC(n4ccnc4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL556449 | 195655 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 375 | 4 | 0 | 5 | 4.3 | Fc1ccc(Cn2c(N3CCC(n4ccnc4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 44247806 | 195668 | 2 | None | 14454 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1021/jm900933k | |||
| CHEMBL556506 | 195668 | 2 | None | 14454 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1021/jm900933k | |||
| 46884670 | 8223 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 3.6 | CN(C)CCC1=C(Cc2cnccn2)c2ccc(Cl)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092259 | 8223 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 3.6 | CN(C)CCC1=C(Cc2cnccn2)c2ccc(Cl)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| 11702114 | 8299 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 297 | 5 | 0 | 3 | 3.1 | CN(C)CCC1=C(Cc2cnccn2)c2ccc(F)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092649 | 8299 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 297 | 5 | 0 | 3 | 3.1 | CN(C)CCC1=C(Cc2cnccn2)c2ccc(F)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| 11186523 | 127511 | 0 | None | 1 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@H]1C[C@@H]2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL366164 | 127511 | 0 | None | 1 | 9 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.5 | CN(C)C[C@H]1C[C@@H]2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 1027 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 3241 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 7176 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| CHEMBL1106 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| DB00751 | 1576 | 73 | None | 6 | 2 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 10.1021/jm00017a019 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| 46884698 | 8300 | 0 | None | 1318 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 343 | 6 | 0 | 4 | 3.6 | COc1nccnc1CC1=C(CCN(C)C)Cc2cc(Cl)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092650 | 8300 | 0 | None | 1318 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 343 | 6 | 0 | 4 | 3.6 | COc1nccnc1CC1=C(CCN(C)C)Cc2cc(Cl)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| 45272876 | 196503 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 348 | 4 | 0 | 4 | 3.9 | Cc1ccc(Cn2c(N3CCC(N(C)C)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL563451 | 196503 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 348 | 4 | 0 | 4 | 3.9 | Cc1ccc(Cn2c(N3CCC(N(C)C)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 44247806 | 195668 | 2 | None | 14454 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.07.117 | |||
| CHEMBL556506 | 195668 | 2 | None | 14454 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.5 | C[C@H](C1=C(CCN(C)C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.07.117 | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.9b00447 | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.9b00447 | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.9b00447 | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1021/acs.jmedchem.9b00447 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2013.01.025 | |||
| 1228 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/np50094a001 | |||
| 2763 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/np50094a001 | |||
| 5282443 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/np50094a001 | |||
| CHEMBL855 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/np50094a001 | |||
| DB00427 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/np50094a001 | |||
| 1816 | 2540 | 102 | None | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1021/jm049632c | |||
| 4205 | 2540 | 102 | None | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1021/jm049632c | |||
| 7241 | 2540 | 102 | None | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1021/jm049632c | |||
| CHEMBL654 | 2540 | 102 | None | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1021/jm049632c | |||
| DB00370 | 2540 | 102 | None | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | 10.1021/jm049632c | |||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| 249 | 505 | 81 | None | -4 | 42 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | nan | |||
| 1228 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| 2763 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| 5282443 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| CHEMBL855 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| DB00427 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 10.1021/jm00017a019 | |||
| 4011 | 82408 | 49 | None | 6 | 24 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL21731 | 82408 | 49 | None | 6 | 24 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | 10.1016/j.bmcl.2008.09.012 | |||
| 11702115 | 8304 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 297 | 5 | 0 | 3 | 3.1 | CN(C)CCC1=C(Cc2cccnn2)c2ccc(F)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092662 | 8304 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 297 | 5 | 0 | 3 | 3.1 | CN(C)CCC1=C(Cc2cccnn2)c2ccc(F)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| 11695591 | 8321 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | C[C@H](c1cccnc1F)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092765 | 8321 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | C[C@H](c1cccnc1F)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2014.12.045 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2014.12.045 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2014.12.045 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2014.12.045 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2014.12.045 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.ejmech.2014.12.045 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm401895u | |||
| 135 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm049632c | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm049632c | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm049632c | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm049632c | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1021/jm049632c | |||
| 11702115 | 8304 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 297 | 5 | 0 | 3 | 3.1 | CN(C)CCC1=C(Cc2cccnn2)c2ccc(F)cc2C1 | 10.1016/j.bmcl.2010.07.117 | |||
| CHEMBL1092662 | 8304 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 297 | 5 | 0 | 3 | 3.1 | CN(C)CCC1=C(Cc2cccnn2)c2ccc(F)cc2C1 | 10.1016/j.bmcl.2010.07.117 | |||
| 155539495 | 172846 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 394 | 4 | 0 | 2 | 6.2 | CCC(CC)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4514700 | 172846 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 394 | 4 | 0 | 2 | 6.2 | CCC(CC)CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2011.12.019 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2011.12.019 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2011.12.019 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmc.2011.12.019 | |||
| 45272875 | 195844 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 352 | 4 | 0 | 4 | 3.8 | CN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL558467 | 195844 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 352 | 4 | 0 | 4 | 3.8 | CN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 4098 | 32505 | 30 | None | 1 | 11 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | nan | |||
| CHEMBL1255739 | 32505 | 30 | None | 1 | 11 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | nan | |||
| CHEMBL1411979 | 32505 | 30 | None | 1 | 11 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | nan | |||
| 44326125 | 111701 | 0 | None | 8 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 455 | 4 | 0 | 3 | 5.9 | O=C(c1ccc(F)cc1)C1CCN(CC2C[C@@H]3c4ccccc4Cc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL328662 | 111701 | 0 | None | 8 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 455 | 4 | 0 | 3 | 5.9 | O=C(c1ccc(F)cc1)C1CCN(CC2C[C@@H]3c4ccccc4Cc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| 2726 | 919 | 68 | None | -2 | 72 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| 621 | 919 | 68 | None | -2 | 72 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| 83 | 919 | 68 | None | -2 | 72 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| CHEMBL71 | 919 | 68 | None | -2 | 72 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| DB00477 | 919 | 68 | None | -2 | 72 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | nan | |||
| 134135966 | 154445 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 281 | 4 | 0 | 2 | 3.8 | CN1CCC(Oc2ccccc2Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3906929 | 154445 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 281 | 4 | 0 | 2 | 3.8 | CN1CCC(Oc2ccccc2Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3990109 | 154445 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 281 | 4 | 0 | 2 | 3.8 | CN1CCC(Oc2ccccc2Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| 18715379 | 9143 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 430 | 0 | 0 | 2 | 5.0 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(Br)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL11001 | 9143 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 430 | 0 | 0 | 2 | 5.0 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(Br)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 10177103 | 171347 | 0 | None | 12 | 2 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 368 | 9 | 1 | 3 | 4.5 | CN(CCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL446147 | 171347 | 0 | None | 12 | 2 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 368 | 9 | 1 | 3 | 4.5 | CN(CCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL5291469 | 194640 | 0 | None | 70 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 508 | 8 | 1 | 6 | 3.6 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCOCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315702 | 194640 | 0 | None | 70 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 508 | 8 | 1 | 6 | 3.6 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCOCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 14127193 | 11286 | 0 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.4 | CCN(CC)CC/C=C1/c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL1179179 | 11286 | 0 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.4 | CCN(CC)CC/C=C1/c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL63596 | 11286 | 0 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.4 | CCN(CC)CC/C=C1/c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C2MD00311B | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C2MD00311B | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C2MD00311B | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C2MD00311B | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C2MD00311B | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1039/C2MD00311B | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1039/C2MD00311B | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1039/C2MD00311B | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1039/C2MD00311B | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1039/C2MD00311B | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1039/C2MD00311B | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1039/C2MD00311B | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1039/C2MD00311B | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1039/C2MD00311B | |||
| 1427 | 2013 | 54 | None | -5 | 27 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2020.127493 | |||
| 357 | 2013 | 54 | None | -5 | 27 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2020.127493 | |||
| 3696 | 2013 | 54 | None | -5 | 27 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2020.127493 | |||
| CHEMBL11 | 2013 | 54 | None | -5 | 27 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2020.127493 | |||
| DB00458 | 2013 | 54 | None | -5 | 27 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1016/j.bmcl.2020.127493 | |||
| 1524 | 2181 | 96 | None | -2 | 52 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/acs.jmedchem.2c00633 | |||
| 197 | 2181 | 96 | None | -2 | 52 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/acs.jmedchem.2c00633 | |||
| 3822 | 2181 | 96 | None | -2 | 52 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/acs.jmedchem.2c00633 | |||
| 88 | 2181 | 96 | None | -2 | 52 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/acs.jmedchem.2c00633 | |||
| CHEMBL51 | 2181 | 96 | None | -2 | 52 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/acs.jmedchem.2c00633 | |||
| DB12465 | 2181 | 96 | None | -2 | 52 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | 10.1021/acs.jmedchem.2c00633 | |||
| 69260079 | 81306 | 2 | None | 63 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.8 | O=C(O)c1cccnc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158834 | 81306 | 2 | None | 63 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.8 | O=C(O)c1cccnc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 17867053 | 99010 | 0 | None | 10 | 3 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 435 | 5 | 0 | 5 | 4.3 | Cn1c(=O)sc2cc(CCN3CCN(Cc4ccc(Cl)cc4Cl)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL280063 | 99010 | 0 | None | 10 | 3 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 435 | 5 | 0 | 5 | 4.3 | Cn1c(=O)sc2cc(CCN3CCN(Cc4ccc(Cl)cc4Cl)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 59296066 | 84093 | 0 | None | -5 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 487 | 7 | 3 | 5 | 3.0 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207663 | 84093 | 0 | None | -5 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 487 | 7 | 3 | 5 | 3.0 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| 59295938 | 84094 | 0 | None | -7 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 521 | 7 | 3 | 5 | 3.6 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)cc3C(F)(F)F)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207664 | 84094 | 0 | None | -7 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 521 | 7 | 3 | 5 | 3.6 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)cc3C(F)(F)F)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| 11335419 | 67100 | 1 | None | 11 | 6 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 295 | 7 | 0 | 2 | 4.1 | c1ccc(Cc2ccccc2OCCCN2CCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL187367 | 67100 | 1 | None | 11 | 6 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 295 | 7 | 0 | 2 | 4.1 | c1ccc(Cc2ccccc2OCCCN2CCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 15662541 | 67772 | 0 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 322 | 2 | 0 | 3 | 4.8 | c1ccc2c(c1)Sc1ccccc1N2CC12CCN(CC1)CC2 | 10.1021/jm00017a019 | |||
| CHEMBL1908311 | 67772 | 0 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 322 | 2 | 0 | 3 | 4.8 | c1ccc2c(c1)Sc1ccccc1N2CC12CCN(CC1)CC2 | 10.1021/jm00017a019 | |||
| 44450154 | 95836 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 311 | 4 | 1 | 4 | 2.7 | c1ccc([C@@H](Oc2cccc3c2OCC3)[C@H]2CNCCO2)cc1 | 10.1016/j.bmcl.2008.03.050 | |||
| CHEMBL258930 | 95836 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 311 | 4 | 1 | 4 | 2.7 | c1ccc([C@@H](Oc2cccc3c2OCC3)[C@H]2CNCCO2)cc1 | 10.1016/j.bmcl.2008.03.050 | |||
| 44449768 | 96023 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 317 | 5 | 1 | 4 | 2.9 | COc1cc(F)ccc1O[C@H](c1ccccc1)[C@H]1CNCCO1 | 10.1016/j.bmcl.2008.03.050 | |||
| CHEMBL259765 | 96023 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 317 | 5 | 1 | 4 | 2.9 | COc1cc(F)ccc1O[C@H](c1ccccc1)[C@H]1CNCCO1 | 10.1016/j.bmcl.2008.03.050 | |||
| 44450212 | 96219 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 321 | 4 | 1 | 3 | 3.6 | Fc1ccc(O[C@H](c2ccccc2)[C@H]2CNCCO2)c(Cl)c1 | 10.1016/j.bmcl.2008.03.050 | |||
| CHEMBL260823 | 96219 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 321 | 4 | 1 | 3 | 3.6 | Fc1ccc(O[C@H](c2ccccc2)[C@H]2CNCCO2)c(Cl)c1 | 10.1016/j.bmcl.2008.03.050 | |||
| 44450181 | 96743 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 305 | 4 | 1 | 3 | 3.1 | Fc1cccc(O[C@H](c2ccccc2)[C@H]2CNCCO2)c1F | 10.1016/j.bmcl.2008.03.050 | |||
| CHEMBL264418 | 96743 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 305 | 4 | 1 | 3 | 3.1 | Fc1cccc(O[C@H](c2ccccc2)[C@H]2CNCCO2)c1F | 10.1016/j.bmcl.2008.03.050 | |||
| 44450184 | 155676 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 301 | 4 | 1 | 3 | 3.2 | Cc1cc(F)ccc1O[C@H](c1ccccc1)[C@H]1CNCCO1 | 10.1016/j.bmcl.2008.03.050 | |||
| CHEMBL404956 | 155676 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 301 | 4 | 1 | 3 | 3.2 | Cc1cc(F)ccc1O[C@H](c1ccccc1)[C@H]1CNCCO1 | 10.1016/j.bmcl.2008.03.050 | |||
| 10458170 | 116526 | 0 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 487 | 8 | 1 | 4 | 6.0 | O=C(O)Cc1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL336198 | 116526 | 0 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 487 | 8 | 1 | 4 | 6.0 | O=C(O)Cc1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 51039227 | 57760 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 5 | 0 | 3 | 3.5 | FC1CCN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669417 | 57760 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 5 | 0 | 3 | 3.5 | FC1CCN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 22621911 | 9408 | 0 | None | - | 1 | Rat | 7.0 | pKi | = | 7 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(Cl)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL11159 | 9408 | 0 | None | - | 1 | Rat | 7.0 | pKi | = | 7 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(Cl)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1039/C2MD00311B | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C2MD00311B | |||
| 66615705 | 81267 | 0 | None | -19 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1ccc(F)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)cc3Cl)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158779 | 81267 | 0 | None | -19 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1ccc(F)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)cc3Cl)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71453204 | 81270 | 0 | None | -12 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 488 | 8 | 1 | 4 | 5.0 | Cc1cc(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158782 | 81270 | 0 | None | -12 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 488 | 8 | 1 | 4 | 5.0 | Cc1cc(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 71451392 | 81274 | 0 | None | -31 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | C[C@](Cc1ccccc1)(C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158786 | 81274 | 0 | None | -31 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | C[C@](Cc1ccccc1)(C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 68849581 | 81289 | 0 | None | -3 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 478 | 7 | 1 | 5 | 4.4 | O=C(O)C(c1ccccc1)N1CCO[C@H](CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158818 | 81289 | 0 | None | -3 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 478 | 7 | 1 | 5 | 4.4 | O=C(O)C(c1ccccc1)N1CCO[C@H](CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/j.bmcl.2012.08.103 | |||
| 69347575 | 81292 | 0 | None | -10 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)[C@@H](c1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158821 | 81292 | 0 | None | -10 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)[C@@H](c1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072034 | 81308 | 0 | None | -3 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 490 | 8 | 1 | 4 | 5.2 | O=C(O)[C@@H](Cc1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158836 | 81308 | 0 | None | -3 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 490 | 8 | 1 | 4 | 5.2 | O=C(O)[C@@H](Cc1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 127036932 | 137348 | 0 | None | -3 | 22 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 274 | 7 | 1 | 1 | 4.0 | C=CCN(CC=C)CCc1c[nH]c2ccc(Cl)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| CHEMBL3752900 | 137348 | 0 | None | -3 | 22 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 274 | 7 | 1 | 1 | 4.0 | C=CCN(CC=C)CCc1c[nH]c2ccc(Cl)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| 127036953 | 137515 | 0 | None | -10 | 22 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 318 | 7 | 1 | 1 | 4.1 | C=CCN(CC=C)CCc1c[nH]c2ccc(Br)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| CHEMBL3754166 | 137515 | 0 | None | -10 | 22 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 318 | 7 | 1 | 1 | 4.1 | C=CCN(CC=C)CCc1c[nH]c2ccc(Br)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| 59296085 | 84209 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 506 | 8 | 2 | 7 | 3.1 | CS(=O)(=O)c1ccc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)s1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208426 | 84209 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 506 | 8 | 2 | 7 | 3.1 | CS(=O)(=O)c1ccc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)s1 | 10.1016/j.bmcl.2012.09.113 | |||
| 57397301 | 67880 | 0 | None | -13 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 560 | 11 | 1 | 6 | 4.6 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910382 | 67880 | 0 | None | -13 | 3 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 560 | 11 | 1 | 6 | 4.6 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| 12660328 | 13406 | 16 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 241 | 6 | 1 | 2 | 2.9 | CNCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL1192719 | 13406 | 16 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 241 | 6 | 1 | 2 | 2.9 | CNCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3953343 | 13406 | 16 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 241 | 6 | 1 | 2 | 2.9 | CNCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 242 | 470 | 124 | None | -23 | 51 | Guinea pig | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1021/jm070516u | |||
| 34 | 470 | 124 | None | -23 | 51 | Guinea pig | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1021/jm070516u | |||
| 60795 | 470 | 124 | None | -23 | 51 | Guinea pig | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1021/jm070516u | |||
| CHEMBL1112 | 470 | 124 | None | -23 | 51 | Guinea pig | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1021/jm070516u | |||
| DB01238 | 470 | 124 | None | -23 | 51 | Guinea pig | 7.0 | pKi | = | 7 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1021/jm070516u | |||
| 23102733 | 82233 | 0 | None | -1 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 511 | 6 | 1 | 5 | 4.0 | O=C(NS(=O)(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1)c1ccccc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171015 | 82233 | 0 | None | -1 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 511 | 6 | 1 | 5 | 4.0 | O=C(NS(=O)(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1)c1ccccc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 71458869 | 82241 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 506 | 7 | 1 | 5 | 4.6 | O=C(O)COc1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171022 | 82241 | 0 | None | 2 | 2 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 506 | 7 | 1 | 5 | 4.6 | O=C(O)COc1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| 11709314 | 104111 | 0 | None | -100 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 307 | 5 | 0 | 2 | 4.1 | c1ccc(COc2ccc3c(c2)CCN(CC2CC2)CC3)cc1 | 10.1016/j.bmcl.2013.09.089 | |||
| CHEMBL3094114 | 104111 | 0 | None | -100 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 307 | 5 | 0 | 2 | 4.1 | c1ccc(COc2ccc3c(c2)CCN(CC2CC2)CC3)cc1 | 10.1016/j.bmcl.2013.09.089 | |||
| 10067368 | 104132 | 0 | None | -100 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 364 | 6 | 0 | 3 | 4.5 | c1ccc(N2CCc3ccc(OCCCN4CCCCC4)cc3CC2)cc1 | 10.1016/j.bmcl.2013.09.089 | |||
| CHEMBL3094214 | 104132 | 0 | None | -100 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 364 | 6 | 0 | 3 | 4.5 | c1ccc(N2CCc3ccc(OCCCN4CCCCC4)cc3CC2)cc1 | 10.1016/j.bmcl.2013.09.089 | |||
| 10064805 | 102376 | 0 | None | -54 | 4 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 4.4 | CN1CCCC1CCNc1c2c(nc3ccccc13)CCCCC2 | 10.1016/s0960-894x(03)00356-1 | |||
| CHEMBL303824 | 102376 | 0 | None | -54 | 4 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 4.4 | CN1CCCC1CCNc1c2c(nc3ccccc13)CCCCC2 | 10.1016/s0960-894x(03)00356-1 | |||
| 33630 | 178957 | 99 | None | -13 | 28 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| CHEMBL47050 | 178957 | 99 | None | -13 | 28 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| 71454295 | 84079 | 0 | None | -1258 | 7 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 536 | 8 | 0 | 6 | 5.5 | COc1ccccc1N1CCN(Cc2cc(CN3CCN(c4ccccc4OC)CC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| CHEMBL2207641 | 84079 | 0 | None | -1258 | 7 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 536 | 8 | 0 | 6 | 5.5 | COc1ccccc1N1CCN(Cc2cc(CN3CCN(c4ccccc4OC)CC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| 17963199 | 82270 | 0 | None | -1 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 493 | 5 | 1 | 5 | 3.7 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(F)c(F)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171050 | 82270 | 0 | None | -1 | 2 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 493 | 5 | 1 | 5 | 3.7 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(F)c(F)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 25025581 | 201996 | 0 | None | -15 | 8 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 285 | 4 | 1 | 2 | 3.1 | CCOC[C@H]1[C@@H]2CNC[C@@]21c1ccc(Cl)c(Cl)c1 | 10.1021/jm901818u | |||
| CHEMBL608151 | 201996 | 0 | None | -15 | 8 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 285 | 4 | 1 | 2 | 3.1 | CCOC[C@H]1[C@@H]2CNC[C@@]21c1ccc(Cl)c(Cl)c1 | 10.1021/jm901818u | |||
| 10060425 | 54935 | 0 | None | -758 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 245 | 5 | 2 | 3 | 2.6 | O=C(Nc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16142 | 54935 | 0 | None | -758 | 2 | Guinea pig | 5.0 | pKi | = | 5 | Binding | ChEMBL | 245 | 5 | 2 | 3 | 2.6 | O=C(Nc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 14554146 | 119119 | 0 | None | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 354 | 0 | 0 | 2 | 3.9 | CC(=O)N1CCC(=C2c3cc(F)c(F)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL342747 | 119119 | 0 | None | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | ChEMBL | 354 | 0 | 0 | 2 | 3.9 | CC(=O)N1CCC(=C2c3cc(F)c(F)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 44334265 | 109683 | 0 | None | -50 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 368 | 8 | 1 | 6 | 2.0 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3cnccn3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL322695 | 109683 | 0 | None | -50 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 368 | 8 | 1 | 6 | 2.0 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3cnccn3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44304295 | 202869 | 0 | None | -2290 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 357 | 8 | 1 | 5 | 1.5 | O=C1C[C@@H](N2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)CC2)N1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62596 | 202869 | 0 | None | -2290 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 357 | 8 | 1 | 5 | 1.5 | O=C1C[C@@H](N2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)CC2)N1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304331 | 203121 | 0 | None | -2187 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 449 | 11 | 1 | 5 | 3.2 | N[C@H](CCc1ccccc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64059 | 203121 | 0 | None | -2187 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 449 | 11 | 1 | 5 | 3.2 | N[C@H](CCc1ccccc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304303 | 203329 | 0 | None | -776 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 371 | 8 | 1 | 5 | 1.6 | O=C(c1ccc(OCCCN2CCN(C(=O)[C@@H]3CCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64896 | 203329 | 0 | None | -776 | 3 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 371 | 8 | 1 | 5 | 1.6 | O=C(c1ccc(OCCCN2CCN(C(=O)[C@@H]3CCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 26191740 | 151582 | 9 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccc(OC3CCNCC3)cc2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3963375 | 151582 | 9 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccc(OC3CCNCC3)cc2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 11623756 | 8142 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | CC(c1cccnc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091776 | 8142 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | CC(c1cccnc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 10731042 | 98650 | 0 | None | -194 | 2 | Guinea pig | 4.0 | pKi | = | 4 | Binding | ChEMBL | 274 | 6 | 3 | 4 | 1.9 | Nc1ccc(CNC(=O)OCCCc2c[nH]cn2)cc1 | 10.1021/jm9507688 | |||
| CHEMBL277285 | 98650 | 0 | None | -194 | 2 | Guinea pig | 4.0 | pKi | = | 4 | Binding | ChEMBL | 274 | 6 | 3 | 4 | 1.9 | Nc1ccc(CNC(=O)OCCCc2c[nH]cn2)cc1 | 10.1021/jm9507688 | |||
| 44304311 | 200293 | 0 | None | -17378 | 3 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 442 | 10 | 1 | 7 | 2.2 | N[C@H](Cc1nccs1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL59733 | 200293 | 0 | None | -17378 | 3 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 442 | 10 | 1 | 7 | 2.2 | N[C@H](Cc1nccs1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304067 | 201283 | 0 | None | -43651 | 3 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 359 | 9 | 1 | 5 | 1.4 | CNCC(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL60401 | 201283 | 0 | None | -43651 | 3 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 359 | 9 | 1 | 5 | 1.4 | CNCC(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44334521 | 107836 | 0 | None | -85 | 3 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 262 | 6 | 1 | 4 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](N)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL319231 | 107836 | 0 | None | -85 | 3 | Human | 4.0 | pKi | = | 4 | Binding | ChEMBL | 262 | 6 | 1 | 4 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](N)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 118709751 | 113541 | 0 | None | -776 | 10 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.5 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCSc1ccccc1F | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL3321792 | 113541 | 0 | None | -776 | 10 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.5 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCSc1ccccc1F | 10.1016/j.bmcl.2014.07.018 | |||
| 46882664 | 5717 | 0 | None | -2 | 5 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 494 | 8 | 2 | 8 | 3.6 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL1078240 | 5717 | 0 | None | -2 | 5 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 494 | 8 | 2 | 8 | 3.6 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| 11545813 | 181194 | 0 | None | -24 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 400 | 6 | 0 | 3 | 5.2 | O=C(CCCN1C2CCC1CN(c1ccc(Cl)cc1)CC2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL476109 | 181194 | 0 | None | -24 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 400 | 6 | 0 | 3 | 5.2 | O=C(CCCN1C2CCC1CN(c1ccc(Cl)cc1)CC2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 168284748 | 191648 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.7 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5196026 | 191648 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.7 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304308 | 102485 | 0 | None | -40 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 432 | 8 | 0 | 5 | 3.7 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3cccc(F)c3F)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL304027 | 102485 | 0 | None | -40 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 432 | 8 | 0 | 5 | 3.7 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3cccc(F)c3F)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 168284748 | 191648 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.7 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5196026 | 191648 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.7 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304357 | 200610 | 0 | None | -851 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 415 | 9 | 1 | 5 | 3.0 | CC(C)(C)C[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL59931 | 200610 | 0 | None | -851 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 415 | 9 | 1 | 5 | 3.0 | CC(C)(C)C[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 164614907 | 184584 | 0 | None | -323 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 378 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(F)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4848697 | 184584 | 0 | None | -323 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 378 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(F)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 44267109 | 7171 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 366 | 0 | 0 | 2 | 4.6 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3ccc(C)nc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL10855 | 7171 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 366 | 0 | 0 | 2 | 4.6 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3ccc(C)nc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 21830793 | 91835 | 10 | None | -6760 | 45 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 373 | 7 | 0 | 8 | 0.6 | COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1 | 10.1016/j.bmc.2013.05.050 | |||
| CHEMBL2413154 | 91835 | 10 | None | -6760 | 45 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 373 | 7 | 0 | 8 | 0.6 | COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1 | 10.1016/j.bmc.2013.05.050 | |||
| 44304246 | 202651 | 0 | None | -12 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 426 | 11 | 0 | 5 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3occc3C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL61396 | 202651 | 0 | None | -12 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 426 | 11 | 0 | 5 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3occc3C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304310 | 203274 | 0 | None | -141 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 415 | 10 | 0 | 4 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)N3CCCC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64667 | 203274 | 0 | None | -141 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 415 | 10 | 0 | 4 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)N3CCCC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 168281746 | 192882 | 0 | None | -14454 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 365 | 6 | 4 | 5 | 1.6 | CC(NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1cccc(F)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5184911 | 192882 | 0 | None | -14454 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 365 | 6 | 4 | 5 | 1.6 | CC(NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1cccc(F)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221974 | 192882 | 0 | None | -14454 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 365 | 6 | 4 | 5 | 1.6 | CC(NC(=O)/N=C(\N)NCCCc1nnc(N)s1)c1cccc(F)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 71712245 | 110310 | 0 | None | -43651 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 377 | 7 | 0 | 6 | 3.9 | Cc1nnc(-c2cccnc2)n1-c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.ejmech.2014.03.014 | |||
| CHEMBL3238445 | 110310 | 0 | None | -43651 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 377 | 7 | 0 | 6 | 3.9 | Cc1nnc(-c2cccnc2)n1-c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.ejmech.2014.03.014 | |||
| 56835171 | 69740 | 0 | None | -645 | 9 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 295 | 2 | 2 | 6 | 1.9 | Nc1nc(N2CCNCC2)c2ccc(-c3ccco3)cc2n1 | 10.1016/j.bmcl.2011.10.104 | |||
| CHEMBL1935574 | 69740 | 0 | None | -645 | 9 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 295 | 2 | 2 | 6 | 1.9 | Nc1nc(N2CCNCC2)c2ccc(-c3ccco3)cc2n1 | 10.1016/j.bmcl.2011.10.104 | |||
| 132060752 | 162926 | 0 | None | -3 | 4 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 437 | 7 | 0 | 6 | 3.4 | CCOC(=O)CCN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)C3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4174189 | 162926 | 0 | None | -3 | 4 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 437 | 7 | 0 | 6 | 3.4 | CCOC(=O)CCN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)C3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| 44304457 | 203213 | 0 | None | -354 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 376 | 10 | 0 | 5 | 3.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64408 | 203213 | 0 | None | -354 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 376 | 10 | 0 | 5 | 3.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 127026017 | 137358 | 0 | None | 12 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 415 | 5 | 1 | 6 | 3.6 | COc1ccc(CNc2nc3c(c(N4CCN(C)CC4)n2)-c2ccccc2CC3)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752972 | 137358 | 0 | None | 12 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 415 | 5 | 1 | 6 | 3.6 | COc1ccc(CNc2nc3c(c(N4CCN(C)CC4)n2)-c2ccccc2CC3)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| 12192007 | 168408 | 44 | None | -407 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 191 | 2 | 2 | 2 | 0.8 | N[C@@H](C(=O)O)C1Cc2ccccc2C1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL434785 | 168408 | 44 | None | -407 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 191 | 2 | 2 | 2 | 0.8 | N[C@@H](C(=O)O)C1Cc2ccccc2C1 | 10.1016/s0960-894x(02)00310-4 | |||
| 168275750 | 192826 | 0 | None | -72 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 332 | 6 | 3 | 4 | 1.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCc2ccccc2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5175558 | 192826 | 0 | None | -72 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 332 | 6 | 3 | 4 | 1.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCc2ccccc2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221581 | 192826 | 0 | None | -72 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 332 | 6 | 3 | 4 | 1.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCc2ccccc2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 867637 | 55187 | 4 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 291 | 5 | 1 | 4 | 3.0 | C=CCn1c(=N)n(CC(=O)c2ccccc2)c2ccccc21 | 10.1021/jm2011589 | |||
| CHEMBL1617548 | 55187 | 4 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 291 | 5 | 1 | 4 | 3.0 | C=CCn1c(=N)n(CC(=O)c2ccccc2)c2ccccc21 | 10.1021/jm2011589 | |||
| 164612037 | 185377 | 0 | None | -204173 | 20 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 326 | 8 | 4 | 4 | 1.8 | CCCCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4860528 | 185377 | 0 | None | -204173 | 20 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 326 | 8 | 4 | 4 | 1.8 | CCCCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C | 10.1016/j.ejmech.2021.113190 | |||
| 44288874 | 101095 | 0 | None | -107 | 7 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 528 | 7 | 2 | 4 | 4.2 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3F)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL295001 | 101095 | 0 | None | -107 | 7 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 528 | 7 | 2 | 4 | 4.2 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3F)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| 168287539 | 191559 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 392 | 7 | 2 | 4 | 3.7 | CCOc1ccc(F)cc1NC(=O)c1cc(C)ccc1NS(=O)(=O)C1CC1 | 10.1021/acsmedchemlett.2c00100 | |||
| CHEMBL5194692 | 191559 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 392 | 7 | 2 | 4 | 3.7 | CCOc1ccc(F)cc1NC(=O)c1cc(C)ccc1NS(=O)(=O)C1CC1 | 10.1021/acsmedchemlett.2c00100 | |||
| 53326724 | 57753 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 332 | 7 | 0 | 4 | 3.8 | C[C@H](C1=C(CCN(C)CCC#N)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669410 | 57753 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 332 | 7 | 0 | 4 | 3.8 | C[C@H](C1=C(CCN(C)CCC#N)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 23381046 | 66754 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 548 | 10 | 2 | 5 | 4.7 | NC(=O)N(O)CCC#Cc1ccc(OCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL185825 | 66754 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 548 | 10 | 2 | 5 | 4.7 | NC(=O)N(O)CCC#Cc1ccc(OCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 168269382 | 189920 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 818 | 21 | 6 | 8 | 3.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5169902 | 189920 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 818 | 21 | 6 | 8 | 3.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304438 | 203168 | 0 | None | -100 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 420 | 13 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)CSCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64235 | 203168 | 0 | None | -100 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 420 | 13 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)CSCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 3570228 | 69033 | 67 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 213 | 4 | 1 | 2 | 3.0 | NCCc1ccccc1Oc1ccccc1 | 10.1021/jm2011589 | |||
| CHEMBL1923535 | 69033 | 67 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 213 | 4 | 1 | 2 | 3.0 | NCCc1ccccc1Oc1ccccc1 | 10.1021/jm2011589 | |||
| 141485890 | 173280 | 0 | None | - | 1 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 331 | 6 | 0 | 4 | 1.7 | CCN1CCN(CCCOc2ccc3c(c2)C(=O)N(C)CC3)CC1 | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4525456 | 173280 | 0 | None | - | 1 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 331 | 6 | 0 | 4 | 1.7 | CCN1CCN(CCCOc2ccc3c(c2)C(=O)N(C)CC3)CC1 | 10.1016/j.bmcl.2019.04.015 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| 15749427 | 102059 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm300682j | |||
| CHEMBL302005 | 102059 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm300682j | |||
| 191 | 403 | 98 | None | -56 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| 201 | 403 | 98 | None | -56 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| 2170 | 403 | 98 | None | -56 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| CHEMBL1113 | 403 | 98 | None | -56 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| DB00543 | 403 | 98 | None | -56 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | nan | |||
| 11544156 | 194901 | 0 | None | -123 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 313 | 5 | 0 | 2 | 4.7 | CN(C)CCc1sc2ccccc2c1Cc1ccc(F)cc1 | 10.1021/jm900933k | |||
| CHEMBL540982 | 194901 | 0 | None | -123 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 313 | 5 | 0 | 2 | 4.7 | CN(C)CCc1sc2ccccc2c1Cc1ccc(F)cc1 | 10.1021/jm900933k | |||
| 15749427 | 102059 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm058225d | |||
| CHEMBL302005 | 102059 | 0 | None | 1 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm058225d | |||
| 15749427 | 102059 | 0 | None | -1 | 2 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00055a013 | |||
| CHEMBL302005 | 102059 | 0 | None | -1 | 2 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00055a013 | |||
| 15749427 | 102059 | 0 | None | -1 | 2 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL302005 | 102059 | 0 | None | -1 | 2 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.2 | CN(C)C/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 46884668 | 8289 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1ccc2c(c1)CC(CCN(C)C)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092600 | 8289 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1ccc2c(c1)CC(CCN(C)C)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| 24769156 | 116217 | 0 | None | -181 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 388 | 7 | 1 | 4 | 3.6 | O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc2ncccc2c1 | 10.1021/jm501119j | |||
| CHEMBL3358509 | 116217 | 0 | None | -181 | 4 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 388 | 7 | 1 | 4 | 3.6 | O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc2ncccc2c1 | 10.1021/jm501119j | |||
| 168269382 | 189920 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 818 | 21 | 6 | 8 | 3.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5169902 | 189920 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 818 | 21 | 6 | 8 | 3.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 16006492 | 97469 | 7 | None | -275 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
| CHEMBL270177 | 97469 | 7 | None | -275 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 195 | 0 | 2 | 3 | 2.0 | CC1NC(N)=Nc2cccc(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
| 44334037 | 4446 | 0 | None | -199 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 450 | 9 | 1 | 7 | 3.7 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3csc(-c4cccnc4)n3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL101634 | 4446 | 0 | None | -199 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 450 | 9 | 1 | 7 | 3.7 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3csc(-c4cccnc4)n3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 95339350 | 162882 | 1 | None | 3 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 277 | 4 | 0 | 4 | 1.9 | COC[C@@H](C)N1CCN(c2cccc(F)c2C#N)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4173442 | 162882 | 1 | None | 3 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 277 | 4 | 0 | 4 | 1.9 | COC[C@@H](C)N1CCN(c2cccc(F)c2C#N)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| 141485895 | 175197 | 0 | None | - | 1 | Guinea pig | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 304 | 5 | 1 | 4 | 1.2 | CN1CCc2ccc(OCCCN3CCC(O)C3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4570965 | 175197 | 0 | None | - | 1 | Guinea pig | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 304 | 5 | 1 | 4 | 1.2 | CN1CCc2ccc(OCCCN3CCC(O)C3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 112936251 | 137266 | 1 | None | -1 | 4 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 359 | 5 | 1 | 5 | 3.5 | CN1CCN(c2cc(-c3ccccc3)nc(NCc3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752085 | 137266 | 1 | None | -1 | 4 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 359 | 5 | 1 | 5 | 3.5 | CN1CCN(c2cc(-c3ccccc3)nc(NCc3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 44304991 | 203061 | 0 | None | -891 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 424 | 12 | 0 | 5 | 3.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(S(=O)(=O)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL63631 | 203061 | 0 | None | -891 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 424 | 12 | 0 | 5 | 3.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(S(=O)(=O)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 71525679 | 89726 | 0 | None | -794 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 272 | 3 | 2 | 6 | 1.0 | CCc1cnc2c(N3CC[C@@H](NC)C3)nc(N)nc2c1 | 10.1016/j.bmcl.2013.02.091 | |||
| CHEMBL2376801 | 89726 | 0 | None | -794 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 272 | 3 | 2 | 6 | 1.0 | CCc1cnc2c(N3CC[C@@H](NC)C3)nc(N)nc2c1 | 10.1016/j.bmcl.2013.02.091 | |||
| 57334553 | 90475 | 0 | None | -3715 | 13 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 484 | 7 | 0 | 6 | 6.1 | Cc1cc(=O)oc2c(Cl)c(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc12 | 10.1021/jm400408r | |||
| CHEMBL2387229 | 90475 | 0 | None | -3715 | 13 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 484 | 7 | 0 | 6 | 6.1 | Cc1cc(=O)oc2c(Cl)c(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc12 | 10.1021/jm400408r | |||
| 44324800 | 206948 | 0 | None | -371 | 7 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 463 | 7 | 0 | 7 | 3.5 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccccc4)CC3)[C@@H]1CO2 | 10.1021/jm049619s | |||
| CHEMBL91157 | 206948 | 0 | None | -371 | 7 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 463 | 7 | 0 | 7 | 3.5 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccccc4)CC3)[C@@H]1CO2 | 10.1021/jm049619s | |||
| 94496003 | 162865 | 1 | None | -20 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 331 | 5 | 1 | 5 | 2.8 | C[C@H](CNc1cncc(Cl)n1)N1CCN(c2ccccc2)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4173176 | 162865 | 1 | None | -20 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 331 | 5 | 1 | 5 | 2.8 | C[C@H](CNc1cncc(Cl)n1)N1CCN(c2ccccc2)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| 5048 | 3133 | 64 | None | -109 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1016/j.ejmech.2014.03.014 | |||
| 8924 | 3133 | 64 | None | -109 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1016/j.ejmech.2014.03.014 | |||
| 9948102 | 3133 | 64 | None | -109 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1016/j.ejmech.2014.03.014 | |||
| CHEMBL462605 | 3133 | 64 | None | -109 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1016/j.ejmech.2014.03.014 | |||
| DB11642 | 3133 | 64 | None | -109 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 10.1016/j.ejmech.2014.03.014 | |||
| 21533446 | 70155 | 0 | None | -30 | 10 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 379 | 6 | 1 | 3 | 4.9 | OC1(c2ccc(Cl)cc2)CCN(CCCSc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL1940403 | 70155 | 0 | None | -30 | 10 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 379 | 6 | 1 | 3 | 4.9 | OC1(c2ccc(Cl)cc2)CCN(CCCSc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2014.07.018 | |||
| 44267115 | 9903 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 394 | 1 | 0 | 3 | 4.5 | CC(=O)c1cnc2c(c1)CCc1cc(Cl)ccc1C2=C1CCN(C(C)=O)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL11435 | 9903 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 394 | 1 | 0 | 3 | 4.5 | CC(=O)c1cnc2c(c1)CCc1cc(Cl)ccc1C2=C1CCN(C(C)=O)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 107782 | 14468 | 18 | None | 1 | 5 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | nan | |||
| 67151996 | 14468 | 18 | None | 1 | 5 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | nan | |||
| CHEMBL1201207 | 14468 | 18 | None | 1 | 5 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | nan | |||
| 127026019 | 137460 | 0 | None | 6 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 378 | 2 | 0 | 6 | 1.7 | CN1CCN(c2nc3c(c(N4CCN(C)CC4)n2)-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753705 | 137460 | 0 | None | 6 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 378 | 2 | 0 | 6 | 1.7 | CN1CCN(c2nc3c(c(N4CCN(C)CC4)n2)-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 168276112 | 190272 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 790 | 19 | 6 | 8 | 3.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5175594 | 190272 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 790 | 19 | 6 | 8 | 3.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168276112 | 190272 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 790 | 19 | 6 | 8 | 3.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5175594 | 190272 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 790 | 19 | 6 | 8 | 3.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 45815848 | 162304 | 5 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 330 | 4 | 0 | 5 | 3.2 | CC(C)(C)c1nc(CN2CCN(Cc3ccccn3)CC2)cs1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4164366 | 162304 | 5 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 330 | 4 | 0 | 5 | 3.2 | CC(C)(C)c1nc(CN2CCN(Cc3ccccn3)CC2)cs1 | 10.1021/acs.jmedchem.8b00718 | |||
| 46884600 | 7719 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1cncc(CC2=C(CCN(C)C)Cc3ccccc32)n1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1088882 | 7719 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1cncc(CC2=C(CCN(C)C)Cc3ccccc32)n1 | 10.1016/j.bmcl.2010.02.055 | |||
| 11277528 | 170102 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 282 | 0 | 1 | 5 | 1.6 | Cn1ccc2c1C(=O)Cn1ccnc1C2=C1CCNCC1 | 10.1021/jm049495j | |||
| CHEMBL444353 | 170102 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 282 | 0 | 1 | 5 | 1.6 | Cn1ccc2c1C(=O)Cn1ccnc1C2=C1CCNCC1 | 10.1021/jm049495j | |||
| 15749426 | 11284 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 309 | 3 | 1 | 3 | 3.3 | CN(C)C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL1179173 | 11284 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 309 | 3 | 1 | 3 | 3.3 | CN(C)C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL63424 | 11284 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 309 | 3 | 1 | 3 | 3.3 | CN(C)C/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 6603950 | 203324 | 9 | None | -19 | 8 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 344 | 1 | 0 | 3 | 4.3 | CN1CCN([C@@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm100652h | |||
| CHEMBL64875 | 203324 | 9 | None | -19 | 8 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 344 | 1 | 0 | 3 | 4.3 | CN1CCN([C@@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm100652h | |||
| 11580426 | 7944 | 3 | None | 117 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | CC(c1ccccn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1090432 | 7944 | 3 | None | 117 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | CC(c1ccccn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 10028980 | 24697 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 501 | 9 | 1 | 4 | 6.4 | O=C(O)CCc1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL134377 | 24697 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 501 | 9 | 1 | 4 | 6.4 | O=C(O)CCc1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 135398737 | 958 | 93 | None | -2 | 89 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2015.09.045 | |||
| 38 | 958 | 93 | None | -2 | 89 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2015.09.045 | |||
| 722 | 958 | 93 | None | -2 | 89 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2015.09.045 | |||
| CHEMBL42 | 958 | 93 | None | -2 | 89 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2015.09.045 | |||
| DB00363 | 958 | 93 | None | -2 | 89 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2015.09.045 | |||
| 49836410 | 18735 | 0 | None | 3 | 4 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 393 | 2 | 1 | 2 | 4.5 | O=C(O)C1(F)CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | |||
| CHEMBL1277678 | 18735 | 0 | None | 3 | 4 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 393 | 2 | 1 | 2 | 4.5 | O=C(O)C1(F)CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | |||
| 11437142 | 202606 | 2 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| CHEMBL612084 | 202606 | 2 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| 11097588 | 202138 | 2 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| CHEMBL609131 | 202138 | 2 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccc([C@H](OCCN(C)C)c2ccccc2)cc1 | 10.1021/jm00017a019 | |||
| 16202149 | 80633 | 1 | None | 3 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 556 | 10 | 1 | 4 | 6.8 | CC1(C)CCCN(CCCOc2ccc(C3CCN(C(=O)c4ccc(CCC(=O)O)c5ccccc45)CC3)cc2)C1 | 10.1021/jm100064d | |||
| CHEMBL2151156 | 80633 | 1 | None | 3 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 556 | 10 | 1 | 4 | 6.8 | CC1(C)CCCN(CCCOc2ccc(C3CCN(C(=O)c4ccc(CCC(=O)O)c5ccccc45)CC3)cc2)C1 | 10.1021/jm100064d | |||
| 71450777 | 84203 | 0 | None | 63 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 5.2 | N#Cc1cccc(OCCCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208420 | 84203 | 0 | None | 63 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 5.2 | N#Cc1cccc(OCCCN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 59295926 | 84218 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 474 | 7 | 2 | 6 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1cnnc2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208435 | 84218 | 0 | None | 1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 474 | 7 | 2 | 6 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1cnnc2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| 59295984 | 84011 | 0 | None | -3 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 487 | 7 | 3 | 5 | 3.3 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3cc(F)ccc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207279 | 84011 | 0 | None | -3 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 487 | 7 | 3 | 5 | 3.3 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3cc(F)ccc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| 59296033 | 84018 | 0 | None | -15 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 596 | 9 | 3 | 7 | 2.7 | CN(C)S(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207286 | 84018 | 0 | None | -15 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 596 | 9 | 3 | 7 | 2.7 | CN(C)S(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| 71459762 | 84091 | 0 | None | -7 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 452 | 8 | 3 | 5 | 3.2 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]nc1C1CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207661 | 84091 | 0 | None | -7 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 452 | 8 | 3 | 5 | 3.2 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]nc1C1CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| 7077 | 66959 | 27 | None | 3 | 5 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.2 | CN(C)CCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL186720 | 66959 | 27 | None | 3 | 5 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.2 | CN(C)CCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3925724 | 66959 | 27 | None | 3 | 5 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.2 | CN(C)CCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 3359700 | 143095 | 2 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 309 | 7 | 0 | 2 | 4.5 | c1ccc(Cc2ccccc2OCCCN2CCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3895427 | 143095 | 2 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 309 | 7 | 0 | 2 | 4.5 | c1ccc(Cc2ccccc2OCCCN2CCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 11742610 | 207029 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1ccncc1CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL91565 | 207029 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1ccncc1CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 144950987 | 179970 | 0 | None | 95 | 6 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 292 | 3 | 0 | 2 | 3.4 | CN(C)CCN1C(=O)c2ccccc2/C=C\c2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| CHEMBL4746800 | 179970 | 0 | None | 95 | 6 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 292 | 3 | 0 | 2 | 3.4 | CN(C)CCN1C(=O)c2ccccc2/C=C\c2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| 46884154 | 8325 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1ccc(C(C)c2c(CCN(C)C)sc3ccccc23)cn1 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092812 | 8325 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1ccc(C(C)c2c(CCN(C)C)sc3ccccc23)cn1 | 10.1016/j.bmcl.2010.01.134 | |||
| 14885639 | 118569 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 351 | 1 | 0 | 2 | 5.4 | CC(=O)C1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL341584 | 118569 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 351 | 1 | 0 | 2 | 5.4 | CC(=O)C1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 44352308 | 117487 | 0 | None | -1479 | 12 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 339 | 5 | 2 | 2 | 4.0 | Cc1[nH]c2cccc(NC(=O)c3ccc(F)cc3)c2c1CCN(C)C | 10.1021/jm0155190 | |||
| CHEMBL339980 | 117487 | 0 | None | -1479 | 12 | Rat | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 339 | 5 | 2 | 2 | 4.0 | Cc1[nH]c2cccc(NC(=O)c3ccc(F)cc3)c2c1CCN(C)C | 10.1021/jm0155190 | |||
| 44304382 | 203302 | 0 | None | -125 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 403 | 11 | 1 | 4 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)NC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64773 | 203302 | 0 | None | -125 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 403 | 11 | 1 | 4 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)NC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 164627774 | 186565 | 0 | None | -2 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 344 | 3 | 4 | 4 | 1.4 | N/C(=N\C(=O)NCc1ccccc1)NC1CCc2nc(N)sc2C1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4878215 | 186565 | 0 | None | -2 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 344 | 3 | 4 | 4 | 1.4 | N/C(=N\C(=O)NCc1ccccc1)NC1CCc2nc(N)sc2C1 | 10.1016/j.ejmech.2021.113190 | |||
| 44304030 | 200962 | 0 | None | -91 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 511 | 11 | 1 | 5 | 4.4 | N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL60189 | 200962 | 0 | None | -91 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 511 | 11 | 1 | 5 | 4.4 | N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 118709750 | 113540 | 0 | None | -109 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.5 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCSc1cccc(F)c1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL3321791 | 113540 | 0 | None | -109 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.5 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCSc1cccc(F)c1 | 10.1016/j.bmcl.2014.07.018 | |||
| 155564280 | 175423 | 0 | None | - | 1 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 290 | 4 | 0 | 4 | 1.0 | CN1CCc2ccc(OCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4576048 | 175423 | 0 | None | - | 1 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 290 | 4 | 0 | 4 | 1.0 | CN1CCc2ccc(OCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 45485525 | 197799 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 337 | 7 | 1 | 2 | 4.8 | Cc1ccc(CCCCN2CCC(C(O)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL572034 | 197799 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 337 | 7 | 1 | 2 | 4.8 | Cc1ccc(CCCCN2CCC(C(O)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 46884239 | 8436 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 299 | 5 | 0 | 4 | 3.8 | CC(c1c(CCN(C)C)sc2ccccc12)n1ccnc1 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1093607 | 8436 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 299 | 5 | 0 | 4 | 3.8 | CC(c1c(CCN(C)C)sc2ccccc12)n1ccnc1 | 10.1016/j.bmcl.2010.01.134 | |||
| 57345619 | 70464 | 0 | None | -13 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 360 | 6 | 0 | 2 | 5.0 | Fc1ccc(CCCCN2CCCN(c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946253 | 70464 | 0 | None | -13 | 7 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 360 | 6 | 0 | 2 | 5.0 | Fc1ccc(CCCCN2CCCN(c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| 28390601 | 162972 | 0 | None | -2 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 377 | 4 | 0 | 5 | 3.9 | Cc1oc(-c2ccco2)nc1CN1CCN([C@@H]2CCc3ccccc3C2)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4175018 | 162972 | 0 | None | -2 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 377 | 4 | 0 | 5 | 3.9 | Cc1oc(-c2ccco2)nc1CN1CCN([C@@H]2CCc3ccccc3C2)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| 69347707 | 81305 | 1 | None | 5 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)c1ccc(CN2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158833 | 81305 | 1 | None | 5 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)c1ccc(CN2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072057 | 81312 | 0 | None | -5 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1cccc(F)c1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158840 | 81312 | 0 | None | -5 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1cccc(F)c1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 24839550 | 137315 | 14 | None | -2 | 15 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 240 | 7 | 1 | 1 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2015.12.053 | |||
| CHEMBL3752576 | 137315 | 14 | None | -2 | 15 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 240 | 7 | 1 | 1 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccccc12 | 10.1016/j.bmcl.2015.12.053 | |||
| 59296094 | 84099 | 0 | None | -31 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 480 | 7 | 3 | 6 | 2.7 | N#Cc1ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccccc34)CC2)cc1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207669 | 84099 | 0 | None | -31 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 480 | 7 | 3 | 6 | 2.7 | N#Cc1ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccccc34)CC2)cc1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| 9954003 | 71700 | 24 | None | -251 | 9 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 422 | 5 | 2 | 4 | 3.8 | C[C@H]1Oc2c(cccc2N2CCN(CCCc3c[nH]c4ccc(F)cc34)CC2)NC1=O | 10.1021/jm070516u | |||
| CHEMBL196514 | 71700 | 24 | None | -251 | 9 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 422 | 5 | 2 | 4 | 3.8 | C[C@H]1Oc2c(cccc2N2CCN(CCCc3c[nH]c4ccc(F)cc34)CC2)NC1=O | 10.1021/jm070516u | |||
| 71462389 | 82243 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 476 | 5 | 1 | 4 | 4.8 | O=C(O)c1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171024 | 82243 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 476 | 5 | 1 | 4 | 4.8 | O=C(O)c1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963141 | 82268 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 491 | 5 | 1 | 5 | 4.1 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)cc4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171049 | 82268 | 0 | None | 1 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 491 | 5 | 1 | 5 | 4.1 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)cc4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 168296182 | 192227 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 808 | 21 | 7 | 9 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5204985 | 192227 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 808 | 21 | 7 | 9 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 9971374 | 104126 | 0 | None | -316 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 288 | 5 | 1 | 3 | 2.6 | c1cc2c(cc1OCCCN1CCCCC1)CCNCC2 | 10.1016/j.bmcl.2013.09.089 | |||
| CHEMBL3094130 | 104126 | 0 | None | -316 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 288 | 5 | 1 | 3 | 2.6 | c1cc2c(cc1OCCCN1CCCCC1)CCNCC2 | 10.1016/j.bmcl.2013.09.089 | |||
| 50898777 | 56440 | 0 | None | -11748 | 8 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 441 | 9 | 1 | 6 | 3.6 | COC(=O)CCCCCN1CCC(CNC(=O)c2c3n(c4ccccc24)CCCO3)CC1 | 10.1016/j.bmc.2010.10.011 | |||
| CHEMBL1632158 | 56440 | 0 | None | -11748 | 8 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 441 | 9 | 1 | 6 | 3.6 | COC(=O)CCCCCN1CCC(CNC(=O)c2c3n(c4ccccc24)CCCO3)CC1 | 10.1016/j.bmc.2010.10.011 | |||
| 71461541 | 84220 | 0 | None | -15 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 513 | 9 | 3 | 6 | 2.7 | CS(=O)(=O)c1ccccc1C(=O)NCC(O)CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208437 | 84220 | 0 | None | -15 | 2 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 513 | 9 | 3 | 6 | 2.7 | CS(=O)(=O)c1ccccc1C(=O)NCC(O)CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 | 10.1016/j.bmcl.2012.09.113 | |||
| 50878551 | 90745 | 61 | None | -21 | 18 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2013.03.066 | |||
| CHEMBL2391541 | 90745 | 61 | None | -21 | 18 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2013.03.066 | |||
| 10662264 | 56494 | 0 | None | -812 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 304 | 7 | 2 | 5 | 2.2 | O=C(NCc1ccc([N+](=O)[O-])cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16338 | 56494 | 0 | None | -812 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 304 | 7 | 2 | 5 | 2.2 | O=C(NCc1ccc([N+](=O)[O-])cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10660952 | 98123 | 0 | None | -190 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 287 | 7 | 1 | 3 | 3.0 | CCN(Cc1ccccc1)C(=O)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL273549 | 98123 | 0 | None | -190 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 287 | 7 | 1 | 3 | 3.0 | CCN(Cc1ccccc1)C(=O)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10732219 | 98944 | 0 | None | -602 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 290 | 6 | 2 | 5 | 2.5 | O=C(Nc1cccc([N+](=O)[O-])c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL279617 | 98944 | 0 | None | -602 | 2 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 290 | 6 | 2 | 5 | 2.5 | O=C(Nc1cccc([N+](=O)[O-])c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 1204 | 1932 | 119 | None | -46 | 24 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm00002a008 | |||
| 1247 | 1932 | 119 | None | -46 | 24 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm00002a008 | |||
| 1375 | 1932 | 119 | None | -46 | 24 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm00002a008 | |||
| 774 | 1932 | 119 | None | -46 | 24 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm00002a008 | |||
| CHEMBL90 | 1932 | 119 | None | -46 | 24 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm00002a008 | |||
| DB05381 | 1932 | 119 | None | -46 | 24 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/jm00002a008 | |||
| 44304560 | 102763 | 0 | None | -9549 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 371 | 8 | 1 | 5 | 1.6 | O=C(c1ccc(OCCCN2CCN(C(=O)[C@H]3CCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL305144 | 102763 | 0 | None | -9549 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 371 | 8 | 1 | 5 | 1.6 | O=C(c1ccc(OCCCN2CCN(C(=O)[C@H]3CCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 10422468 | 204158 | 0 | None | -630 | 3 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 254 | 7 | 3 | 2 | 2.4 | CC(C)/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| CHEMBL70603 | 204158 | 0 | None | -630 | 3 | Guinea pig | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 254 | 7 | 3 | 2 | 2.4 | CC(C)/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 164620678 | 186019 | 0 | None | -199 | 4 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 374 | 7 | 4 | 4 | 2.7 | CCC(NC(=O)/N=C(\N)NCCCc1sc(N)nc1C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4870510 | 186019 | 0 | None | -199 | 4 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 374 | 7 | 4 | 4 | 2.7 | CCC(NC(=O)/N=C(\N)NCCCc1sc(N)nc1C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 168296182 | 192227 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 808 | 21 | 7 | 9 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5204985 | 192227 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 808 | 21 | 7 | 9 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 155567030 | 176417 | 0 | None | -37 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 337 | 8 | 0 | 2 | 5.8 | c1ccc(-c2ccc(OCCCCCN3CCCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL4586133 | 176417 | 0 | None | -37 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 337 | 8 | 0 | 2 | 5.8 | c1ccc(-c2ccc(OCCCCCN3CCCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| CHEMBL4596108 | 176417 | 0 | None | -37 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 337 | 8 | 0 | 2 | 5.8 | c1ccc(-c2ccc(OCCCCCN3CCCCCC3)cc2)cc1 | 10.1016/j.bmc.2017.07.058 | |||
| 18337331 | 116091 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 410 | 2 | 0 | 3 | 5.5 | CC(C)COC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL3357035 | 116091 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 410 | 2 | 0 | 3 | 5.5 | CC(C)COC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| 57403525 | 70154 | 0 | None | -85 | 10 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 361 | 6 | 1 | 2 | 4.8 | OC1(c2ccc(Cl)cc2)CCN(CCCCc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL1940402 | 70154 | 0 | None | -85 | 10 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 361 | 6 | 1 | 2 | 4.8 | OC1(c2ccc(Cl)cc2)CCN(CCCCc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2014.07.018 | |||
| 168295543 | 193041 | 0 | None | -1 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5209021 | 193041 | 0 | None | -1 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222929 | 193041 | 0 | None | -1 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 57390695 | 70467 | 0 | None | 3 | 8 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 427 | 7 | 0 | 5 | 5.5 | O=C(CCCCN1CCCN(c2ccc(Cl)cc2)CC1)c1nc2ccccc2s1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946257 | 70467 | 0 | None | 3 | 8 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 427 | 7 | 0 | 5 | 5.5 | O=C(CCCCN1CCCN(c2ccc(Cl)cc2)CC1)c1nc2ccccc2s1 | 10.1016/j.bmc.2012.01.022 | |||
| 127035062 | 136451 | 0 | None | -44 | 19 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 447 | 12 | 0 | 5 | 5.2 | COc1ccc(CCN(CCCc2ccccc2)CCc2ccc3c(c2)OCO3)cc1OC | 10.1039/C4MD00418C | |||
| CHEMBL3735756 | 136451 | 0 | None | -44 | 19 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 447 | 12 | 0 | 5 | 5.2 | COc1ccc(CCN(CCCc2ccccc2)CCc2ccc3c(c2)OCO3)cc1OC | 10.1039/C4MD00418C | |||
| 53322959 | 57750 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 325 | 7 | 0 | 3 | 3.9 | C[C@H](C1=C(CCN(C)CCF)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669408 | 57750 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 325 | 7 | 0 | 3 | 3.9 | C[C@H](C1=C(CCN(C)CCF)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 11493620 | 8268 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | C[C@@H](c1ccc(F)cn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092495 | 8268 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | C[C@@H](c1ccc(F)cn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 76332519 | 105477 | 0 | None | -1 | 4 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 510 | 7 | 0 | 6 | 6.3 | O=c1oc2c(Cl)c(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc2c2c1CCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| CHEMBL3120697 | 105477 | 0 | None | -1 | 4 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 510 | 7 | 0 | 6 | 6.3 | O=c1oc2c(Cl)c(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc2c2c1CCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| 53324167 | 57767 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 370 | 7 | 0 | 4 | 4.5 | C[C@H](C1=C(CCN(C)Cc2ccccn2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669424 | 57767 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 370 | 7 | 0 | 4 | 4.5 | C[C@H](C1=C(CCN(C)Cc2ccccn2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 44334036 | 167792 | 0 | None | -323 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 391 | 8 | 1 | 5 | 3.0 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3ccc(C#N)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL430502 | 167792 | 0 | None | -323 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 391 | 8 | 1 | 5 | 3.0 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3ccc(C#N)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 168271050 | 189932 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 774 | 19 | 5 | 7 | 3.5 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5170060 | 189932 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 774 | 19 | 5 | 7 | 3.5 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168271050 | 189932 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 774 | 19 | 5 | 7 | 3.5 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5170060 | 189932 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 774 | 19 | 5 | 7 | 3.5 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL4576555 | 214017 | 5 | None | -1 | 19 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | None | None | None | CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccc4n3)cc2)CC1 | 10.6019/CHEMBL4507307 | |||||
| 168268827 | 192779 | 0 | None | -4 | 4 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5179906 | 192779 | 0 | None | -4 | 4 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221314 | 192779 | 0 | None | -4 | 4 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 72138721 | 162229 | 3 | None | -3 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 349 | 6 | 1 | 5 | 2.9 | Fc1ccccc1N1CCN(CCCNc2cncc(Cl)n2)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4163265 | 162229 | 3 | None | -3 | 3 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 349 | 6 | 1 | 5 | 2.9 | Fc1ccccc1N1CCN(CCCNc2cncc(Cl)n2)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| 168268853 | 192785 | 0 | None | -19 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 389 | 8 | 4 | 5 | 1.9 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5180504 | 192785 | 0 | None | -19 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 389 | 8 | 4 | 5 | 1.9 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221353 | 192785 | 0 | None | -19 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 389 | 8 | 4 | 5 | 1.9 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 164624107 | 185722 | 0 | None | -29 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 402 | 9 | 4 | 4 | 2.8 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)CCc1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4865765 | 185722 | 0 | None | -29 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 402 | 9 | 4 | 4 | 2.8 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)CCc1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 44304990 | 203062 | 0 | None | -363 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 483 | 12 | 0 | 6 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL63632 | 203062 | 0 | None | -363 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 483 | 12 | 0 | 6 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304066 | 202765 | 0 | None | -309 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 449 | 11 | 1 | 5 | 3.0 | CN[C@H](Cc1ccccc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62050 | 202765 | 0 | None | -309 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 449 | 11 | 1 | 5 | 3.0 | CN[C@H](Cc1ccccc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 73347825 | 92540 | 0 | None | 1 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 311 | 5 | 1 | 3 | 2.9 | COc1ccc(CN[C@H]2C3C4CC5C6C4CC3C6C52)cc1OC | 10.1016/j.bmc.2013.07.045 | |||
| CHEMBL2432046 | 92540 | 0 | None | 1 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 311 | 5 | 1 | 3 | 2.9 | COc1ccc(CN[C@H]2C3C4CC5C6C4CC3C6C52)cc1OC | 10.1016/j.bmc.2013.07.045 | |||
| 18715381 | 97351 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3ccc(Cl)nc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL269460 | 97351 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3ccc(Cl)nc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL4520788 | 213975 | 10 | None | -63 | 25 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | None | None | None | CNCc1ccccc1-c1csc([C@H](C)Nc2nc(C)nc3cc(OC)c(OC)cc23)c1 | 10.6019/CHEMBL5212743 | |||||
| 44373221 | 54388 | 0 | None | 3 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 223 | 2 | 1 | 1 | 3.1 | NCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL160893 | 54388 | 0 | None | 3 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 223 | 2 | 1 | 1 | 3.1 | NCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 46882180 | 5841 | 0 | None | -5 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 7 | 2 | 7 | 3.7 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1F | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL1079180 | 5841 | 0 | None | -5 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 482 | 7 | 2 | 7 | 3.7 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1F | 10.1016/j.bmcl.2009.09.024 | |||
| 9923147 | 5049 | 0 | None | -2238 | 4 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 321 | 6 | 1 | 4 | 3.0 | N#Cc1ccc(-c2ccc(OCCCN3CC[C@@H](N)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105267 | 5049 | 0 | None | -2238 | 4 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 321 | 6 | 1 | 4 | 3.0 | N#Cc1ccc(-c2ccc(OCCCN3CC[C@@H](N)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 44326321 | 207796 | 0 | None | 2 | 3 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 295 | 2 | 0 | 3 | 4.0 | CN(C)CC1C[C@@H]2c3ccccc3Oc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL96158 | 207796 | 0 | None | 2 | 3 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 295 | 2 | 0 | 3 | 4.0 | CN(C)CC1C[C@@H]2c3ccccc3Oc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 10382839 | 116552 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 343 | 5 | 1 | 4 | 3.7 | CN(C)CCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL336317 | 116552 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 343 | 5 | 1 | 4 | 3.7 | CN(C)CCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL538750 | 116552 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 343 | 5 | 1 | 4 | 3.7 | CN(C)CCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 12992627 | 67247 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 570 | 7 | 2 | 5 | 5.7 | NC(=O)N(O)CCC#Cc1ccc(OCCCN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL188021 | 67247 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 570 | 7 | 2 | 5 | 5.7 | NC(=O)N(O)CCC#Cc1ccc(OCCCN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 135398737 | 958 | 93 | None | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm010982y | |||
| 38 | 958 | 93 | None | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm010982y | |||
| 722 | 958 | 93 | None | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm010982y | |||
| CHEMBL42 | 958 | 93 | None | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm010982y | |||
| DB00363 | 958 | 93 | None | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm010982y | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.02.005 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.02.005 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.02.005 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.02.005 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm058225d | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm058225d | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm058225d | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm058225d | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm058225d | |||
| 44401042 | 124829 | 0 | None | -3 | 9 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.6 | CN(C)C[C@@H]1CC2c3ccccc3Oc3ccc(Cl)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL364270 | 124829 | 0 | None | -3 | 9 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.6 | CN(C)C[C@@H]1CC2c3ccccc3Oc3ccc(Cl)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 10344845 | 24883 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 474 | 7 | 1 | 5 | 4.9 | O=C(O)c1ccc2c(c1)C(SCCN1CCN(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL134543 | 24883 | 0 | None | - | 1 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 474 | 7 | 1 | 5 | 4.9 | O=C(O)c1ccc2c(c1)C(SCCN1CCN(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 45272878 | 195861 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 448 | 7 | 0 | 6 | 4.4 | COc1ccc(Cn2c(N3CCC(N(C)CC4CCOCC4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL558663 | 195861 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 448 | 7 | 0 | 6 | 4.4 | COc1ccc(Cn2c(N3CCC(N(C)CC4CCOCC4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 45270330 | 196447 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 434 | 7 | 1 | 6 | 4.1 | COc1ccc(Cn2c(N3CCC(NCC4CCOCC4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL563055 | 196447 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 434 | 7 | 1 | 6 | 4.1 | COc1ccc(Cn2c(N3CCC(NCC4CCOCC4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 25184832 | 18695 | 0 | None | 2 | 5 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 349 | 2 | 1 | 3 | 3.8 | O=C(O)C1CN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | |||
| CHEMBL1277312 | 18695 | 0 | None | 2 | 5 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 349 | 2 | 1 | 3 | 3.8 | O=C(O)C1CN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)C1 | 10.1021/jm100856p | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1016/j.bmcl.2011.09.001 | |||
| 44343629 | 159949 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 327 | 1 | 1 | 3 | 2.4 | O=C1CN(C2c3ccc(Cl)cc3CCc3cccnc32)CCN1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL410734 | 159949 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 327 | 1 | 1 | 3 | 2.4 | O=C1CN(C2c3ccc(Cl)cc3CCc3cccnc32)CCN1 | 10.1016/s0960-894x(98)00626-x | |||
| 10474964 | 130471 | 0 | None | -181 | 7 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 3.3 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| CHEMBL368061 | 130471 | 0 | None | -181 | 7 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 3.3 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| CHEMBL5206021 | 130471 | 0 | None | -181 | 7 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 3.3 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| 46782362 | 150451 | 27 | None | -10 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 446 | 6 | 1 | 6 | 3.9 | CS(=O)(=O)c1ccc2c(c1)N(CCCN1CCC(C(=O)O)CC1)c1ccccc1S2 | nan | |||
| CHEMBL3954123 | 150451 | 27 | None | -10 | 2 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 446 | 6 | 1 | 6 | 3.9 | CS(=O)(=O)c1ccc2c(c1)N(CCCN1CCC(C(=O)O)CC1)c1ccccc1S2 | nan | |||
| 11121216 | 30139 | 0 | None | -707 | 14 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
| CHEMBL138989 | 30139 | 0 | None | -707 | 14 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
| 71456045 | 84073 | 0 | None | -1995 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 3.6 | COc1ccccc1N1CCN(Cc2cc(CO)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| CHEMBL2207635 | 84073 | 0 | None | -1995 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 3.6 | COc1ccccc1N1CCN(Cc2cc(CO)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| 44334214 | 4615 | 0 | None | -2344 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 427 | 9 | 1 | 6 | 2.6 | CC(=O)c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(C#N)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL102840 | 4615 | 0 | None | -2344 | 3 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 427 | 9 | 1 | 6 | 2.6 | CC(=O)c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(C#N)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44304090 | 202950 | 0 | None | -301 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 360 | 8 | 0 | 5 | 2.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62948 | 202950 | 0 | None | -301 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 360 | 8 | 0 | 5 | 2.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 53245590 | 92399 | 43 | None | -3 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 420 | 6 | 0 | 7 | 3.9 | COc1cc2nc(C3CC3)nc(N3CCN(c4ccccc4OC)CC3)c2cc1OC | 10.1021/ml400176n | |||
| CHEMBL2431120 | 92399 | 43 | None | -3 | 4 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 420 | 6 | 0 | 7 | 3.9 | COc1cc2nc(C3CC3)nc(N3CCN(c4ccccc4OC)CC3)c2cc1OC | 10.1021/ml400176n | |||
| 16726095 | 84637 | 2 | None | -1 | 4 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 379 | 5 | 1 | 4 | 3.4 | COC(=O)C1(c2ccc(C)cc2)CC1CN1CCC(O)(c2ccccc2)CC1 | 10.1021/jm0611197 | |||
| CHEMBL222301 | 84637 | 2 | None | -1 | 4 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 379 | 5 | 1 | 4 | 3.4 | COC(=O)C1(c2ccc(C)cc2)CC1CN1CCC(O)(c2ccccc2)CC1 | 10.1021/jm0611197 | |||
| 127051844 | 140847 | 0 | None | -125 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 322 | 6 | 1 | 3 | 2.8 | NC(=O)c1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819427 | 140847 | 0 | None | -125 | 9 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 322 | 6 | 1 | 3 | 2.8 | NC(=O)c1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 4601 | 206747 | 35 | None | -1 | 16 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | nan | |||
| CHEMBL1201023 | 206747 | 35 | None | -1 | 16 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | nan | |||
| CHEMBL900 | 206747 | 35 | None | -1 | 16 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | nan | |||
| 168276867 | 192835 | 0 | None | -1 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5174278 | 192835 | 0 | None | -1 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221653 | 192835 | 0 | None | -1 | 4 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 44304068 | 102347 | 0 | None | -89 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 441 | 10 | 1 | 5 | 3.5 | N[C@H](CC1CCCCC1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL303737 | 102347 | 0 | None | -89 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 441 | 10 | 1 | 5 | 3.5 | N[C@H](CC1CCCCC1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304760 | 202901 | 0 | None | -234 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 431 | 13 | 1 | 5 | 3.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)CC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62741 | 202901 | 0 | None | -234 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 431 | 13 | 1 | 5 | 3.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)CC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 9906978 | 42711 | 2 | None | -28 | 12 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL150161 | 42711 | 2 | None | -28 | 12 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 9906978 | 42711 | 2 | None | -28 | 12 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.03.057 | |||
| CHEMBL150161 | 42711 | 2 | None | -28 | 12 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.03.057 | |||
| 118721930 | 116094 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 394 | 3 | 0 | 2 | 5.4 | CCCCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL3357043 | 116094 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 394 | 3 | 0 | 2 | 5.4 | CCCCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| 44335428 | 4984 | 0 | None | -1 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 358 | 7 | 1 | 5 | 2.6 | CCOC(=O)N1CCN(CCCOc2ccc(-c3c[nH]cn3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL104947 | 4984 | 0 | None | -1 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 358 | 7 | 1 | 5 | 2.6 | CCOC(=O)N1CCN(CCCOc2ccc(-c3c[nH]cn3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | nan | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | nan | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | nan | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | nan | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | nan | |||
| 46884641 | 7914 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2ncccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090198 | 7914 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2ncccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| 12765746 | 102280 | 4 | None | -69 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 344 | 1 | 0 | 3 | 4.3 | CN1CCN([C@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm100652h | |||
| CHEMBL303313 | 102280 | 4 | None | -69 | 9 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 344 | 1 | 0 | 3 | 4.3 | CN1CCN([C@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm100652h | |||
| 11696813 | 187918 | 12 | None | -3 | 9 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 391 | 7 | 1 | 4 | 4.1 | Cc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4o3)CC2)c1 | 10.1021/jm800689g | |||
| CHEMBL496739 | 187918 | 12 | None | -3 | 9 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 391 | 7 | 1 | 4 | 4.1 | Cc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4o3)CC2)c1 | 10.1021/jm800689g | |||
| 44404954 | 135265 | 0 | None | 1 | 3 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C\CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL372588 | 135265 | 0 | None | 1 | 3 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C\CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 15749429 | 202913 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.0 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CCC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL62790 | 202913 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.0 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CCC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 53326727 | 57770 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 4.3 | C[C@H](C1=C(CCN(C)CC2CCOCC2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669427 | 57770 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 4.3 | C[C@H](C1=C(CCN(C)CC2CCOCC2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 9914506 | 81257 | 0 | None | -3 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 5 | 5.1 | N#Cc1ccccc1C[C@@H](C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158769 | 81257 | 0 | None | -3 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 5 | 5.1 | N#Cc1ccccc1C[C@@H](C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072052 | 81259 | 0 | None | -1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 5 | 5.1 | N#Cc1ccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158771 | 81259 | 0 | None | -1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 5 | 5.1 | N#Cc1ccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072081 | 81261 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1cccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158773 | 81261 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1cccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71449584 | 81296 | 1 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)Cc1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158825 | 81296 | 1 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)Cc1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 69272932 | 81299 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 5.2 | O=C(O)COc1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158828 | 81299 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 5.2 | O=C(O)COc1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 17747460 | 61329 | 12 | None | -19 | 4 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm100064d | |||
| CHEMBL1767164 | 61329 | 12 | None | -19 | 4 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 640 | 14 | 0 | 6 | 7.8 | O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 | 10.1021/jm100064d | |||
| 59296114 | 84208 | 0 | None | 12 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 480 | 7 | 2 | 6 | 3.4 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1cn2cc(F)ccc2n1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208425 | 84208 | 0 | None | 12 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 480 | 7 | 2 | 6 | 3.4 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1cn2cc(F)ccc2n1 | 10.1016/j.bmcl.2012.09.113 | |||
| 59296111 | 84087 | 0 | None | -2 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 480 | 7 | 3 | 5 | 3.4 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]nc1C(F)(F)F | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207658 | 84087 | 0 | None | -2 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 480 | 7 | 3 | 5 | 3.4 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]nc1C(F)(F)F | 10.1016/j.bmcl.2012.09.112 | |||
| 23722970 | 69020 | 21 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL1923521 | 69020 | 21 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3977546 | 69020 | 21 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 44396235 | 168537 | 1 | None | 23 | 5 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 281 | 6 | 0 | 2 | 3.8 | c1ccc(Cc2ccccc2OCCN2CCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL435505 | 168537 | 1 | None | 23 | 5 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 281 | 6 | 0 | 2 | 3.8 | c1ccc(Cc2ccccc2OCCN2CCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 2865 | 4143 | 73 | None | -17 | 53 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm070516u | |||
| 59 | 4143 | 73 | None | -17 | 53 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm070516u | |||
| 60854 | 4143 | 73 | None | -17 | 53 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm070516u | |||
| CHEMBL708 | 4143 | 73 | None | -17 | 53 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm070516u | |||
| DB00246 | 4143 | 73 | None | -17 | 53 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm070516u | |||
| 136229178 | 82244 | 0 | None | 19 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 516 | 5 | 1 | 6 | 4.5 | O=C(c1ccc(-c2noc(=O)[nH]2)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171025 | 82244 | 0 | None | 19 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 516 | 5 | 1 | 6 | 4.5 | O=C(c1ccc(-c2noc(=O)[nH]2)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 71451671 | 82247 | 0 | None | 31 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 519 | 8 | 2 | 5 | 5.0 | O=C(O)CCNc1ccccc1C(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171028 | 82247 | 0 | None | 31 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 519 | 8 | 2 | 5 | 5.0 | O=C(O)CCNc1ccccc1C(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963153 | 82265 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)cc4Cl)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171046 | 82265 | 0 | None | 1 | 2 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)cc4Cl)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 10324985 | 76781 | 8 | None | -112 | 17 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 423 | 7 | 0 | 8 | 1.7 | COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1 | 10.1021/jm050725j | |||
| CHEMBL199824 | 76781 | 8 | None | -112 | 17 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 423 | 7 | 0 | 8 | 1.7 | COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1 | 10.1021/jm050725j | |||
| CHEMBL2068762 | 76781 | 8 | None | -112 | 17 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 423 | 7 | 0 | 8 | 1.7 | COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1 | 10.1021/jm050725j | |||
| 9913604 | 204586 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 492 | 7 | 2 | 5 | 4.4 | NC(=O)N(O)CCC#Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1 | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL73135 | 204586 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 492 | 7 | 2 | 5 | 4.4 | NC(=O)N(O)CCC#Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1 | 10.1016/j.bmcl.2004.02.005 | |||
| 9913604 | 204586 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 492 | 7 | 2 | 5 | 4.4 | NC(=O)N(O)CCC#Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1 | 10.1021/jm058225d | |||
| CHEMBL73135 | 204586 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 492 | 7 | 2 | 5 | 4.4 | NC(=O)N(O)CCC#Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1 | 10.1021/jm058225d | |||
| 14885627 | 114820 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | CC(=O)N1CCC(=C2c3cc(Cl)ccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL334127 | 114820 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | CC(=O)N1CCC(=C2c3cc(Cl)ccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 44334368 | 109217 | 0 | None | -301 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 506 | 10 | 1 | 5 | 3.9 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(Br)cc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL321709 | 109217 | 0 | None | -301 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 506 | 10 | 1 | 5 | 3.9 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(Br)cc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 9848303 | 111580 | 0 | None | -501 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 487 | 6 | 1 | 6 | 3.8 | Cn1cc(-c2ccc3c(c2)c(C2CCN(CCN4CCNC4=O)CC2)cn3-c2ccc(F)cc2)nn1 | 10.1021/jm100652h | |||
| CHEMBL328187 | 111580 | 0 | None | -501 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 487 | 6 | 1 | 6 | 3.8 | Cn1cc(-c2ccc3c(c2)c(C2CCN(CCN4CCNC4=O)CC2)cn3-c2ccc(F)cc2)nn1 | 10.1021/jm100652h | |||
| 168276544 | 190321 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5176319 | 190321 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168276544 | 190321 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5176319 | 190321 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 742 | 19 | 6 | 8 | 1.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304318 | 203261 | 0 | None | -234 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.8 | C[C@@H](CN)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64608 | 203261 | 0 | None | -234 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.8 | C[C@@H](CN)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 118721928 | 116092 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 378 | 1 | 0 | 2 | 4.8 | C/C=C/C(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL3357041 | 116092 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 378 | 1 | 0 | 2 | 4.8 | C/C=C/C(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| 1621 | 2429 | 17 | None | -301 | 45 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
| 17 | 2429 | 17 | None | -301 | 45 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
| 5761 | 2429 | 17 | None | -301 | 45 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
| CHEMBL263881 | 2429 | 17 | None | -301 | 45 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
| DB04829 | 2429 | 17 | None | -301 | 45 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | 10.1021/jm020153s | |||
| 45485535 | 197621 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 399 | 7 | 1 | 2 | 5.6 | Cc1ccc(CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL570695 | 197621 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 399 | 7 | 1 | 2 | 5.6 | Cc1ccc(CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 3151 | 1462 | 97 | None | -41 | 27 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| 945 | 1462 | 97 | None | -41 | 27 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| 965 | 1462 | 97 | None | -41 | 27 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| CHEMBL219916 | 1462 | 97 | None | -41 | 27 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| DB01184 | 1462 | 97 | None | -41 | 27 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | nan | |||
| 44395741 | 181581 | 0 | None | -10 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 360 | 6 | 0 | 3 | 4.3 | O=C(CCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL476935 | 181581 | 0 | None | -10 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 360 | 6 | 0 | 3 | 4.3 | O=C(CCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL558392 | 181581 | 0 | None | -10 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 360 | 6 | 0 | 3 | 4.3 | O=C(CCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 44307779 | 203559 | 0 | None | -1348 | 4 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 332 | 2 | 0 | 2 | 4.7 | C(#Cc1c2c(nc3ccccc13)CCCCC2)CCN1CCCCC1 | 10.1016/s0960-894x(03)00356-1 | |||
| CHEMBL66660 | 203559 | 0 | None | -1348 | 4 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 332 | 2 | 0 | 2 | 4.7 | C(#Cc1c2c(nc3ccccc13)CCCCC2)CCN1CCCCC1 | 10.1016/s0960-894x(03)00356-1 | |||
| 168279725 | 191155 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 728 | 19 | 6 | 8 | 1.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5188589 | 191155 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 728 | 19 | 6 | 8 | 1.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168292703 | 192060 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 726 | 18 | 5 | 7 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5202570 | 192060 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 726 | 18 | 5 | 7 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44335387 | 108550 | 0 | None | -5 | 4 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 393 | 7 | 0 | 5 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL320178 | 108550 | 0 | None | -5 | 4 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 393 | 7 | 0 | 5 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 11444350 | 81265 | 0 | None | -7 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 558 | 8 | 1 | 4 | 6.3 | O=C(O)[C@H](Cc1cccc(C(F)(F)F)c1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158777 | 81265 | 0 | None | -7 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 558 | 8 | 1 | 4 | 6.3 | O=C(O)[C@H](Cc1cccc(C(F)(F)F)c1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71451391 | 81269 | 0 | None | -12 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 472 | 8 | 1 | 4 | 4.5 | Cc1cc(F)ccc1OC1CCN(CC2CCN([C@@H](Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158781 | 81269 | 0 | None | -12 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 472 | 8 | 1 | 4 | 4.5 | Cc1cc(F)ccc1OC1CCN(CC2CCN([C@@H](Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 16040671 | 81279 | 0 | None | -56 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 502 | 8 | 1 | 4 | 5.4 | Cc1cc(Cl)ccc1OC1CCN(CC2CCN([C@@](C)(Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158791 | 81279 | 0 | None | -56 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 502 | 8 | 1 | 4 | 5.4 | Cc1cc(Cl)ccc1OC1CCN(CC2CCN([C@@](C)(Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 127051843 | 140751 | 0 | None | -7 | 9 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 304 | 5 | 0 | 3 | 3.6 | N#Cc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818200 | 140751 | 0 | None | -7 | 9 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 304 | 5 | 0 | 3 | 3.6 | N#Cc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 168279725 | 191155 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 728 | 19 | 6 | 8 | 1.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5188589 | 191155 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 728 | 19 | 6 | 8 | 1.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168292703 | 192060 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 726 | 18 | 5 | 7 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5202570 | 192060 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 726 | 18 | 5 | 7 | 2.9 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44267106 | 98490 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 368 | 0 | 1 | 3 | 4.0 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(O)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL275993 | 98490 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 368 | 0 | 1 | 3 | 4.0 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(O)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 44304325 | 201678 | 0 | None | -74 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 389 | 11 | 1 | 4 | 3.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)NCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL60620 | 201678 | 0 | None | -74 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 389 | 11 | 1 | 4 | 3.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)NCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 10473209 | 62674 | 3 | None | -6456 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 352 | 4 | 1 | 5 | 2.6 | CNC(=O)c1cnc(Oc2ccc3c(c2)CCN(C2CCC2)CC3)cn1 | 10.1016/j.bmcl.2013.09.090 | |||
| CHEMBL1783890 | 62674 | 3 | None | -6456 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 352 | 4 | 1 | 5 | 2.6 | CNC(=O)c1cnc(Oc2ccc3c(c2)CCN(C2CCC2)CC3)cn1 | 10.1016/j.bmcl.2013.09.090 | |||
| 127051844 | 140847 | 0 | None | -125 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 322 | 6 | 1 | 3 | 2.8 | NC(=O)c1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819427 | 140847 | 0 | None | -125 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 322 | 6 | 1 | 3 | 2.8 | NC(=O)c1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 9974306 | 204474 | 0 | None | -199 | 4 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 336 | 8 | 3 | 2 | 3.4 | S=C(NCCCCCc1c[nH]cn1)NCc1ccc(Cl)cc1 | 10.1021/jm00012a025 | |||
| CHEMBL72372 | 204474 | 0 | None | -199 | 4 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 336 | 8 | 3 | 2 | 3.4 | S=C(NCCCCCc1c[nH]cn1)NCc1ccc(Cl)cc1 | 10.1021/jm00012a025 | |||
| 2061019 | 55103 | 17 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 227 | 5 | 1 | 2 | 2.6 | NCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL1616890 | 55103 | 17 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 227 | 5 | 1 | 2 | 2.6 | NCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3916710 | 55103 | 17 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 227 | 5 | 1 | 2 | 2.6 | NCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 134142912 | 154522 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2cccc(OC3CCNCC3)c2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3913361 | 154522 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2cccc(OC3CCNCC3)c2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3990797 | 154522 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2cccc(OC3CCNCC3)c2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 10802230 | 56559 | 0 | None | -389 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 273 | 6 | 1 | 3 | 2.6 | CN(Cc1ccccc1)C(=O)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16404 | 56559 | 0 | None | -389 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 273 | 6 | 1 | 3 | 2.6 | CN(Cc1ccccc1)C(=O)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10358195 | 57460 | 0 | None | -1023 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 313 | 5 | 2 | 3 | 3.6 | O=C(Nc1ccc(C(F)(F)F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16565 | 57460 | 0 | None | -1023 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 313 | 5 | 2 | 3 | 3.6 | O=C(Nc1ccc(C(F)(F)F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10520238 | 57564 | 0 | None | -1288 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 327 | 6 | 2 | 3 | 3.3 | O=C(NCc1ccc(C(F)(F)F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16654 | 57564 | 0 | None | -1288 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 327 | 6 | 2 | 3 | 3.3 | O=C(NCc1ccc(C(F)(F)F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10708894 | 98633 | 0 | None | -1202 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 293 | 6 | 2 | 3 | 2.9 | O=C(NCc1ccc(Cl)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL277149 | 98633 | 0 | None | -1202 | 2 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 293 | 6 | 2 | 3 | 2.9 | O=C(NCc1ccc(Cl)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10466840 | 204481 | 0 | None | -1584 | 4 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 240 | 7 | 3 | 2 | 2.0 | CC/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| CHEMBL72424 | 204481 | 0 | None | -1584 | 4 | Guinea pig | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 240 | 7 | 3 | 2 | 2.0 | CC/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| 164627020 | 186408 | 0 | None | -363 | 4 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 422 | 7 | 4 | 4 | 3.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4876025 | 186408 | 0 | None | -363 | 4 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 422 | 7 | 4 | 4 | 3.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 25271818 | 12967 | 58 | None | -1 | 2 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 5281071 | 12967 | 58 | None | -1 | 2 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL1189432 | 12967 | 58 | None | -1 | 2 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL1719 | 12967 | 58 | None | -1 | 2 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 44622869 | 197717 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 371 | 5 | 1 | 2 | 5.1 | Cc1ccc(CN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL571390 | 197717 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 371 | 5 | 1 | 2 | 5.1 | Cc1ccc(CN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 71151588 | 118258 | 0 | None | -1584 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 518 | 9 | 1 | 7 | 3.6 | NC(=O)c1ccccc1OCCCN1CCN(c2cccc3c2ccn3S(=O)(=O)c2ccccc2)CC1 | 10.1016/j.ejmech.2014.12.045 | |||
| CHEMBL3409256 | 118258 | 0 | None | -1584 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 518 | 9 | 1 | 7 | 3.6 | NC(=O)c1ccccc1OCCCN1CCN(c2cccc3c2ccn3S(=O)(=O)c2ccccc2)CC1 | 10.1016/j.ejmech.2014.12.045 | |||
| 14885632 | 21003 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 348 | 1 | 0 | 3 | 3.6 | COc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C(C)=O)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL131155 | 21003 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 348 | 1 | 0 | 3 | 3.6 | COc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C(C)=O)CC1 | 10.1021/jm00105a069 | |||
| 44334235 | 4631 | 0 | None | -1445 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 442 | 10 | 1 | 5 | 3.4 | Cc1ccccc1S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)C1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL102929 | 4631 | 0 | None | -1445 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 442 | 10 | 1 | 5 | 3.4 | Cc1ccccc1S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)C1 | 10.1016/s0960-894x(02)00685-6 | |||
| 53318873 | 57764 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 360 | 7 | 0 | 5 | 4.1 | C[C@H](C1=C(CCN(C)Cc2ncco2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669421 | 57764 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 360 | 7 | 0 | 5 | 4.1 | C[C@H](C1=C(CCN(C)Cc2ncco2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 44335389 | 5167 | 0 | None | 3 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 413 | 8 | 0 | 6 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccccc3[N+](=O)[O-])cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105952 | 5167 | 0 | None | 3 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 413 | 8 | 0 | 6 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccccc3[N+](=O)[O-])cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168277076 | 190474 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 755 | 21 | 6 | 8 | 2.3 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5178882 | 190474 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 755 | 21 | 6 | 8 | 2.3 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304014 | 100785 | 0 | None | -1905 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 431 | 10 | 1 | 6 | 2.3 | CC(C)(C)OC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL293033 | 100785 | 0 | None | -1905 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 431 | 10 | 1 | 6 | 2.3 | CC(C)(C)OC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 168277076 | 190474 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 755 | 21 | 6 | 8 | 2.3 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5178882 | 190474 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 755 | 21 | 6 | 8 | 2.3 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 155528188 | 171321 | 0 | None | - | 1 | Guinea pig | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 316 | 5 | 0 | 3 | 3.0 | CC1CCCCN1CCCOc1ccc2c(c1)C(=O)N(C)CC2 | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4461154 | 171321 | 0 | None | - | 1 | Guinea pig | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 316 | 5 | 0 | 3 | 3.0 | CC1CCCCN1CCCOc1ccc2c(c1)C(=O)N(C)CC2 | 10.1016/j.bmcl.2019.04.015 | |||
| 44304475 | 202767 | 0 | None | -309 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 348 | 8 | 0 | 5 | 2.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)CC)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62066 | 202767 | 0 | None | -309 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 348 | 8 | 0 | 5 | 2.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)CC)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 164611757 | 184903 | 0 | None | -22 | 6 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 402 | 8 | 4 | 4 | 2.8 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2sc(N)nc2C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4853107 | 184903 | 0 | None | -22 | 6 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 402 | 8 | 4 | 4 | 2.8 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2sc(N)nc2C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 44304451 | 102290 | 0 | None | -977 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 417 | 12 | 1 | 5 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL303369 | 102290 | 0 | None | -977 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 417 | 12 | 1 | 5 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 71525681 | 89728 | 0 | None | -2041 | 6 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 298 | 3 | 2 | 6 | 1.7 | CNC1CN(c2nc(N)nc3cc(C4CCCC4)cnc23)C1 | 10.1016/j.bmcl.2013.02.091 | |||
| CHEMBL2376803 | 89728 | 0 | None | -2041 | 6 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 298 | 3 | 2 | 6 | 1.7 | CNC1CN(c2nc(N)nc3cc(C4CCCC4)cnc23)C1 | 10.1016/j.bmcl.2013.02.091 | |||
| 71528209 | 86972 | 0 | None | -257 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 465 | 6 | 0 | 3 | 5.8 | CC1=CC(C)=[N+]2C1=C(c1ccc(OCCCN3CCCCC3)cc1)c1c(C)cc(C)n1[B-]2(F)F | 10.1021/ml300383n | |||
| CHEMBL2323582 | 86972 | 0 | None | -257 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 465 | 6 | 0 | 3 | 5.8 | CC1=CC(C)=[N+]2C1=C(c1ccc(OCCCN3CCCCC3)cc1)c1c(C)cc(C)n1[B-]2(F)F | 10.1021/ml300383n | |||
| 44209480 | 70170 | 0 | None | -151 | 11 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 3.4 | Fc1ccc(CCCCN2CCN(c3ccccn3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL1940418 | 70170 | 0 | None | -151 | 11 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 3.4 | Fc1ccc(CCCCN2CCN(c3ccccn3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| 3015863 | 199757 | 10 | None | 1 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 225 | 5 | 1 | 1 | 3.6 | NCCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL593734 | 199757 | 10 | None | 1 | 2 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 225 | 5 | 1 | 1 | 3.6 | NCCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| 57402471 | 67876 | 0 | None | -15 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 469 | 8 | 1 | 5 | 4.0 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910378 | 67876 | 0 | None | -15 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 469 | 8 | 1 | 5 | 4.0 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| 44304415 | 202028 | 0 | None | -7079 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 505 | 13 | 2 | 7 | 3.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](CO)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL60837 | 202028 | 0 | None | -7079 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 505 | 13 | 2 | 7 | 3.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](CO)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304431 | 202941 | 0 | None | -724 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 566 | 14 | 1 | 7 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](Cc3ccncc3)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62903 | 202941 | 0 | None | -724 | 3 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 566 | 14 | 1 | 7 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](Cc3ccncc3)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 164619208 | 185662 | 0 | None | -588 | 4 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 378 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccccc1F | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4864852 | 185662 | 0 | None | -588 | 4 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 378 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccccc1F | 10.1016/j.ejmech.2021.113190 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0002432 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0002432 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0002432 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0002432 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0002432 | |||
| 46884155 | 8326 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1ncccc1[C@@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092813 | 8326 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1ncccc1[C@@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 10075223 | 23190 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 4 | 6.7 | CC(C)(C(=O)O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL133127 | 23190 | 0 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 515 | 8 | 1 | 4 | 6.7 | CC(C)(C(=O)O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 44389302 | 122933 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 653 | 13 | 1 | 6 | 7.3 | O=C(OCc1ccccc1)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL360666 | 122933 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 653 | 13 | 1 | 6 | 7.3 | O=C(OCc1ccccc1)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 135356876 | 174074 | 0 | None | 7 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 464 | 5 | 2 | 6 | 5.5 | O=C(O)c1cc(-c2ccc(C3CCNCC3)cc2)cc(-n2cc(-c3ccc(Cl)s3)nn2)c1 | 10.1021/acs.jmedchem.6b00044 | |||
| CHEMBL4544251 | 174074 | 0 | None | 7 | 3 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 464 | 5 | 2 | 6 | 5.5 | O=C(O)c1cc(-c2ccc(C3CCNCC3)cc2)cc(-n2cc(-c3ccc(Cl)s3)nn2)c1 | 10.1021/acs.jmedchem.6b00044 | |||
| 14554127 | 113325 | 0 | None | -3 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 380 | 2 | 0 | 2 | 5.1 | CCCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL331603 | 113325 | 0 | None | -3 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 380 | 2 | 0 | 2 | 5.1 | CCCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| 5624 | 32693 | 14 | None | -5 | 10 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 520 | 5 | 1 | 8 | 4.2 | Cc1c(C)c2c(c(C)c1O)CCC(C)(CN1CCN(c3cc(N4CCCC4)nc(N4CCCC4)n3)CC1)O2 | nan | |||
| CHEMBL1203324 | 32693 | 14 | None | -5 | 10 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 520 | 5 | 1 | 8 | 4.2 | Cc1c(C)c2c(c(C)c1O)CCC(C)(CN1CCN(c3cc(N4CCCC4)nc(N4CCCC4)n3)CC1)O2 | nan | |||
| CHEMBL141343 | 32693 | 14 | None | -5 | 10 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 520 | 5 | 1 | 8 | 4.2 | Cc1c(C)c2c(c(C)c1O)CCC(C)(CN1CCN(c3cc(N4CCCC4)nc(N4CCCC4)n3)CC1)O2 | nan | |||
| 57345617 | 70456 | 0 | None | -186 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 387 | 6 | 1 | 2 | 5.3 | OC1(c2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2CCCCc1ccc(F)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946123 | 70456 | 0 | None | -186 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 387 | 6 | 1 | 2 | 5.3 | OC1(c2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2CCCCc1ccc(F)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| 76518514 | 113537 | 0 | None | -186 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 387 | 6 | 1 | 2 | 5.3 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCCc1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL3321788 | 113537 | 0 | None | -186 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 387 | 6 | 1 | 2 | 5.3 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCCc1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| 168290077 | 191413 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 786 | 21 | 7 | 9 | 1.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192678 | 191413 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 786 | 21 | 7 | 9 | 1.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304319 | 202634 | 0 | None | -194 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.8 | C[C@H](CN)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL61288 | 202634 | 0 | None | -194 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.8 | C[C@H](CN)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 132075278 | 162644 | 0 | None | -30 | 5 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 308 | 3 | 0 | 3 | 3.1 | c1ccc(CN2CCc3cc(N4CCOCC4)ccc3C2)cc1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4169752 | 162644 | 0 | None | -30 | 5 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 308 | 3 | 0 | 3 | 3.1 | c1ccc(CN2CCc3cc(N4CCOCC4)ccc3C2)cc1 | 10.1016/j.ejmech.2018.02.024 | |||
| 168290077 | 191413 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 786 | 21 | 7 | 9 | 1.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192678 | 191413 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 786 | 21 | 7 | 9 | 1.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 10354158 | 52138 | 0 | None | -5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 237 | 3 | 1 | 1 | 3.5 | NCCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL158780 | 52138 | 0 | None | -5 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 237 | 3 | 1 | 1 | 3.5 | NCCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 155536609 | 172219 | 0 | None | - | 1 | Guinea pig | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 1.7 | CN1CCc2ccc(OCCCN3CCC(=O)CC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4474007 | 172219 | 0 | None | - | 1 | Guinea pig | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 1.7 | CN1CCc2ccc(OCCCN3CCC(=O)CC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 127051843 | 140751 | 0 | None | -7 | 9 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 304 | 5 | 0 | 3 | 3.6 | N#Cc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818200 | 140751 | 0 | None | -7 | 9 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 304 | 5 | 0 | 3 | 3.6 | N#Cc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 44304288 | 102207 | 0 | None | -831 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 386 | 11 | 0 | 4 | 3.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C3CC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL302886 | 102207 | 0 | None | -831 | 3 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 386 | 11 | 0 | 4 | 3.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C3CC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 46967967 | 120817 | 5 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 299 | 4 | 0 | 4 | 3.4 | c1cnc2c(c1)cc([C@@H]1CCCO1)n2CCN1CCCCC1 | 10.1021/jm2011589 | |||
| CHEMBL3557423 | 120817 | 5 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 299 | 4 | 0 | 4 | 3.4 | c1cnc2c(c1)cc([C@@H]1CCCO1)n2CCN1CCCCC1 | 10.1021/jm2011589 | |||
| 12488 | 1657 | 56 | None | -2 | 23 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| 941361 | 1657 | 56 | None | -2 | 23 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| CHEMBL30008 | 1657 | 56 | None | -2 | 23 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| DB04841 | 1657 | 56 | None | -2 | 23 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | nan | |||
| 132356 | 14677 | 1 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL1205688 | 14677 | 1 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL133778 | 14677 | 1 | None | - | 1 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 135458410 | 167189 | 0 | None | -3 | 6 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | CC1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
| CHEMBL429136 | 167189 | 0 | None | -3 | 6 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | CC1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
| 45272070 | 195284 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 375 | 4 | 0 | 5 | 4.3 | Fc1ccc(Cn2c(N3CCC(n4cccn4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL551347 | 195284 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 375 | 4 | 0 | 5 | 4.3 | Fc1ccc(Cn2c(N3CCC(n4cccn4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 4806 | 4008 | 88 | None | -5 | 13 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
| 7351 | 4008 | 88 | None | -5 | 13 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
| 9966051 | 4008 | 88 | None | -5 | 13 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
| CHEMBL2104993 | 4008 | 88 | None | -5 | 13 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
| DB09068 | 4008 | 88 | None | -5 | 13 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | 10.1021/jm101459g | |||
| 44312748 | 204765 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 496 | 7 | 2 | 5 | 3.8 | NC(=O)N(O)CCC#C[C@H]1CC[C@H](CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)O1 | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL74688 | 204765 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 496 | 7 | 2 | 5 | 3.8 | NC(=O)N(O)CCC#C[C@H]1CC[C@H](CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)O1 | 10.1016/j.bmcl.2004.02.005 | |||
| 44335185 | 107391 | 0 | None | -1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 446 | 7 | 0 | 4 | 4.7 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(Br)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL317900 | 107391 | 0 | None | -1 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 446 | 7 | 0 | 4 | 4.7 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(Br)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168294445 | 193010 | 0 | None | 1 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.6 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCC2CCc3nc(N)sc3C2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5208113 | 193010 | 0 | None | 1 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.6 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCC2CCc3nc(N)sc3C2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222768 | 193010 | 0 | None | 1 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.6 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCC2CCc3nc(N)sc3C2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168273471 | 192801 | 0 | None | -12 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 596 | 17 | 8 | 10 | 0.7 | N/C(=N\C(=O)NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5173079 | 192801 | 0 | None | -12 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 596 | 17 | 8 | 10 | 0.7 | N/C(=N\C(=O)NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221433 | 192801 | 0 | None | -12 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 596 | 17 | 8 | 10 | 0.7 | N/C(=N\C(=O)NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168273549 | 192803 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5174342 | 192803 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221438 | 192803 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 76325295 | 105476 | 0 | None | -234 | 4 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 490 | 7 | 0 | 6 | 5.9 | Cc1c(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)ccc2c3c(c(=O)oc12)CCC3 | 10.1016/j.ejmech.2014.01.012 | |||
| CHEMBL3120696 | 105476 | 0 | None | -234 | 4 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 490 | 7 | 0 | 6 | 5.9 | Cc1c(OCCCCN2CCC(c3noc4cc(F)ccc34)CC2)ccc2c3c(c(=O)oc12)CCC3 | 10.1016/j.ejmech.2014.01.012 | |||
| 168288713 | 191377 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 799 | 23 | 7 | 9 | 2.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192305 | 191377 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 799 | 23 | 7 | 9 | 2.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168288713 | 191377 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 799 | 23 | 7 | 9 | 2.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192305 | 191377 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 799 | 23 | 7 | 9 | 2.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 127026018 | 137492 | 0 | None | 3 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 399 | 5 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)nc3c2-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753985 | 137492 | 0 | None | 3 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 399 | 5 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)nc3c2-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 95198280 | 162091 | 0 | None | -1 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 351 | 5 | 1 | 5 | 3.4 | Cc1oc(-c2ccc3ccccc3c2)nc1CN1CCO[C@H](CCN)C1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4160967 | 162091 | 0 | None | -1 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 351 | 5 | 1 | 5 | 3.4 | Cc1oc(-c2ccc3ccccc3c2)nc1CN1CCO[C@H](CCN)C1 | 10.1021/acs.jmedchem.8b00718 | |||
| 57403981 | 70495 | 0 | None | -14 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 426 | 6 | 1 | 4 | 5.8 | OC1(c2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2CCCCc1nc2ccccc2s1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946745 | 70495 | 0 | None | -14 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 426 | 6 | 1 | 4 | 5.8 | OC1(c2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2CCCCc1nc2ccccc2s1 | 10.1016/j.bmc.2012.01.022 | |||
| 11653679 | 181191 | 1 | None | -28 | 11 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 374 | 6 | 0 | 3 | 4.7 | O=C(CCCN1CCCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL476108 | 181191 | 1 | None | -28 | 11 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 374 | 6 | 0 | 3 | 4.7 | O=C(CCCN1CCCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 10251906 | 2743 | 18 | None | -1548 | 8 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 427 | 8 | 1 | 4 | 3.6 | IC1=CC(=C(C=C1OC)CCNCC2=C(C=CC=C2)OC)OC | 10.1016/j.bmc.2008.04.050 | |||
| 13550 | 2743 | 18 | None | -1548 | 8 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 427 | 8 | 1 | 4 | 3.6 | IC1=CC(=C(C=C1OC)CCNCC2=C(C=CC=C2)OC)OC | 10.1016/j.bmc.2008.04.050 | |||
| CHEMBL1908863 | 2743 | 18 | None | -1548 | 8 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 427 | 8 | 1 | 4 | 3.6 | IC1=CC(=C(C=C1OC)CCNCC2=C(C=CC=C2)OC)OC | 10.1016/j.bmc.2008.04.050 | |||
| 44313266 | 204613 | 0 | None | -3 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 223 | 2 | 1 | 1 | 2.9 | CNCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL73307 | 204613 | 0 | None | -3 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 223 | 2 | 1 | 1 | 2.9 | CNCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 9842252 | 131443 | 18 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 296 | 1 | 2 | 4 | 1.2 | NC(=O)c1cnc2n1CCc1ccccc1C21CCNCC1 | 10.1021/jm049495j | |||
| CHEMBL369075 | 131443 | 18 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 296 | 1 | 2 | 4 | 1.2 | NC(=O)c1cnc2n1CCc1ccccc1C21CCNCC1 | 10.1021/jm049495j | |||
| CHEMBL539843 | 131443 | 18 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 296 | 1 | 2 | 4 | 1.2 | NC(=O)c1cnc2n1CCc1ccccc1C21CCNCC1 | 10.1021/jm049495j | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmc.2008.06.030 | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmc.2008.06.030 | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmc.2008.06.030 | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmc.2008.06.030 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm030480f | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm030480f | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm030480f | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm030480f | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm030480f | |||
| 9872445 | 66779 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 556 | 6 | 2 | 5 | 5.3 | NC(=O)N(O)CCC#Cc1ccc(OCCN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL185905 | 66779 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 556 | 6 | 2 | 5 | 5.3 | NC(=O)N(O)CCC#Cc1ccc(OCCN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 1588 | 2325 | 27 | None | -35 | 44 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| 28864 | 2325 | 27 | None | -35 | 44 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| 43 | 2325 | 27 | None | -35 | 44 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| CHEMBL157138 | 2325 | 27 | None | -35 | 44 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| DB00589 | 2325 | 27 | None | -35 | 44 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | nan | |||
| 56820088 | 162118 | 4 | None | 169 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 340 | 4 | 0 | 6 | 3.5 | c1ccc(-c2nc(CN3CCCN(c4nccs4)CC3)co2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4161436 | 162118 | 4 | None | 169 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 340 | 4 | 0 | 6 | 3.5 | c1ccc(-c2nc(CN3CCCN(c4nccs4)CC3)co2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| 59652086 | 114592 | 0 | None | 85 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 448 | 8 | 2 | 6 | 3.6 | COc1cccc(CNC(=O)c2nc3scc(CN(C)Cc4ccccc4)c3c(=O)[nH]2)c1 | 10.6019/CHEMBL5212743 | |||
| CHEMBL3337895 | 114592 | 0 | None | 85 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 448 | 8 | 2 | 6 | 3.6 | COc1cccc(CNC(=O)c2nc3scc(CN(C)Cc4ccccc4)c3c(=O)[nH]2)c1 | 10.6019/CHEMBL5212743 | |||
| 44288945 | 168915 | 0 | None | -47 | 7 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 485 | 7 | 2 | 3 | 4.4 | CC1=C(C(=O)NCCCN2CCC(c3ccc(F)cc3)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL43860 | 168915 | 0 | None | -47 | 7 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 485 | 7 | 2 | 3 | 4.4 | CC1=C(C(=O)NCCCN2CCC(c3ccc(F)cc3)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| 57334102 | 90508 | 0 | None | -5 | 5 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 450 | 7 | 0 | 6 | 5.4 | Cc1cc(=O)oc2cc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc12 | 10.1021/jm400408r | |||
| CHEMBL2387260 | 90508 | 0 | None | -5 | 5 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 450 | 7 | 0 | 6 | 5.4 | Cc1cc(=O)oc2cc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc12 | 10.1021/jm400408r | |||
| 71462102 | 81288 | 0 | None | 6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 478 | 7 | 1 | 5 | 4.4 | O=C(O)C(c1ccccc1)N1CCO[C@@H](CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158817 | 81288 | 0 | None | 6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 478 | 7 | 1 | 5 | 4.4 | O=C(O)C(c1ccccc1)N1CCO[C@@H](CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71456725 | 81298 | 1 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)Cc1ccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158827 | 81298 | 1 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)Cc1ccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71463288 | 84204 | 0 | None | 6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 8 | 1 | 5 | 5.0 | COc1cccc(SC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208421 | 84204 | 0 | None | 6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 441 | 8 | 1 | 5 | 5.0 | COc1cccc(SC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 59296064 | 84206 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 7 | 2 | 5 | 3.5 | N#Cc1cccc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208423 | 84206 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 447 | 7 | 2 | 5 | 3.5 | N#Cc1cccc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 59296000 | 84215 | 0 | None | -7 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 478 | 6 | 3 | 6 | 3.1 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)n1c(=O)[nH]c2ccccc21 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208432 | 84215 | 0 | None | -7 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 478 | 6 | 3 | 6 | 3.1 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)n1c(=O)[nH]c2ccccc21 | 10.1016/j.bmcl.2012.09.113 | |||
| 59295982 | 84014 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 568 | 8 | 4 | 7 | 2.1 | NS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207282 | 84014 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 568 | 8 | 4 | 7 | 2.1 | NS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| 59295925 | 84101 | 0 | None | -2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 567 | 8 | 3 | 7 | 2.9 | CS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207671 | 84101 | 0 | None | -2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 567 | 8 | 3 | 7 | 2.9 | CS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| 71723301 | 91009 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 392 | 1 | 0 | 2 | 6.1 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CCCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL2396897 | 91009 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 392 | 1 | 0 | 2 | 6.1 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CCCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 25147772 | 173409 | 9 | None | -6 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 373 | 4 | 1 | 6 | 3.7 | CN1CCN(c2nc(NCc3cccs3)c3cc(Cl)ccc3n2)CC1 | 10.1021/jm800876b | |||
| CHEMBL452847 | 173409 | 9 | None | -6 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 373 | 4 | 1 | 6 | 3.7 | CN1CCN(c2nc(NCc3cccs3)c3cc(Cl)ccc3n2)CC1 | 10.1021/jm800876b | |||
| 134151839 | 152978 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 323 | 7 | 0 | 2 | 4.9 | c1ccc(Cc2ccccc2OCCCN2CCCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3975229 | 152978 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 323 | 7 | 0 | 2 | 4.9 | c1ccc(Cc2ccccc2OCCCN2CCCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 49836637 | 18678 | 0 | None | 1 | 4 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 375 | 2 | 1 | 3 | 4.5 | O=C(O)C1=CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | |||
| CHEMBL1277126 | 18678 | 0 | None | 1 | 4 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 375 | 2 | 1 | 3 | 4.5 | O=C(O)C1=CCN(C2CCC3(Cc4ccccc4Oc4ccccc43)C2)CC1 | 10.1021/jm100856p | |||
| 71458868 | 82232 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 568 | 6 | 1 | 6 | 4.8 | Cc1c(Cl)ccc(OC2CCN(C3CCN(C(=O)NS(=O)(=O)c4ccc(N(C)C)cc4)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171014 | 82232 | 0 | None | -6 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 568 | 6 | 1 | 6 | 4.8 | Cc1c(Cl)ccc(OC2CCN(C3CCN(C(=O)NS(=O)(=O)c4ccc(N(C)C)cc4)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.124 | |||
| 17963363 | 82254 | 0 | None | -2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 545 | 5 | 1 | 5 | 5.1 | O=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171035 | 82254 | 0 | None | -2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 545 | 5 | 1 | 5 | 5.1 | O=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963196 | 82255 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 541 | 6 | 1 | 6 | 4.4 | COc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171036 | 82255 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 541 | 6 | 1 | 6 | 4.4 | COc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963258 | 82256 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 554 | 6 | 1 | 6 | 4.5 | CN(C)c1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171037 | 82256 | 0 | None | 2 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 554 | 6 | 1 | 6 | 4.5 | CN(C)c1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963332 | 82259 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 541 | 6 | 1 | 6 | 4.4 | COc1ccccc1S(=O)(=O)NC(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171040 | 82259 | 0 | None | 1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 541 | 6 | 1 | 6 | 4.4 | COc1ccccc1S(=O)(=O)NC(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963336 | 82263 | 0 | None | 5 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 536 | 5 | 1 | 6 | 4.3 | N#Cc1cccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171044 | 82263 | 0 | None | 5 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 536 | 5 | 1 | 6 | 4.3 | N#Cc1cccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963201 | 82266 | 0 | None | -31 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 539 | 5 | 1 | 5 | 5.0 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(C)c4Cl)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171047 | 82266 | 0 | None | -31 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 539 | 5 | 1 | 5 | 5.0 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(C)c4Cl)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 14885626 | 32172 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 414 | 1 | 0 | 2 | 5.6 | O=C(c1ccccc1)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL140924 | 32172 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 414 | 1 | 0 | 2 | 5.6 | O=C(c1ccccc1)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 14885631 | 34940 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 332 | 0 | 0 | 2 | 3.9 | CC(=O)N1CCC(=C2c3ccc(C)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL143242 | 34940 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 332 | 0 | 0 | 2 | 3.9 | CC(=O)N1CCC(=C2c3ccc(C)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 135986088 | 178115 | 0 | None | -57 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 543 | 7 | 1 | 6 | 6.5 | Clc1ccc2c(c1)N=C(N1CCN(Cc3ccc(OCCCN4CCCCC4)cc3)CC1)c1ccccc1N2 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL464811 | 178115 | 0 | None | -57 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 543 | 7 | 1 | 6 | 6.5 | Clc1ccc2c(c1)N=C(N1CCN(Cc3ccc(OCCCN4CCCCC4)cc3)CC1)c1ccccc1N2 | 10.1016/j.bmcl.2008.09.012 | |||
| 44312371 | 105483 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 492 | 6 | 2 | 5 | 4.4 | CC(C#Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1)N(O)C(N)=O | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL312082 | 105483 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 492 | 6 | 2 | 5 | 4.4 | CC(C#Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1)N(O)C(N)=O | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL4576555 | 214017 | 5 | None | -1 | 19 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccc4n3)cc2)CC1 | 10.6019/CHEMBL5212743 | |||||
| CHEMBL4576555 | 214017 | 5 | None | -1 | 19 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccc4n3)cc2)CC1 | 10.6019/CHEMBL4507307 | |||||
| 44304558 | 101019 | 0 | None | -602 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 374 | 11 | 0 | 4 | 3.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)CC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL294502 | 101019 | 0 | None | -602 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 374 | 11 | 0 | 4 | 3.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)CC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 4023 | 198 | 24 | None | -660 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 349 | 7 | 0 | 4 | 3.6 | N#Cc1ccc(cc1)c1ccc(cc1)OCCCN1CC[C@H](C1)N(C)C | 10.1016/s0960-894x(02)00648-0 | |||
| 9884746 | 198 | 24 | None | -660 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 349 | 7 | 0 | 4 | 3.6 | N#Cc1ccc(cc1)c1ccc(cc1)OCCCN1CC[C@H](C1)N(C)C | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL319000 | 198 | 24 | None | -660 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 349 | 7 | 0 | 4 | 3.6 | N#Cc1ccc(cc1)c1ccc(cc1)OCCCN1CC[C@H](C1)N(C)C | 10.1016/s0960-894x(02)00648-0 | |||
| 127026016 | 137489 | 0 | None | 13 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 385 | 4 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCc3ccccc3)nc3c2-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753967 | 137489 | 0 | None | 13 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 385 | 4 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCc3ccccc3)nc3c2-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 649745 | 31482 | 54 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 303 | 3 | 1 | 7 | 0.5 | C1CCN(c2nc(N3CCCC3)nc(N3CCNCC3)n2)C1 | 10.1021/jm2011589 | |||
| CHEMBL1403257 | 31482 | 54 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 303 | 3 | 1 | 7 | 0.5 | C1CCN(c2nc(N3CCCC3)nc(N3CCNCC3)n2)C1 | 10.1021/jm2011589 | |||
| 44304450 | 202867 | 0 | None | -239 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 417 | 12 | 1 | 5 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](N)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62592 | 202867 | 0 | None | -239 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 417 | 12 | 1 | 5 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](N)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 162665485 | 182357 | 0 | None | -58 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 468 | 4 | 0 | 3 | 5.3 | C[C@H]1CN(CC[C@H]2CC[C@H](N3C(=O)[C@H]4[C@H]5CC[C@H](C5)[C@H]4C3=O)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL4784751 | 182357 | 0 | None | -58 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 468 | 4 | 0 | 3 | 5.3 | C[C@H]1CN(CC[C@H]2CC[C@H](N3C(=O)[C@H]4[C@H]5CC[C@H](C5)[C@H]4C3=O)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| 112936357 | 137359 | 1 | None | 18 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 373 | 6 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)cc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752978 | 137359 | 1 | None | 18 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 373 | 6 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)cc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 127035837 | 137417 | 0 | None | 5 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 403 | 4 | 1 | 5 | 3.7 | CN1CCN(c2nc(NCc3ccc(F)cc3)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753334 | 137417 | 0 | None | 5 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 403 | 4 | 1 | 5 | 3.7 | CN1CCN(c2nc(NCc3ccc(F)cc3)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 164626370 | 186473 | 0 | None | -1 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.8 | CCCCCCNC(=O)/N=C(\N)NC1CCc2nc(N)sc2C1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4876799 | 186473 | 0 | None | -1 | 6 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.8 | CCCCCCNC(=O)/N=C(\N)NC1CCc2nc(N)sc2C1 | 10.1016/j.ejmech.2021.113190 | |||
| 18382725 | 116090 | 27 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 412 | 2 | 0 | 4 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(OC)cnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL3357024 | 116090 | 27 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 412 | 2 | 0 | 4 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(OC)cnc32)CC1 | 10.1021/jm501086v | |||
| 10398175 | 180091 | 7 | None | -6 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 209 | 1 | 1 | 1 | 2.7 | NCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL47482 | 180091 | 7 | None | -6 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 209 | 1 | 1 | 1 | 2.7 | NCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 162644910 | 179411 | 0 | None | -18 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 407 | 7 | 0 | 4 | 5.0 | Clc1cccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)c1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4740135 | 179411 | 0 | None | -18 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 407 | 7 | 0 | 4 | 5.0 | Clc1cccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)c1 | 10.1016/j.ejmech.2020.113041 | |||
| 46882181 | 5681 | 0 | None | 1 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 536 | 10 | 2 | 8 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NS(=O)(=O)c5ccccc5)ccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL1077908 | 5681 | 0 | None | 1 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 536 | 10 | 2 | 8 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NS(=O)(=O)c5ccccc5)ccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| 66615691 | 81277 | 0 | None | -125 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 518 | 8 | 1 | 4 | 5.9 | Cc1c(OC2CCN(CC3CCN([C@@](C)(Cc4ccccc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158789 | 81277 | 0 | None | -125 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 518 | 8 | 1 | 4 | 5.9 | Cc1c(OC2CCN(CC3CCN([C@@](C)(Cc4ccccc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 59296109 | 84211 | 0 | None | -12 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 8 | 2 | 6 | 3.0 | CS(=O)(=O)c1ccccc1C(=O)NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208428 | 84211 | 0 | None | -12 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 8 | 2 | 6 | 3.0 | CS(=O)(=O)c1ccccc1C(=O)NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1 | 10.1016/j.bmcl.2012.09.113 | |||
| 127051845 | 140729 | 0 | None | -12 | 9 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 309 | 6 | 0 | 3 | 3.7 | COc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3817898 | 140729 | 0 | None | -12 | 9 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 309 | 6 | 0 | 3 | 3.7 | COc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 71462391 | 82251 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 554 | 6 | 1 | 6 | 3.9 | CS(=O)(=O)c1cccc(C(=O)N2CC[C@@H](N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)[C@H](C(=O)O)C2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171032 | 82251 | 0 | None | 1 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 554 | 6 | 1 | 6 | 3.9 | CS(=O)(=O)c1cccc(C(=O)N2CC[C@@H](N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)[C@H](C(=O)O)C2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| 46881463 | 7218 | 0 | None | -501 | 5 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 293 | 3 | 1 | 2 | 2.7 | O=C1N(CC2CCCCN2)CCN1c1cccc(Cl)c1 | 10.1016/j.bmcl.2010.01.090 | |||
| CHEMBL1085672 | 7218 | 0 | None | -501 | 5 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 293 | 3 | 1 | 2 | 2.7 | O=C1N(CC2CCCCN2)CCN1c1cccc(Cl)c1 | 10.1016/j.bmcl.2010.01.090 | |||
| 9798145 | 104133 | 0 | None | -3981 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 342 | 7 | 0 | 3 | 3.8 | c1cc2c(cc1OCCCN1CCCCC1)CCN(CC1CC1)CC2 | 10.1016/j.bmcl.2013.09.089 | |||
| CHEMBL3094215 | 104133 | 0 | None | -3981 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 342 | 7 | 0 | 3 | 3.8 | c1cc2c(cc1OCCCN1CCCCC1)CCN(CC1CC1)CC2 | 10.1016/j.bmcl.2013.09.089 | |||
| 10429386 | 104134 | 0 | None | -3981 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 372 | 7 | 0 | 4 | 3.5 | c1cc2c(cc1OCCCN1CCCCC1)CCN(CC1CCCO1)CC2 | 10.1016/j.bmcl.2013.09.089 | |||
| CHEMBL3094216 | 104134 | 0 | None | -3981 | 2 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 372 | 7 | 0 | 4 | 3.5 | c1cc2c(cc1OCCCN1CCCCC1)CCN(CC1CCCO1)CC2 | 10.1016/j.bmcl.2013.09.089 | |||
| 44304294 | 202963 | 0 | None | -9 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 485 | 10 | 1 | 5 | 3.9 | N[C@H](Cc1cccc2ccccc12)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL63003 | 202963 | 0 | None | -9 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 485 | 10 | 1 | 5 | 3.9 | N[C@H](Cc1cccc2ccccc12)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 10565409 | 52189 | 0 | None | -977 | 2 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 290 | 6 | 2 | 5 | 2.5 | O=C(Nc1ccc([N+](=O)[O-])cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL15883 | 52189 | 0 | None | -977 | 2 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 290 | 6 | 2 | 5 | 2.5 | O=C(Nc1ccc([N+](=O)[O-])cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 5250783 | 169387 | 3 | None | -1995 | 3 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 226 | 6 | 3 | 2 | 1.6 | C/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| CHEMBL44220 | 169387 | 3 | None | -1995 | 3 | Guinea pig | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 226 | 6 | 3 | 2 | 1.6 | C/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1210 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 1213 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 2725 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 33036 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 4411 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 616 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 6976 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 716121 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL1201353 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL1554789 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL505 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| DB01114 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| DB13679 | 918 | 51 | None | -9 | 21 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(03)00357-3 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | nan | |||
| 1400 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2018.04.059 | |||
| 3658 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2018.04.059 | |||
| 7199 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2018.04.059 | |||
| 91513 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2018.04.059 | |||
| CHEMBL896 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2018.04.059 | |||
| DB00557 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2018.04.059 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm401958n | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm401958n | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm401958n | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm401958n | |||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | |||
| 249 | 505 | 81 | None | -4 | 42 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | |||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | |||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1016/j.bmcl.2011.09.001 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm2011589 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm2011589 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm2011589 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm2011589 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm2011589 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm2011589 | |||
| 11688223 | 8302 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 3.6 | CN(C)CCC1=C(Cc2cccnn2)c2ccc(Cl)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092652 | 8302 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 3.6 | CN(C)CCC1=C(Cc2cccnn2)c2ccc(Cl)cc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030480f | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030480f | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030480f | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030480f | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm030480f | |||
| 155561547 | 175656 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 364 | 1 | 0 | 2 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4581343 | 175656 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 364 | 1 | 0 | 2 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 46884639 | 7725 | 0 | None | 6918 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 309 | 6 | 0 | 4 | 3.0 | COc1nccnc1CC1=C(CCN(C)C)Cc2ccccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1088900 | 7725 | 0 | None | 6918 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 309 | 6 | 0 | 4 | 3.0 | COc1nccnc1CC1=C(CCN(C)C)Cc2ccccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| 46884736 | 7974 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 5 | 0 | 3 | 4.5 | Cc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090528 | 7974 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 312 | 5 | 0 | 3 | 4.5 | Cc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| 45272046 | 195161 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 396 | 7 | 0 | 5 | 3.8 | COCCN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL550337 | 195161 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 396 | 7 | 0 | 5 | 3.8 | COCCN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1021/jm8007618 | |||
| 44326390 | 207847 | 0 | None | 11 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 335 | 2 | 0 | 3 | 3.5 | c1ccc2c(c1)Cc1ccccc1[C@H]1CC(CN3CCOCC3)O[C@H]21 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL96429 | 207847 | 0 | None | 11 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 335 | 2 | 0 | 3 | 3.5 | c1ccc2c(c1)Cc1ccccc1[C@H]1CC(CN3CCOCC3)O[C@H]21 | 10.1016/j.bmcl.2004.03.069 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2008.09.012 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2008.09.012 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2008.09.012 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.bmcl.2008.09.012 | |||
| 15595033 | 195075 | 20 | None | 416 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 338 | 4 | 1 | 4 | 3.4 | CNC1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL549599 | 195075 | 20 | None | 416 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 338 | 4 | 1 | 4 | 3.4 | CNC1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 45272877 | 195845 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 5 | 0 | 5 | 3.6 | COc1ccc(Cn2c(N3CCC(N(C)C)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL558468 | 195845 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 5 | 0 | 5 | 3.6 | COc1ccc(Cn2c(N3CCC(N(C)C)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 45268662 | 195950 | 0 | None | 37 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 442 | 7 | 0 | 4 | 5.4 | CN(CCc1ccccc1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL559557 | 195950 | 0 | None | 37 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 442 | 7 | 0 | 4 | 5.4 | CN(CCc1ccccc1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 46865978 | 8439 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 328 | 6 | 0 | 4 | 4.2 | COc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1093623 | 8439 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 328 | 6 | 0 | 4 | 4.2 | COc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1nccs1 | 10.1016/j.bmcl.2010.02.055 | |||
| 49782792 | 17911 | 0 | None | -7 | 5 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 381 | 3 | 1 | 4 | 3.3 | CC(=O)NCc1ccc2c(c1)[C@@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| CHEMBL1259174 | 17911 | 0 | None | -7 | 5 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 381 | 3 | 1 | 4 | 3.3 | CC(=O)NCc1ccc2c(c1)[C@@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| 59296081 | 84083 | 0 | None | -7 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 608 | 9 | 3 | 7 | 2.9 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(S(=O)(=O)N3CCC3)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207654 | 84083 | 0 | None | -7 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 608 | 9 | 3 | 7 | 2.9 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(S(=O)(=O)N3CCC3)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| 59295978 | 84085 | 0 | None | -1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2c(F)cccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207656 | 84085 | 0 | None | -1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2c(F)cccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| 59295968 | 84086 | 0 | None | -3 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 487 | 7 | 3 | 5 | 3.3 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3c(F)cccc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207657 | 84086 | 0 | None | -3 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 487 | 7 | 3 | 5 | 3.3 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3c(F)cccc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| 155556183 | 174488 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 406 | 2 | 0 | 2 | 6.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CCCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4554533 | 174488 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 406 | 2 | 0 | 2 | 6.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(CC2CCCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 134134675 | 154583 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 315 | 4 | 0 | 2 | 4.4 | CN1CCC(Oc2ccccc2Cc2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3905009 | 154583 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 315 | 4 | 0 | 2 | 4.4 | CN1CCC(Oc2ccccc2Cc2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3991348 | 154583 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 315 | 4 | 0 | 2 | 4.4 | CN1CCC(Oc2ccccc2Cc2ccc(Cl)cc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| 17963227 | 82231 | 0 | None | 39 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 539 | 5 | 0 | 5 | 5.1 | Cc1ccc(S(=O)(=O)N(C)C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171013 | 82231 | 0 | None | 39 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 539 | 5 | 0 | 5 | 5.1 | Cc1ccc(S(=O)(=O)N(C)C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | nan | |||
| 136152971 | 95357 | 0 | None | -1 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
| CHEMBL256694 | 95357 | 0 | None | -1 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 293 | 2 | 2 | 3 | 3.5 | C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.078 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm030480f | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm030480f | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm030480f | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm030480f | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm030480f | |||
| 46884732 | 7910 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 337 | 6 | 0 | 4 | 3.9 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(C)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090176 | 7910 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 337 | 6 | 0 | 4 | 3.9 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(C)ccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| 46884152 | 8252 | 0 | None | 812 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | C[C@@H](c1ncccc1F)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092377 | 8252 | 0 | None | 812 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | C[C@@H](c1ncccc1F)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 10102 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 10.1016/j.bmcl.2009.05.086 | |||
| 1824 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 10.1016/j.bmcl.2009.05.086 | |||
| 65906 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL94454 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 10.1016/j.bmcl.2009.05.086 | |||
| DB12523 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 10.1016/j.bmcl.2009.05.086 | |||
| 9857902 | 60804 | 0 | None | 6 | 5 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 311 | 1 | 0 | 4 | 3.5 | Cc1ccc2n1C=C(N1CCN(C)CC1)c1ccccc1S2 | 10.1021/jm0309811 | |||
| CHEMBL176169 | 60804 | 0 | None | 6 | 5 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 311 | 1 | 0 | 4 | 3.5 | Cc1ccc2n1C=C(N1CCN(C)CC1)c1ccccc1S2 | 10.1021/jm0309811 | |||
| 9796255 | 129048 | 0 | None | -2 | 8 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 297 | 1 | 0 | 4 | 3.2 | CN1CCN(C2=Cn3cccc3Sc3ccccc32)CC1 | 10.1021/jm0309811 | |||
| CHEMBL367045 | 129048 | 0 | None | -2 | 8 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 297 | 1 | 0 | 4 | 3.2 | CN1CCN(C2=Cn3cccc3Sc3ccccc32)CC1 | 10.1021/jm0309811 | |||
| 46884732 | 7910 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 337 | 6 | 0 | 4 | 3.9 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(C)ccc21 | 10.1016/j.bmcl.2010.07.117 | |||
| CHEMBL1090176 | 7910 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 337 | 6 | 0 | 4 | 3.9 | COc1nccnc1[C@H](C)C1=C(CCN(C)C)Cc2cc(C)ccc21 | 10.1016/j.bmcl.2010.07.117 | |||
| 2274 | 3173 | 58 | None | -3 | 31 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| 4917 | 3173 | 58 | None | -3 | 31 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| 7279 | 3173 | 58 | None | -3 | 31 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| CHEMBL728 | 3173 | 58 | None | -3 | 31 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| DB00433 | 3173 | 58 | None | -3 | 31 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | nan | |||
| 53318872 | 57756 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 305 | 5 | 0 | 3 | 3.5 | c1ccc2c(c1)CC(CCN1CCCC1)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669413 | 57756 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 305 | 5 | 0 | 3 | 3.5 | c1ccc2c(c1)CC(CCN1CCCC1)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmc.2008.06.030 | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmc.2008.06.030 | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmc.2008.06.030 | |||
| 45273833 | 195888 | 0 | None | 977 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 420 | 5 | 0 | 4 | 5.5 | CN(C1CCCCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL558933 | 195888 | 0 | None | 977 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 420 | 5 | 0 | 4 | 5.5 | CN(C1CCCCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | nan | |||
| 46884200 | 8322 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 344 | 5 | 0 | 3 | 5.2 | C[C@H](c1cccnc1Cl)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092766 | 8322 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 344 | 5 | 0 | 3 | 5.2 | C[C@H](c1cccnc1Cl)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 11695811 | 8391 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1ncccc1[C@@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1093294 | 8391 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1ncccc1[C@@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 45272890 | 195901 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 409 | 7 | 0 | 5 | 3.7 | CN(C)CCN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL559061 | 195901 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 409 | 7 | 0 | 5 | 3.7 | CN(C)CCN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 135398737 | 958 | 93 | None | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0309811 | |||
| 38 | 958 | 93 | None | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0309811 | |||
| 722 | 958 | 93 | None | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0309811 | |||
| CHEMBL42 | 958 | 93 | None | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0309811 | |||
| DB00363 | 958 | 93 | None | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm0309811 | |||
| 44266958 | 97241 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 382 | 1 | 1 | 3 | 3.8 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(CO)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL268695 | 97241 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 382 | 1 | 1 | 3 | 3.8 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(CO)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 11485192 | 203123 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | CN(C)CC/C=C1/c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL64067 | 203123 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | CN(C)CC/C=C1/c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2020.127681 | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2020.127681 | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2020.127681 | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2020.127681 | |||
| 9419 | 35922 | 35 | None | 125 | 6 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 295 | 3 | 0 | 3 | 3.0 | CN(C)CCN1C(=O)c2ccccc2N(C)c2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| CHEMBL1442422 | 35922 | 35 | None | 125 | 6 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 295 | 3 | 0 | 3 | 3.0 | CN(C)CCN1C(=O)c2ccccc2N(C)c2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| 71450058 | 82574 | 0 | None | 37 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C/CN1CCCC(Cc3ccccc3)C1)c1ccccc1CO2 | 10.1021/jm300682j | |||
| CHEMBL2178582 | 82574 | 0 | None | 37 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C/CN1CCCC(Cc3ccccc3)C1)c1ccccc1CO2 | 10.1021/jm300682j | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | nan | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | nan | |||
| 9863340 | 162027 | 0 | None | -5 | 4 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 352 | 4 | 0 | 4 | 4.0 | Cn1c(=O)sc2cc(CCN3CCC(c4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL415985 | 162027 | 0 | None | -5 | 4 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 352 | 4 | 0 | 4 | 4.0 | Cn1c(=O)sc2cc(CCN3CCC(c4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 45485473 | 197335 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 457 | 9 | 1 | 4 | 5.4 | COC(=O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL568892 | 197335 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 457 | 9 | 1 | 4 | 5.4 | COC(=O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 44404954 | 135265 | 0 | None | -1 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C\CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm058225d | |||
| CHEMBL372588 | 135265 | 0 | None | -1 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C\CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm058225d | |||
| 9937936 | 23115 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C/CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL133080 | 23115 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 453 | 6 | 1 | 3 | 5.6 | O=C(O)Cc1ccc2c(c1)/C(=C/CN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 10049865 | 24748 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 459 | 6 | 1 | 4 | 6.0 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(c3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL134424 | 24748 | 0 | None | - | 1 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 459 | 6 | 1 | 4 | 6.0 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(c3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 44326405 | 111585 | 0 | None | 6 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 309 | 2 | 0 | 3 | 3.8 | CN(C)CC1C[C@@H]2c3ccccc3COc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL328209 | 111585 | 0 | None | 6 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 309 | 2 | 0 | 3 | 3.8 | CN(C)CC1C[C@@H]2c3ccccc3COc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 71212556 | 143562 | 0 | None | -7 | 6 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 433 | 3 | 1 | 6 | 4.6 | Cc1ccc2c(c1)Oc1sc(Cl)cc1C(N1CCN(CC(C)(C)C(=O)O)CC1)=N2 | nan | |||
| CHEMBL3899169 | 143562 | 0 | None | -7 | 6 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 433 | 3 | 1 | 6 | 4.6 | Cc1ccc2c(c1)Oc1sc(Cl)cc1C(N1CCN(CC(C)(C)C(=O)O)CC1)=N2 | nan | |||
| 524022 | 31644 | 1 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 318 | 0 | 0 | 2 | 3.6 | CC(=O)N1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL140483 | 31644 | 1 | None | - | 1 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 318 | 0 | 0 | 2 | 3.6 | CC(=O)N1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 71452695 | 78683 | 0 | None | -5011 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 453 | 10 | 1 | 6 | 3.0 | N#Cc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL2112451 | 78683 | 0 | None | -5011 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 453 | 10 | 1 | 6 | 3.0 | N#Cc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44270248 | 47973 | 0 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 305 | 3 | 1 | 5 | 1.8 | C[C@H]1CN(CCc2ccc3c(c2)sc(=O)n3C)C[C@@H](C)N1 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL15499 | 47973 | 0 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 305 | 3 | 1 | 5 | 1.8 | C[C@H]1CN(CCc2ccc3c(c2)sc(=O)n3C)C[C@@H](C)N1 | 10.1016/s0960-894x(02)00123-3 | |||
| 10156707 | 202642 | 0 | None | -6 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 381 | 9 | 3 | 3 | 4.6 | N=C(CCCc1c[nH]cn1)NCCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL61348 | 202642 | 0 | None | -6 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 381 | 9 | 3 | 3 | 4.6 | N=C(CCCc1c[nH]cn1)NCCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| 10456093 | 197509 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 443 | 9 | 2 | 3 | 5.4 | O=C(O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL570033 | 197509 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 443 | 9 | 2 | 3 | 5.4 | O=C(O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 44304377 | 202777 | 0 | None | -112 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 424 | 11 | 0 | 6 | 3.5 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cnccn3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62115 | 202777 | 0 | None | -112 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 424 | 11 | 0 | 6 | 3.5 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cnccn3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44591134 | 176200 | 0 | None | -169 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 535 | 11 | 0 | 5 | 7.7 | CN(CCCN1c2ccccc2Sc2ccc(Cl)cc21)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL459373 | 176200 | 0 | None | -169 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 535 | 11 | 0 | 5 | 7.7 | CN(CCCN1c2ccccc2Sc2ccc(Cl)cc21)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| 2712 | 916 | 34 | None | -5 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| 3370 | 916 | 34 | None | -5 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| 594 | 916 | 34 | None | -5 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| CHEMBL451 | 916 | 34 | None | -5 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| DB00475 | 916 | 34 | None | -5 | 4 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | nan | |||
| 44304309 | 169216 | 0 | None | -3 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 414 | 8 | 0 | 5 | 3.6 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(F)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL440864 | 169216 | 0 | None | -3 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 414 | 8 | 0 | 5 | 3.6 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(F)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304211 | 102197 | 0 | None | -6918 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.9 | CC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL302829 | 102197 | 0 | None | -6918 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.9 | CC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 127035835 | 137285 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 385 | 4 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCc3ccccc3)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752270 | 137285 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 385 | 4 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCc3ccccc3)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 71519674 | 89729 | 0 | None | -2454 | 5 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 270 | 3 | 2 | 6 | 0.9 | CNC1CN(c2nc(N)nc3cc(C4CC4)cnc23)C1 | 10.1016/j.bmcl.2013.02.091 | |||
| CHEMBL2376804 | 89729 | 0 | None | -2454 | 5 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 270 | 3 | 2 | 6 | 0.9 | CNC1CN(c2nc(N)nc3cc(C4CC4)cnc23)C1 | 10.1016/j.bmcl.2013.02.091 | |||
| 14554138 | 110662 | 37 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 338 | 1 | 0 | 2 | 3.9 | O=CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL325909 | 110662 | 37 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 338 | 1 | 0 | 2 | 3.9 | O=CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm0002432 | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm0002432 | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm0002432 | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm0002432 | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm0002432 | |||
| 57334707 | 90476 | 0 | None | -4 | 5 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 464 | 7 | 0 | 6 | 5.7 | Cc1cc(=O)oc2c(C)c(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc12 | 10.1021/jm400408r | |||
| CHEMBL2387230 | 90476 | 0 | None | -4 | 5 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 464 | 7 | 0 | 6 | 5.7 | Cc1cc(=O)oc2c(C)c(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc12 | 10.1021/jm400408r | |||
| 56966478 | 105468 | 0 | None | 1 | 4 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 0 | 6 | 5.6 | O=c1oc2cc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc2c2c1CCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| CHEMBL3120688 | 105468 | 0 | None | 1 | 4 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 0 | 6 | 5.6 | O=c1oc2cc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)ccc2c2c1CCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| 9844271 | 130682 | 1 | None | -1 | 5 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 333 | 1 | 0 | 4 | 3.6 | CN1CCN([C@@H]2Cn3cccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm010982y | |||
| CHEMBL368324 | 130682 | 1 | None | -1 | 5 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 333 | 1 | 0 | 4 | 3.6 | CN1CCN([C@@H]2Cn3cccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm010982y | |||
| 9844271 | 130682 | 1 | None | -1 | 5 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 333 | 1 | 0 | 4 | 3.6 | CN1CCN([C@@H]2Cn3cccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm0309811 | |||
| CHEMBL368324 | 130682 | 1 | None | -1 | 5 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 333 | 1 | 0 | 4 | 3.6 | CN1CCN([C@@H]2Cn3cccc3Sc3ccc(Cl)cc32)CC1 | 10.1021/jm0309811 | |||
| 2389 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm400408r | |||
| 5073 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm400408r | |||
| 96 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm400408r | |||
| CHEMBL85 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm400408r | |||
| DB00734 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm400408r | |||
| 44267047 | 9405 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 398 | 1 | 0 | 3 | 5.0 | CSc1cnc2c(c1)CCc1cc(Cl)ccc1C2=C1CCN(C(C)=O)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL11158 | 9405 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 398 | 1 | 0 | 3 | 5.0 | CSc1cnc2c(c1)CCc1cc(Cl)ccc1C2=C1CCN(C(C)=O)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 1353 | 1911 | 93 | None | -602 | 83 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm9601720 | |||
| 3559 | 1911 | 93 | None | -602 | 83 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm9601720 | |||
| 86 | 1911 | 93 | None | -602 | 83 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm9601720 | |||
| CHEMBL54 | 1911 | 93 | None | -602 | 83 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm9601720 | |||
| DB00502 | 1911 | 93 | None | -602 | 83 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm9601720 | |||
| 57401706 | 70171 | 0 | None | -37 | 11 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 331 | 6 | 0 | 4 | 3.5 | Fc1ccc(SCCCN2CCN(c3ccccn3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL1940419 | 70171 | 0 | None | -37 | 11 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 331 | 6 | 0 | 4 | 3.5 | Fc1ccc(SCCCN2CCN(c3ccccn3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| 57398985 | 67883 | 0 | None | -16 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 569 | 12 | 2 | 7 | 4.4 | COc1ccc(CN(CCN(C)CC(C)Nc2ccc3[nH]c(C(=O)N4CCN(C)CC4)cc3c2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910385 | 67883 | 0 | None | -16 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 569 | 12 | 2 | 7 | 4.4 | COc1ccc(CN(CCN(C)CC(C)Nc2ccc3[nH]c(C(=O)N4CCN(C)CC4)cc3c2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| 168268680 | 192766 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5172675 | 192766 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221210 | 192766 | 0 | None | -1 | 4 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 662 | 11 | 8 | 8 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCCCCCCNC(=O)/N=C(\N)Nc2ccc(-c3sc(N)nc3C)cc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 44304437 | 100996 | 0 | None | -371 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 404 | 11 | 1 | 5 | 3.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C(C)(C)O)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL294349 | 100996 | 0 | None | -371 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 404 | 11 | 1 | 5 | 3.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C(C)(C)O)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304393 | 105957 | 0 | None | -218 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 517 | 13 | 1 | 6 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL312958 | 105957 | 0 | None | -218 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 517 | 13 | 1 | 6 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 164622330 | 185862 | 0 | None | -870 | 6 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 2.3 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)N[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4867962 | 185862 | 0 | None | -870 | 6 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 2.3 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)N[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4531334 | 213985 | 31 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | None | None | None | CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5ccncc5)ccc4n3)cc2)CC1 | 10.6019/CHEMBL5212743 | |||||
| 127051845 | 140729 | 0 | None | -12 | 9 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 309 | 6 | 0 | 3 | 3.7 | COc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3817898 | 140729 | 0 | None | -12 | 9 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 309 | 6 | 0 | 3 | 3.7 | COc1ccc(C(=O)CCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 10066369 | 120258 | 0 | None | -8 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 348 | 7 | 0 | 2 | 5.7 | CC(C1=C(CCN(C(C)C)C(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| CHEMBL352375 | 120258 | 0 | None | -8 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 348 | 7 | 0 | 2 | 5.7 | CC(C1=C(CCN(C(C)C)C(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| 44304516 | 165356 | 0 | None | -512 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 357 | 8 | 1 | 5 | 1.5 | O=C1C[C@H](N2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)CC2)N1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL423666 | 165356 | 0 | None | -512 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 357 | 8 | 1 | 5 | 1.5 | O=C1C[C@H](N2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)CC2)N1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304013 | 202894 | 0 | None | -416 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 401 | 8 | 1 | 5 | 2.6 | CC(C)(C)[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62716 | 202894 | 0 | None | -416 | 3 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 401 | 8 | 1 | 5 | 2.6 | CC(C)(C)[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 164621681 | 185580 | 0 | None | -173 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 444 | 7 | 4 | 5 | 3.2 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(OC(F)(F)F)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4863523 | 185580 | 0 | None | -173 | 4 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 444 | 7 | 4 | 5 | 3.2 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(OC(F)(F)F)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 11230971 | 123065 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 268 | 0 | 1 | 4 | 2.0 | Cn1ccc2c1CCn1ccnc1C2=C1CCNCC1 | 10.1021/jm049495j | |||
| CHEMBL360953 | 123065 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 268 | 0 | 1 | 4 | 2.0 | Cn1ccc2c1CCn1ccnc1C2=C1CCNCC1 | 10.1021/jm049495j | |||
| 135446209 | 9585 | 58 | None | -2 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 298 | 0 | 2 | 5 | 3.1 | Cc1cc2c(s1)Nc1ccccc1N=C2N1CCNCC1 | 10.1016/S0960-894X(96)00567-7 | |||
| CHEMBL1125 | 9585 | 58 | None | -2 | 3 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 298 | 0 | 2 | 5 | 3.1 | Cc1cc2c(s1)Nc1ccccc1N=C2N1CCNCC1 | 10.1016/S0960-894X(96)00567-7 | |||
| 2389 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| 5073 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| 96 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| CHEMBL85 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| DB00734 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.ejmech.2014.01.012 | |||
| 90469115 | 185842 | 4 | None | -72 | 17 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 410 | 3 | 1 | 6 | 3.0 | O=S(=O)(c1cccc(F)c1)n1ccc2c(N3CCNCC3)nc3ccccc3c21 | 10.1021/acs.jmedchem.1c00224 | |||
| CHEMBL4867565 | 185842 | 4 | None | -72 | 17 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 410 | 3 | 1 | 6 | 3.0 | O=S(=O)(c1cccc(F)c1)n1ccc2c(N3CCNCC3)nc3ccccc3c21 | 10.1021/acs.jmedchem.1c00224 | |||
| 10575070 | 67881 | 0 | None | 79 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 439 | 7 | 1 | 3 | 4.7 | O=C(c1cc2ccccc2[nH]1)N1CCN(CCOC(c2ccccc2)c2ccccc2)CC1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910383 | 67881 | 0 | None | 79 | 2 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 439 | 7 | 1 | 3 | 4.7 | O=C(c1cc2ccccc2[nH]1)N1CCN(CCOC(c2ccccc2)c2ccccc2)CC1 | 10.1016/j.bmcl.2011.09.001 | |||
| 44304387 | 202928 | 0 | None | -446 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 334 | 7 | 0 | 5 | 2.4 | CCOC(=O)N1CCN(CCCOc2ccc(C(C)=O)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62840 | 202928 | 0 | None | -446 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 334 | 7 | 0 | 5 | 2.4 | CCOC(=O)N1CCN(CCCOc2ccc(C(C)=O)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304244 | 203176 | 0 | None | -141 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 372 | 12 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(CC3CC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64253 | 203176 | 0 | None | -141 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 372 | 12 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(CC3CC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 90654503 | 110312 | 0 | None | -29 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 483 | 9 | 1 | 4 | 4.9 | O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.ejmech.2014.03.014 | |||
| CHEMBL3238447 | 110312 | 0 | None | -29 | 3 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 483 | 9 | 1 | 4 | 4.9 | O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.ejmech.2014.03.014 | |||
| 44304741 | 202917 | 0 | None | -223 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 466 | 13 | 1 | 6 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](N)Cc3ccncc3)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62808 | 202917 | 0 | None | -223 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 466 | 13 | 1 | 6 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](N)Cc3ccncc3)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 57402933 | 69026 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 260 | 4 | 2 | 3 | 2.1 | CNCC(O)CN1c2ccccc2C2CCCCC21 | 10.1021/jm2011589 | |||
| CHEMBL1923528 | 69026 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 260 | 4 | 2 | 3 | 2.1 | CNCC(O)CN1c2ccccc2C2CCCCC21 | 10.1021/jm2011589 | |||
| 155537890 | 172341 | 0 | None | 8 | 2 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 302 | 5 | 0 | 3 | 2.6 | CN1CCc2ccc(OCCCN3CCCCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4475658 | 172341 | 0 | None | 8 | 2 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 302 | 5 | 0 | 3 | 2.6 | CN1CCc2ccc(OCCCN3CCCCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 11154555 | 800 | 62 | None | -56 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| 5037 | 800 | 62 | None | -56 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| 7671 | 800 | 62 | None | -56 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL2028019 | 800 | 62 | None | -56 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL3085826 | 800 | 62 | None | -56 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| DB06016 | 800 | 62 | None | -56 | 12 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| 44267053 | 6462 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 428 | 1 | 0 | 2 | 5.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(-c4ccccc4)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL10826 | 6462 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 428 | 1 | 0 | 2 | 5.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(-c4ccccc4)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 44267061 | 98228 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 366 | 0 | 0 | 2 | 4.6 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(C)ccnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL274357 | 98228 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 366 | 0 | 0 | 2 | 4.6 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(C)ccnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 44334212 | 4629 | 0 | None | -501 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 456 | 11 | 1 | 5 | 3.7 | CCc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL102925 | 4629 | 0 | None | -501 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 456 | 11 | 1 | 5 | 3.7 | CCc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44334369 | 5014 | 0 | None | -436 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 484 | 10 | 1 | 5 | 4.4 | CC(C)(C)c1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL105071 | 5014 | 0 | None | -436 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 484 | 10 | 1 | 5 | 4.4 | CC(C)(C)c1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44275807 | 98970 | 0 | None | -2137 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 422 | 7 | 0 | 4 | 4.5 | C[C@H]1CC[C@H](C)N1CCCOc1ccc(-c2ccc(C(=O)N3CCOCC3)cc2)cc1 | 10.1016/s0960-894x(03)00118-5 | |||
| CHEMBL27979 | 98970 | 0 | None | -2137 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 422 | 7 | 0 | 4 | 4.5 | C[C@H]1CC[C@H](C)N1CCCOc1ccc(-c2ccc(C(=O)N3CCOCC3)cc2)cc1 | 10.1016/s0960-894x(03)00118-5 | |||
| 164608815 | 184454 | 0 | None | -58 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 380 | 7 | 4 | 4 | 2.8 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4846638 | 184454 | 0 | None | -58 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 380 | 7 | 4 | 4 | 2.8 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1016/j.ejmech.2021.113190 | |||
| 53359025 | 62353 | 0 | None | -25 | 5 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 339 | 5 | 1 | 3 | 2.5 | O=C(CCCN1C2C3C4CC5C6C4C2C6C1(O)C53)c1ccc(F)cc1 | 10.1016/j.bmcl.2012.08.046 | |||
| CHEMBL1779058 | 62353 | 0 | None | -25 | 5 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 339 | 5 | 1 | 3 | 2.5 | O=C(CCCN1C2C3C4CC5C6C4C2C6C1(O)C53)c1ccc(F)cc1 | 10.1016/j.bmcl.2012.08.046 | |||
| 53324553 | 56855 | 0 | None | -3 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 283 | 4 | 1 | 1 | 3.1 | Fc1cccc(CCN[C@H]2C3C4CC5C6C4CC3C6C52)c1 | 10.1016/j.bmcl.2010.11.075 | |||
| CHEMBL1643900 | 56855 | 0 | None | -3 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 283 | 4 | 1 | 1 | 3.1 | Fc1cccc(CCN[C@H]2C3C4CC5C6C4CC3C6C52)c1 | 10.1016/j.bmcl.2010.11.075 | |||
| 53324553 | 56855 | 0 | None | -3 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 283 | 4 | 1 | 1 | 3.1 | Fc1cccc(CCN[C@H]2C3C4CC5C6C4CC3C6C52)c1 | 10.1016/j.bmc.2013.07.045 | |||
| CHEMBL1643900 | 56855 | 0 | None | -3 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 283 | 4 | 1 | 1 | 3.1 | Fc1cccc(CCN[C@H]2C3C4CC5C6C4CC3C6C52)c1 | 10.1016/j.bmc.2013.07.045 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.1c00692 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.ejmech.2021.113190 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.ejmech.2021.113190 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.ejmech.2021.113190 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.ejmech.2021.113190 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1016/j.ejmech.2021.113190 | |||
| 168269877 | 190027 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 783 | 22 | 6 | 8 | 3.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5171683 | 190027 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 783 | 22 | 6 | 8 | 3.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 164622259 | 185730 | 0 | None | -2290 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 336 | 6 | 4 | 5 | 1.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCc1ccco1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4865965 | 185730 | 0 | None | -2290 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 336 | 6 | 4 | 5 | 1.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCc1ccco1 | 10.1016/j.ejmech.2021.113190 | |||
| 168269877 | 190027 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 783 | 22 | 6 | 8 | 3.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5171683 | 190027 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 783 | 22 | 6 | 8 | 3.0 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 15749417 | 102097 | 0 | None | - | 1 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | CN(C)CC/C=C1/c2ccccc2COc2cc(C(=O)O)ccc21 | 10.1021/jm00089a020 | |||
| CHEMBL302215 | 102097 | 0 | None | - | 1 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | CN(C)CC/C=C1/c2ccccc2COc2cc(C(=O)O)ccc21 | 10.1021/jm00089a020 | |||
| 53321494 | 57749 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 311 | 7 | 0 | 3 | 3.3 | CN(CCF)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669407 | 57749 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 311 | 7 | 0 | 3 | 3.3 | CN(CCF)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 53318874 | 57769 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 371 | 7 | 0 | 5 | 3.9 | C[C@H](C1=C(CCN(C)Cc2cnccn2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669426 | 57769 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 371 | 7 | 0 | 5 | 3.9 | C[C@H](C1=C(CCN(C)Cc2cnccn2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 18715382 | 8955 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(Cl)ccnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL10981 | 8955 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3c(Cl)ccnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 46216770 | 199269 | 0 | None | 1 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 313 | 5 | 1 | 1 | 4.6 | c1ccc(CCNCC2c3ccccc3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2009.12.064 | |||
| CHEMBL590241 | 199269 | 0 | None | 1 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 313 | 5 | 1 | 1 | 4.6 | c1ccc(CCNCC2c3ccccc3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2009.12.064 | |||
| 10066369 | 120258 | 0 | None | -8 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 348 | 7 | 0 | 2 | 5.7 | CC(C1=C(CCN(C(C)C)C(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| CHEMBL352375 | 120258 | 0 | None | -8 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 348 | 7 | 0 | 2 | 5.7 | CC(C1=C(CCN(C(C)C)C(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| 164614841 | 185274 | 0 | None | -691 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 388 | 7 | 4 | 4 | 3.0 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(c1ccccc1)C(C)C | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4858849 | 185274 | 0 | None | -691 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 388 | 7 | 4 | 4 | 3.0 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(c1ccccc1)C(C)C | 10.1016/j.ejmech.2021.113190 | |||
| 164628701 | 186467 | 0 | None | -144 | 3 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 338 | 5 | 4 | 4 | 1.9 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC1CCCCC1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4876743 | 186467 | 0 | None | -144 | 3 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 338 | 5 | 4 | 4 | 1.9 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC1CCCCC1 | 10.1016/j.ejmech.2021.113190 | |||
| 72152558 | 162404 | 5 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 331 | 5 | 1 | 5 | 2.7 | Cc1cccc(N2CCN(CCNc3cncc(Cl)n3)CC2)c1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4165881 | 162404 | 5 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 331 | 5 | 1 | 5 | 2.7 | Cc1cccc(N2CCN(CCNc3cncc(Cl)n3)CC2)c1 | 10.1021/acs.jmedchem.8b00718 | |||
| 657255 | 199084 | 34 | None | -18 | 15 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 337 | 12 | 2 | 3 | 5.6 | CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1 | nan | |||
| CHEMBL588119 | 199084 | 34 | None | -18 | 15 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 337 | 12 | 2 | 3 | 5.6 | CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1 | nan | |||
| 53317595 | 57759 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 341 | 5 | 0 | 3 | 3.8 | FC1(F)CCN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669416 | 57759 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 341 | 5 | 0 | 3 | 3.8 | FC1(F)CCN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 60785 | 205893 | 48 | None | -204 | 7 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 425 | 5 | 0 | 4 | 3.7 | O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1 | 10.1021/jm00112a025 | |||
| CHEMBL83894 | 205893 | 48 | None | -204 | 7 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 425 | 5 | 0 | 4 | 3.7 | O=S1(=O)c2cccc3cccc(c23)N1CCCN1CCN(c2ccc(F)cc2)CC1 | 10.1021/jm00112a025 | |||
| 14248602 | 54442 | 0 | None | 21 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 237 | 2 | 0 | 1 | 3.3 | CN(C)CC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL160933 | 54442 | 0 | None | 21 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 237 | 2 | 0 | 1 | 3.3 | CN(C)CC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2021.113931 | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2021.113931 | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2021.113931 | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2021.113931 | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.ejmech.2021.113931 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmc.2016.05.053 | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmc.2016.05.053 | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmc.2016.05.053 | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmc.2016.05.053 | |||
| 71072115 | 81258 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 515 | 8 | 1 | 5 | 5.1 | N#Cc1cccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158770 | 81258 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 515 | 8 | 1 | 5 | 5.1 | N#Cc1cccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| 69348078 | 81291 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)[C@H](c1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158820 | 81291 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)[C@H](c1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 59296048 | 84016 | 0 | None | -6 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 582 | 9 | 4 | 7 | 2.4 | CNS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207284 | 84016 | 0 | None | -6 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 582 | 9 | 4 | 7 | 2.4 | CNS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| 59295914 | 84084 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 638 | 9 | 4 | 8 | 2.2 | CC1(O)CN(S(=O)(=O)c2ccc3c(C(=O)NC[C@@H](O)CN4CCC(Oc5ccc(Cl)c(Cl)c5)CC4)c[nH]c(=O)c3c2)C1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207655 | 84084 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 638 | 9 | 4 | 8 | 2.2 | CC1(O)CN(S(=O)(=O)c2ccc3c(C(=O)NC[C@@H](O)CN4CCC(Oc5ccc(Cl)c(Cl)c5)CC4)c[nH]c(=O)c3c2)C1 | 10.1016/j.bmcl.2012.09.112 | |||
| 59296100 | 84088 | 0 | None | -7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 460 | 7 | 3 | 5 | 3.0 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]nc2C(F)(F)F)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207659 | 84088 | 0 | None | -7 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 460 | 7 | 3 | 5 | 3.0 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]nc2C(F)(F)F)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| 44396220 | 125423 | 1 | None | 1 | 6 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 295 | 6 | 0 | 2 | 4.1 | c1ccc(Cc2ccccc2OCCN2CCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL364565 | 125423 | 1 | None | 1 | 6 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 295 | 6 | 0 | 2 | 4.1 | c1ccc(Cc2ccccc2OCCN2CCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 134145957 | 154511 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 296 | 4 | 0 | 1 | 3.9 | C[N+]1(C)CCC(Oc2ccccc2Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3944629 | 154511 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 296 | 4 | 0 | 1 | 3.9 | C[N+]1(C)CCC(Oc2ccccc2Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3990701 | 154511 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 296 | 4 | 0 | 1 | 3.9 | C[N+]1(C)CCC(Oc2ccccc2Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| 23102749 | 82234 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 525 | 6 | 1 | 5 | 4.3 | Cc1c(Cl)ccc(OC2CCN(C3CCN(S(=O)(=O)NC(=O)c4ccccc4)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171016 | 82234 | 0 | None | -1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 525 | 6 | 1 | 5 | 4.3 | Cc1c(Cl)ccc(OC2CCN(C3CCN(S(=O)(=O)NC(=O)c4ccccc4)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.124 | |||
| 22397445 | 82239 | 0 | None | -2 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 499 | 4 | 1 | 4 | 5.0 | O=C(c1c[nH]c(=O)c2ccccc12)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171020 | 82239 | 0 | None | -2 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 499 | 4 | 1 | 4 | 5.0 | O=C(c1c[nH]c(=O)c2ccccc12)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 69826668 | 82240 | 0 | None | -5 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 524 | 5 | 0 | 5 | 4.9 | Cc1c(Cl)ccc(OC2CCN(C3CCN(C(=O)c4cccc(S(C)(=O)=O)c4)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171021 | 82240 | 0 | None | -5 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 524 | 5 | 0 | 5 | 4.9 | Cc1c(Cl)ccc(OC2CCN(C3CCN(C(=O)c4cccc(S(C)(=O)=O)c4)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.124 | |||
| 71449857 | 82242 | 0 | None | 10 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 476 | 5 | 1 | 4 | 4.8 | O=C(O)c1ccccc1C(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171023 | 82242 | 0 | None | 10 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 476 | 5 | 1 | 4 | 4.8 | O=C(O)c1ccccc1C(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 71453505 | 82260 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 554 | 6 | 1 | 6 | 4.5 | CN(C)c1ccccc1S(=O)(=O)NC(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171041 | 82260 | 0 | None | 1 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 554 | 6 | 1 | 6 | 4.5 | CN(C)c1ccccc1S(=O)(=O)NC(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963226 | 82267 | 0 | None | -3 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 505 | 5 | 1 | 5 | 4.4 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)cc4C)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171048 | 82267 | 0 | None | -3 | 2 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 505 | 5 | 1 | 5 | 4.4 | Cc1ccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)cc4C)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.124 | |||
| 44343573 | 111057 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 369 | 2 | 0 | 3 | 3.5 | CCC(=O)N1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL326289 | 111057 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 369 | 2 | 0 | 3 | 3.5 | CCC(=O)N1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| 44334406 | 4863 | 0 | None | -660 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 462 | 10 | 1 | 5 | 3.8 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(Cl)cc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL104344 | 4863 | 0 | None | -660 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 462 | 10 | 1 | 5 | 3.8 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(Cl)cc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 10472143 | 119277 | 0 | None | -5623 | 16 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
| CHEMBL343755 | 119277 | 0 | None | -5623 | 16 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
| 59295960 | 84097 | 0 | None | -12 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 532 | 8 | 4 | 6 | 2.6 | NC(=O)c1c(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccccc34)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207667 | 84097 | 0 | None | -12 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 532 | 8 | 4 | 6 | 2.6 | NC(=O)c1c(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccccc34)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| 59296041 | 84100 | 0 | None | -3 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 558 | 8 | 3 | 8 | 2.1 | CS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(C#N)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207670 | 84100 | 0 | None | -3 | 2 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 558 | 8 | 3 | 8 | 2.1 | CS(=O)(=O)c1ccc2c(C(=O)NC[C@@H](O)CN3CCC(Oc4ccc(C#N)c(Cl)c4)CC3)c[nH]c(=O)c2c1 | 10.1016/j.bmcl.2012.09.112 | |||
| 18722998 | 154474 | 2 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 191 | 2 | 0 | 2 | 2.2 | CN1CCC(Oc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3983211 | 154474 | 2 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 191 | 2 | 0 | 2 | 2.2 | CN1CCC(Oc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3990343 | 154474 | 2 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 191 | 2 | 0 | 2 | 2.2 | CN1CCC(Oc2ccccc2)CC1 | 10.1021/acs.jmedchem.6b00981 | |||
| 46881468 | 6859 | 0 | None | -10 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 245 | 3 | 1 | 3 | 1.9 | c1ccc(N2CCN(CC3CCCCN3)C2)cc1 | 10.1016/j.bmcl.2010.01.090 | |||
| CHEMBL1084132 | 6859 | 0 | None | -10 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 245 | 3 | 1 | 3 | 1.9 | c1ccc(N2CCN(CC3CCCCN3)C2)cc1 | 10.1016/j.bmcl.2010.01.090 | |||
| 10420190 | 206760 | 0 | None | -2 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 195 | 8 | 2 | 2 | 2.3 | NCCCCCCCCc1c[nH]cn1 | 10.1021/jm00002a008 | |||
| CHEMBL90063 | 206760 | 0 | None | -2 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 195 | 8 | 2 | 2 | 2.3 | NCCCCCCCCc1c[nH]cn1 | 10.1021/jm00002a008 | |||
| 11533362 | 80632 | 0 | None | -7943 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 497 | 6 | 0 | 6 | 3.4 | CS(=O)(=O)c1ccc(C(=O)N2CCN(c3ccc(OC4CCN(C5CCC5)CC4)cc3)CC2)cc1 | 10.1021/jm100064d | |||
| CHEMBL2151155 | 80632 | 0 | None | -7943 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 497 | 6 | 0 | 6 | 3.4 | CS(=O)(=O)c1ccc(C(=O)N2CCN(c3ccc(OC4CCN(C5CCC5)CC4)cc3)CC2)cc1 | 10.1021/jm100064d | |||
| 9976892 | 103954 | 42 | None | -10715 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 377 | 4 | 0 | 4 | 4.0 | O=C1CCCN1c1ccc(Oc2ccc3c(c2)CCN(C2CCC2)CC3)nc1 | 10.1016/j.bmcl.2013.09.090 | |||
| CHEMBL3092650 | 103954 | 42 | None | -10715 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 377 | 4 | 0 | 4 | 4.0 | O=C1CCCN1c1ccc(Oc2ccc3c(c2)CCN(C2CCC2)CC3)nc1 | 10.1016/j.bmcl.2013.09.090 | |||
| 168292954 | 192997 | 0 | None | -44 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.5 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2cnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5202592 | 192997 | 0 | None | -44 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.5 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2cnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222660 | 192997 | 0 | None | -44 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.5 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2cnc(N)s2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 10039772 | 104361 | 0 | None | -100 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 288 | 7 | 3 | 2 | 3.1 | S=C(NCCCCCc1c[nH]cn1)Nc1ccccc1 | 10.1021/jm00012a025 | |||
| CHEMBL310087 | 104361 | 0 | None | -100 | 3 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 288 | 7 | 3 | 2 | 3.1 | S=C(NCCCCCc1c[nH]cn1)Nc1ccccc1 | 10.1021/jm00012a025 | |||
| 112936341 | 137474 | 1 | None | 12 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 359 | 5 | 1 | 5 | 3.5 | CN1CCN(c2nc(NCc3ccccc3)cc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753849 | 137474 | 1 | None | 12 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 359 | 5 | 1 | 5 | 3.5 | CN1CCN(c2nc(NCc3ccccc3)cc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 10711079 | 98741 | 0 | None | -1318 | 2 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 323 | 5 | 2 | 3 | 3.4 | O=C(Nc1ccc(Br)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL277989 | 98741 | 0 | None | -1318 | 2 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 323 | 5 | 2 | 3 | 3.4 | O=C(Nc1ccc(Br)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 155515780 | 170024 | 0 | None | - | 1 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 318 | 6 | 0 | 4 | 1.8 | CCN1CCc2ccc(OCCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4442619 | 170024 | 0 | None | - | 1 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 318 | 6 | 0 | 4 | 1.8 | CCN1CCc2ccc(OCCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 9947477 | 199968 | 0 | None | -25 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 368 | 10 | 2 | 3 | 4.6 | Clc1ccc(C(CCNCCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL59512 | 199968 | 0 | None | -25 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 368 | 10 | 2 | 3 | 4.6 | Clc1ccc(C(CCNCCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00357-3 | |||
| 95214051 | 162423 | 0 | None | 1 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 331 | 6 | 2 | 5 | 1.7 | O=C(CO)NC[C@H]1CCN(Cc2csc(-c3ccccc3)n2)C1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4166178 | 162423 | 0 | None | 1 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 331 | 6 | 2 | 5 | 1.7 | O=C(CO)NC[C@H]1CCN(Cc2csc(-c3ccccc3)n2)C1 | 10.1021/acs.jmedchem.8b00718 | |||
| 44478385 | 5776 | 6 | None | -446 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 342 | 9 | 3 | 4 | 2.5 | N#C/N=C(/NCCCCc1c[nH]cn1)NCCSc1ccccc1 | 10.1021/jm900526h | |||
| CHEMBL1078642 | 5776 | 6 | None | -446 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 342 | 9 | 3 | 4 | 2.5 | N#C/N=C(/NCCCCc1c[nH]cn1)NCCSc1ccccc1 | 10.1021/jm900526h | |||
| 164611474 | 185452 | 0 | None | -407 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 366 | 6 | 4 | 5 | 2.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1cccs1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4861704 | 185452 | 0 | None | -407 | 4 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 366 | 6 | 4 | 5 | 2.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1cccs1 | 10.1016/j.ejmech.2021.113190 | |||
| 9906978 | 42711 | 2 | None | -28 | 12 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL150161 | 42711 | 2 | None | -28 | 12 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 9906978 | 42711 | 2 | None | -28 | 12 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.03.057 | |||
| CHEMBL150161 | 42711 | 2 | None | -28 | 12 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.03.057 | |||
| 9850828 | 169902 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 562 | 11 | 2 | 5 | 5.0 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL444083 | 169902 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 562 | 11 | 2 | 5 | 5.0 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 155547818 | 173568 | 0 | None | 2 | 2 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 302 | 5 | 0 | 3 | 2.6 | CC1CCCN1CCCOc1ccc2c(c1)C(=O)N(C)CC2 | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4532574 | 173568 | 0 | None | 2 | 2 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 302 | 5 | 0 | 3 | 2.6 | CC1CCCN1CCCOc1ccc2c(c1)C(=O)N(C)CC2 | 10.1016/j.bmcl.2019.04.015 | |||
| 44449794 | 158262 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 333 | 5 | 1 | 4 | 3.5 | COc1cc(Cl)ccc1O[C@H](c1ccccc1)[C@H]1CNCCO1 | 10.1016/j.bmcl.2008.03.050 | |||
| CHEMBL408868 | 158262 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 333 | 5 | 1 | 4 | 3.5 | COc1cc(Cl)ccc1O[C@H](c1ccccc1)[C@H]1CNCCO1 | 10.1016/j.bmcl.2008.03.050 | |||
| 11848679 | 89244 | 0 | None | -204 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 489 | 9 | 3 | 9 | 2.9 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)cc(OCC)c1N | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL236788 | 89244 | 0 | None | -204 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 489 | 9 | 3 | 9 | 2.9 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)cc(OCC)c1N | 10.1016/j.bmcl.2009.09.024 | |||
| 146025727 | 171685 | 0 | None | -97 | 27 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 411 | 3 | 0 | 5 | 6.4 | FC(F)(F)c1cc(Oc2nccc3ccsc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
| CHEMBL4466483 | 171685 | 0 | None | -97 | 27 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 411 | 3 | 0 | 5 | 6.4 | FC(F)(F)c1cc(Oc2nccc3ccsc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
| 71456046 | 84075 | 0 | None | -1737 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 389 | 6 | 0 | 4 | 4.2 | COc1ccccc1N1CCN(Cc2cc(CN(C)C)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| CHEMBL2207637 | 84075 | 0 | None | -1737 | 7 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 389 | 6 | 0 | 4 | 4.2 | COc1ccccc1N1CCN(Cc2cc(CN(C)C)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| 44209472 | 70172 | 2 | None | -144 | 11 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 315 | 6 | 0 | 4 | 2.8 | Fc1ccc(OCCCN2CCN(c3ccccn3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL1940420 | 70172 | 2 | None | -144 | 11 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 315 | 6 | 0 | 4 | 2.8 | Fc1ccc(OCCCN2CCN(c3ccccn3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| 1072350 | 69027 | 5 | None | -4 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 269 | 3 | 0 | 5 | 2.2 | c1ccc2c(c1)nc1n(CCN3CCCCC3)cnn21 | 10.1021/jm2011589 | |||
| CHEMBL1923529 | 69027 | 5 | None | -4 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 269 | 3 | 0 | 5 | 2.2 | c1ccc2c(c1)nc1n(CCN3CCCCC3)cnn21 | 10.1021/jm2011589 | |||
| 44304978 | 167889 | 0 | None | -1230 | 3 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 396 | 11 | 0 | 5 | 2.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(S(C)(=O)=O)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL431172 | 167889 | 0 | None | -1230 | 3 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 396 | 11 | 0 | 5 | 2.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(S(C)(=O)=O)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 46230651 | 200508 | 0 | None | -125 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 289 | 2 | 1 | 2 | 3.8 | COc1ccc2c3c(ccc2c1)Cc1ccccc1C3CN | 10.1016/j.bmcl.2009.12.064 | |||
| CHEMBL598753 | 200508 | 0 | None | -125 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 289 | 2 | 1 | 2 | 3.8 | COc1ccc2c3c(ccc2c1)Cc1ccccc1C3CN | 10.1016/j.bmcl.2009.12.064 | |||
| 164585622 | 184928 | 0 | None | 1 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 506 | 6 | 2 | 7 | 5.5 | O=C(O)c1cc(-c2ccc(-c3cc(CO)on3)cc2)cc(-n2cc(-c3ccc(C(F)(F)F)cc3)nn2)c1 | 10.1021/acs.jmedchem.1c00164 | |||
| CHEMBL4853466 | 184928 | 0 | None | 1 | 2 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 506 | 6 | 2 | 7 | 5.5 | O=C(O)c1cc(-c2ccc(-c3cc(CO)on3)cc2)cc(-n2cc(-c3ccc(C(F)(F)F)cc3)nn2)c1 | 10.1021/acs.jmedchem.1c00164 | |||
| 24740863 | 89158 | 0 | None | -3 | 6 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 385 | 6 | 1 | 5 | 5.0 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1Cl | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL236610 | 89158 | 0 | None | -3 | 6 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 385 | 6 | 1 | 5 | 5.0 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1Cl | 10.1016/j.bmcl.2009.09.024 | |||
| 56781741 | 162635 | 4 | None | 1 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 337 | 6 | 0 | 6 | 3.0 | Cc1cc(C)n(C2CN(CCCc3nc(-c4ccccc4)no3)C2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4169603 | 162635 | 4 | None | 1 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 337 | 6 | 0 | 6 | 3.0 | Cc1cc(C)n(C2CN(CCCc3nc(-c4ccccc4)no3)C2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| 168291233 | 192979 | 0 | None | -6 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 373 | 8 | 4 | 5 | 1.4 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)o2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5200106 | 192979 | 0 | None | -6 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 373 | 8 | 4 | 5 | 1.4 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)o2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222556 | 192979 | 0 | None | -6 | 4 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 373 | 8 | 4 | 5 | 1.4 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)NCCCc2nnc(N)o2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 44326298 | 207909 | 0 | None | 3 | 3 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)CC1C[C@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL96732 | 207909 | 0 | None | 3 | 3 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)CC1C[C@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.07.047 | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.07.047 | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.07.047 | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.07.047 | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 10.1016/j.bmcl.2009.07.047 | |||
| 44335237 | 5121 | 0 | None | 3 | 3 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 407 | 7 | 0 | 5 | 4.1 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(C#N)cc3C)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105669 | 5121 | 0 | None | 3 | 3 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 407 | 7 | 0 | 5 | 4.1 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(C#N)cc3C)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 11963995 | 91865 | 0 | None | -15 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 387 | 6 | 1 | 4 | 3.8 | CCOc1cc(CN2CCC(NC(=O)c3cncc(C)c3)CC2)ccc1Cl | 10.1021/jm701144e | |||
| CHEMBL241329 | 91865 | 0 | None | -15 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 387 | 6 | 1 | 4 | 3.8 | CCOc1cc(CN2CCC(NC(=O)c3cncc(C)c3)CC2)ccc1Cl | 10.1021/jm701144e | |||
| 49783209 | 17609 | 0 | None | -1380 | 26 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 396 | 7 | 1 | 6 | 3.8 | CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3c2OCCO3)CC1 | 10.1021/jm100668r | |||
| CHEMBL1258223 | 17609 | 0 | None | -1380 | 26 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 396 | 7 | 1 | 6 | 3.8 | CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3c2OCCO3)CC1 | 10.1021/jm100668r | |||
| 409544 | 202914 | 4 | None | -194 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 390 | 11 | 0 | 5 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62803 | 202914 | 4 | None | -194 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 390 | 11 | 0 | 5 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304383 | 203303 | 0 | None | -27 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 418 | 12 | 0 | 5 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64775 | 203303 | 0 | None | -27 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 418 | 12 | 0 | 5 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335559 | 109709 | 0 | None | -162 | 4 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.7 | CC1CCCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)C1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL322873 | 109709 | 0 | None | -162 | 4 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.7 | CC1CCCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)C1 | 10.1016/s0960-894x(02)00648-0 | |||
| 79698 | 202192 | 95 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 211 | 4 | 1 | 1 | 3.2 | NCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL609579 | 202192 | 95 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 211 | 4 | 1 | 1 | 3.2 | NCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| 25450664 | 161996 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 392 | 6 | 0 | 6 | 3.9 | COC(=O)c1ccc(-c2nc(CN(C)C[C@@H]3Cc4ccccc4O3)c(C)o2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4159365 | 161996 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 392 | 6 | 0 | 6 | 3.9 | COC(=O)c1ccc(-c2nc(CN(C)C[C@@H]3Cc4ccccc4O3)c(C)o2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | nan | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | nan | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | nan | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | nan | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | nan | |||
| 53322839 | 57766 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 373 | 7 | 0 | 5 | 3.8 | C[C@H](C1=C(CCN(C)Cc2nccn2C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669423 | 57766 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 373 | 7 | 0 | 5 | 3.8 | C[C@H](C1=C(CCN(C)Cc2nccn2C)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 11808040 | 168395 | 0 | None | -2 | 6 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.8 | CC(C1=C(CN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| CHEMBL434684 | 168395 | 0 | None | -2 | 6 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 278 | 4 | 0 | 2 | 3.8 | CC(C1=C(CN(C)C)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| 46929647 | 16758 | 0 | None | -19 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 355 | 5 | 2 | 3 | 4.3 | FC(F)(F)c1ccc(SC[C@H](c2c[nH]cn2)C2CCNCC2)cc1 | 10.1021/jm100643t | |||
| CHEMBL1243394 | 16758 | 0 | None | -19 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 355 | 5 | 2 | 3 | 4.3 | FC(F)(F)c1ccc(SC[C@H](c2c[nH]cn2)C2CCNCC2)cc1 | 10.1021/jm100643t | |||
| 28357663 | 162144 | 2 | None | 1 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 301 | 5 | 0 | 3 | 3.3 | Cc1ccn(CCN2CCC(Cc3ccccc3F)CC2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4161837 | 162144 | 2 | None | 1 | 3 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 301 | 5 | 0 | 3 | 3.3 | Cc1ccn(CCN2CCC(Cc3ccccc3F)CC2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| 49841846 | 69738 | 0 | None | -812 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 325 | 2 | 1 | 6 | 2.7 | CN1CCN(c2nc(N)nc3cc(-c4ccsc4)ccc23)CC1 | 10.1016/j.bmcl.2011.10.104 | |||
| CHEMBL1935572 | 69738 | 0 | None | -812 | 3 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 325 | 2 | 1 | 6 | 2.7 | CN1CCN(c2nc(N)nc3cc(-c4ccsc4)ccc23)CC1 | 10.1016/j.bmcl.2011.10.104 | |||
| 10451094 | 202473 | 0 | None | -56234 | 3 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 359 | 9 | 1 | 5 | 1.5 | NCCC(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL61120 | 202473 | 0 | None | -56234 | 3 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 359 | 9 | 1 | 5 | 1.5 | NCCC(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 127038376 | 136783 | 0 | None | -323 | 5 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 502 | 6 | 0 | 7 | 4.2 | O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(CN3CCC(c4noc5cc(F)ccc45)CC3)CC2)cc1 | 10.1039/C4MD00578C | |||
| CHEMBL3741292 | 136783 | 0 | None | -323 | 5 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 502 | 6 | 0 | 7 | 4.2 | O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(CN3CCC(c4noc5cc(F)ccc45)CC3)CC2)cc1 | 10.1039/C4MD00578C | |||
| 44304751 | 101023 | 0 | None | -7 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 422 | 11 | 0 | 4 | 4.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccccc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL294519 | 101023 | 0 | None | -7 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 422 | 11 | 0 | 4 | 4.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccccc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335225 | 164155 | 0 | None | -190 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 347 | 6 | 1 | 4 | 3.1 | N#Cc1ccc(-c2ccc(OCCCN3CC4CNCC4C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL421026 | 164155 | 0 | None | -190 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 347 | 6 | 1 | 4 | 3.1 | N#Cc1ccc(-c2ccc(OCCCN3CC4CNCC4C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168294178 | 193035 | 0 | None | -1 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 414 | 5 | 4 | 4 | 4.4 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)C2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5205197 | 193035 | 0 | None | -1 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 414 | 5 | 4 | 4 | 4.4 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)C2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222887 | 193035 | 0 | None | -1 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 414 | 5 | 4 | 4 | 4.4 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)C2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 164627241 | 186429 | 0 | None | -95 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 438 | 6 | 4 | 4 | 3.1 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(Br)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4876267 | 186429 | 0 | None | -95 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 438 | 6 | 4 | 4 | 3.1 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(Br)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 164627189 | 186321 | 0 | None | -275 | 4 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 298 | 6 | 4 | 4 | 1.0 | CCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4874758 | 186321 | 0 | None | -275 | 4 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 298 | 6 | 4 | 4 | 1.0 | CCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C | 10.1016/j.ejmech.2021.113190 | |||
| 118721929 | 116093 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 394 | 2 | 0 | 2 | 5.3 | CC(C)CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL3357042 | 116093 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 394 | 2 | 0 | 2 | 5.3 | CC(C)CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| 162645254 | 179683 | 3 | None | -371 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 398 | 7 | 0 | 5 | 4.2 | N#Cc1ccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4743583 | 179683 | 3 | None | -371 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 398 | 7 | 0 | 5 | 4.2 | N#Cc1ccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| 24841480 | 183899 | 0 | None | -14 | 20 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 340 | 3 | 0 | 4 | 4.5 | O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc21 | 10.1016/j.bmcl.2013.04.082 | |||
| CHEMBL481153 | 183899 | 0 | None | -14 | 20 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 340 | 3 | 0 | 4 | 4.5 | O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc21 | 10.1016/j.bmcl.2013.04.082 | |||
| 9928323 | 11937 | 0 | None | - | 1 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 349 | 5 | 1 | 3 | 4.1 | CN(C)CC/C=C1/c2ccccc2COc2ccc(/C=C/C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL1182766 | 11937 | 0 | None | - | 1 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 349 | 5 | 1 | 3 | 4.1 | CN(C)CC/C=C1/c2ccccc2COc2ccc(/C=C/C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL264979 | 11937 | 0 | None | - | 1 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 349 | 5 | 1 | 3 | 4.1 | CN(C)CC/C=C1/c2ccccc2COc2ccc(/C=C/C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 44326433 | 207858 | 0 | None | 1 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 409 | 3 | 0 | 2 | 6.1 | c1ccc(C2CCN(CC3C[C@@H]4c5ccccc5Cc5ccccc5[C@H]4O3)CC2)cc1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL96471 | 207858 | 0 | None | 1 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 409 | 3 | 0 | 2 | 6.1 | c1ccc(C2CCN(CC3C[C@@H]4c5ccccc5Cc5ccccc5[C@H]4O3)CC2)cc1 | 10.1016/j.bmcl.2004.03.069 | |||
| 23551948 | 110396 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 341 | 2 | 0 | 3 | 2.7 | O=CN1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL324336 | 110396 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 341 | 2 | 0 | 3 | 2.7 | O=CN1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| 162647537 | 179804 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 294 | 3 | 0 | 2 | 3.0 | CN(C)CCN1C(=O)c2ccccc2CCc2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| CHEMBL4744893 | 179804 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 294 | 3 | 0 | 2 | 3.0 | CN(C)CCN1C(=O)c2ccccc2CCc2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| 14885640 | 16778 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 340 | 3 | 0 | 2 | 4.1 | CC(=O)N(C)CC/C=C1\c2ccc(Cl)cc2CCc2cccnc21 | 10.1021/jm00105a069 | |||
| CHEMBL124466 | 16778 | 0 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 340 | 3 | 0 | 2 | 4.1 | CC(=O)N(C)CC/C=C1\c2ccc(Cl)cc2CCc2cccnc21 | 10.1021/jm00105a069 | |||
| 9928224 | 134357 | 0 | None | -1621 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 346 | 6 | 2 | 3 | 3.3 | O=C(CCN1CCC(Cc2c[nH]cn2)CC1)Nc1ccc(Cl)cc1 | 10.1016/j.bmcl.2005.09.076 | |||
| CHEMBL371730 | 134357 | 0 | None | -1621 | 3 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 346 | 6 | 2 | 3 | 3.3 | O=C(CCN1CCC(Cc2c[nH]cn2)CC1)Nc1ccc(Cl)cc1 | 10.1016/j.bmcl.2005.09.076 | |||
| 14885629 | 34978 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 336 | 0 | 0 | 2 | 3.8 | CC(=O)N1CCC(=C2c3cc(F)ccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL143272 | 34978 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 336 | 0 | 0 | 2 | 3.8 | CC(=O)N1CCC(=C2c3cc(F)ccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 162653991 | 180547 | 0 | None | -245 | 5 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 470 | 4 | 0 | 3 | 6.0 | C[C@H]1CN(CC[C@H]2CC[C@H](N3C(=O)CC4(CCCC4)CC3=O)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL4753808 | 180547 | 0 | None | -245 | 5 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 470 | 4 | 0 | 3 | 6.0 | C[C@H]1CN(CC[C@H]2CC[C@H](N3C(=O)CC4(CCCC4)CC3=O)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| 10347051 | 67161 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 534 | 9 | 2 | 5 | 4.3 | NC(=O)N(O)CCC#Cc1ccc(OCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL187637 | 67161 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 534 | 9 | 2 | 5 | 4.3 | NC(=O)N(O)CCC#Cc1ccc(OCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 44591135 | 190177 | 0 | None | -190 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 532 | 10 | 0 | 4 | 8.0 | CN(CC/C=C1\c2ccccc2Sc2ccc(Cl)cc21)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL517407 | 190177 | 0 | None | -190 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 532 | 10 | 0 | 4 | 8.0 | CN(CC/C=C1\c2ccccc2Sc2ccc(Cl)cc21)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| 90654501 | 110309 | 0 | None | -31622 | 3 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 314 | 6 | 0 | 5 | 3.1 | Cc1nnc(C)n1-c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.ejmech.2014.03.014 | |||
| CHEMBL3238444 | 110309 | 0 | None | -31622 | 3 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 314 | 6 | 0 | 5 | 3.1 | Cc1nnc(C)n1-c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.ejmech.2014.03.014 | |||
| 132060734 | 163124 | 0 | None | 3 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 391 | 5 | 0 | 4 | 4.0 | C=C(C)CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)C3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4177497 | 163124 | 0 | None | 3 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 391 | 5 | 0 | 4 | 4.0 | C=C(C)CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)C3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| 44326427 | 107516 | 0 | None | 144 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 348 | 2 | 0 | 3 | 3.5 | CN1CCN(CC2C[C@@H]3c4ccccc4Cc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL318659 | 107516 | 0 | None | 144 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 348 | 2 | 0 | 3 | 3.5 | CN1CCN(CC2C[C@@H]3c4ccccc4Cc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1021/jm0205651 | |||
| 249 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1021/jm0205651 | |||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1021/jm0205651 | |||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1021/jm0205651 | |||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1021/jm0205651 | |||
| 10361564 | 51292 | 0 | None | 1 | 3 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 366 | 5 | 0 | 4 | 4.1 | Cn1c(=O)sc2cc(CCN3CCC(Cc4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL15809 | 51292 | 0 | None | 1 | 3 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 366 | 5 | 0 | 4 | 4.1 | Cn1c(=O)sc2cc(CCN3CCC(Cc4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 10399921 | 119805 | 0 | None | 4 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 251 | 4 | 1 | 1 | 3.7 | CNCCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL348302 | 119805 | 0 | None | 4 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 251 | 4 | 1 | 1 | 3.7 | CNCCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 46884731 | 7909 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 323 | 6 | 0 | 4 | 3.6 | COc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090175 | 7909 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 323 | 6 | 0 | 4 | 3.6 | COc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| 46884667 | 8287 | 0 | None | 1174 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 312 | 5 | 0 | 3 | 4.5 | Cc1csc([C@H](C)C2=C(CCN(C)C)Cc3ccccc32)n1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092599 | 8287 | 0 | None | 1174 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 312 | 5 | 0 | 3 | 4.5 | Cc1csc([C@H](C)C2=C(CCN(C)C)Cc3ccccc32)n1 | 10.1016/j.bmcl.2010.02.055 | |||
| 6075 | 150108 | 42 | None | 2 | 16 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 310 | 2 | 0 | 3 | 4.6 | CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 | nan | |||
| CHEMBL395110 | 150108 | 42 | None | 2 | 16 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 310 | 2 | 0 | 3 | 4.6 | CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 | nan | |||
| 24824726 | 161109 | 1 | None | 2 | 6 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4060529 | 161109 | 1 | None | 2 | 6 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL4117079 | 161109 | 1 | None | 2 | 6 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5282336 | 161109 | 1 | None | 2 | 6 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5286389 | 161109 | 1 | None | 2 | 6 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 496 | 11 | 1 | 6 | 3.6 | COCCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5284242 | 194615 | 0 | None | 56 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 510 | 11 | 0 | 6 | 4.0 | COCCCC(=O)N(C)CCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315342 | 194615 | 0 | None | 56 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 510 | 11 | 0 | 6 | 4.0 | COCCCC(=O)N(C)CCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 75306277 | 109254 | 0 | None | -1 | 23 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 308 | 0 | 0 | 3 | 4.2 | CN1CCC2C(C1)c1cccc3c1N2c1ccccc1CS3 | 10.1039/C2MD00311B | |||
| CHEMBL3217984 | 109254 | 0 | None | -1 | 23 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 308 | 0 | 0 | 3 | 4.2 | CN1CCC2C(C1)c1cccc3c1N2c1ccccc1CS3 | 10.1039/C2MD00311B | |||
| 71463287 | 84202 | 0 | None | 79 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 420 | 7 | 1 | 5 | 4.1 | N#Cc1cccc(OC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208419 | 84202 | 0 | None | 79 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 420 | 7 | 1 | 5 | 4.1 | N#Cc1cccc(OC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 155515934 | 170015 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 402 | 2 | 0 | 4 | 4.7 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ncccn2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4442502 | 170015 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 402 | 2 | 0 | 4 | 4.7 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ncccn2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 89474811 | 172906 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 401 | 2 | 0 | 3 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccccn2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4516137 | 172906 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 401 | 2 | 0 | 3 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccccn2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 155567448 | 175982 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 350 | 1 | 0 | 2 | 4.9 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4588726 | 175982 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 350 | 1 | 0 | 2 | 4.9 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 4671324 | 13196 | 2 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 269 | 7 | 0 | 2 | 3.6 | CN(C)CCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL1191054 | 13196 | 2 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 269 | 7 | 0 | 2 | 3.6 | CN(C)CCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3955589 | 13196 | 2 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 269 | 7 | 0 | 2 | 3.6 | CN(C)CCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 45268653 | 195729 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 382 | 6 | 1 | 5 | 3.1 | CN(CCO)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL557210 | 195729 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 382 | 6 | 1 | 5 | 3.1 | CN(CCO)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 3191 | 102858 | 97 | None | 2 | 25 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | nan | |||
| CHEMBL305660 | 102858 | 97 | None | 2 | 25 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | nan | |||
| 103 | 4153 | 61 | None | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm030480f | |||
| 2875 | 4153 | 61 | None | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm030480f | |||
| 5736 | 4153 | 61 | None | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm030480f | |||
| CHEMBL285802 | 4153 | 61 | None | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm030480f | |||
| DB09225 | 4153 | 61 | None | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm030480f | |||
| 69314950 | 78660 | 0 | None | 4 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 279 | 2 | 1 | 2 | 3.4 | CNC[C@@H]1C[C@H]2c3ccccc3Cc3ccccc3[C@@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL2112371 | 78660 | 0 | None | 4 | 3 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 279 | 2 | 1 | 2 | 3.4 | CNC[C@@H]1C[C@H]2c3ccccc3Cc3ccccc3[C@@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm030480f | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm030480f | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm030480f | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm030480f | |||
| 70941112 | 175390 | 5 | None | 117 | 2 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 288 | 6 | 1 | 3 | 2.3 | NC(=O)c1ccc(OCCCN2C[C@H]3CCC[C@H]3C2)cc1 | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4575319 | 175390 | 5 | None | 117 | 2 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 288 | 6 | 1 | 3 | 2.3 | NC(=O)c1ccc(OCCCN2C[C@H]3CCC[C@H]3C2)cc1 | 10.1016/j.bmcl.2019.04.015 | |||
| 49782791 | 17910 | 0 | None | -8 | 5 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 381 | 3 | 1 | 4 | 3.3 | CC(=O)NCc1ccc2c(c1)[C@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| CHEMBL1259173 | 17910 | 0 | None | -8 | 5 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 381 | 3 | 1 | 4 | 3.3 | CC(=O)NCc1ccc2c(c1)[C@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| 45271167 | 195364 | 0 | None | 977 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 428 | 6 | 0 | 4 | 5.3 | CN(Cc1ccccc1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL551888 | 195364 | 0 | None | 977 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 428 | 6 | 0 | 4 | 5.3 | CN(Cc1ccccc1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 9850828 | 169902 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 562 | 11 | 2 | 5 | 5.0 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL444083 | 169902 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 562 | 11 | 2 | 5 | 5.0 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 44326407 | 207159 | 0 | None | 23 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 378 | 4 | 1 | 4 | 2.8 | OCCN1CCN(CC2C[C@@H]3c4ccccc4Cc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL92337 | 207159 | 0 | None | 23 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 378 | 4 | 1 | 4 | 2.8 | OCCN1CCN(CC2C[C@@H]3c4ccccc4Cc4ccccc4[C@H]3O2)CC1 | 10.1016/j.bmcl.2004.03.069 | |||
| 44326690 | 111472 | 0 | None | 7 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@@H]1C[C@H]2c3ccccc3Cc3ccccc3[C@@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL327651 | 111472 | 0 | None | 7 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 293 | 2 | 0 | 2 | 3.8 | CN(C)C[C@@H]1C[C@H]2c3ccccc3Cc3ccccc3[C@@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 11976 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1016/j.bmcl.2008.09.012 | |||
| 667467 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL908 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1016/j.bmcl.2008.09.012 | |||
| DB01239 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 10.1016/j.bmcl.2008.09.012 | |||
| 135398737 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm400408r | |||
| 38 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm400408r | |||
| 722 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm400408r | |||
| CHEMBL42 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm400408r | |||
| DB00363 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm400408r | |||
| 19861 | 207523 | 50 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL946 | 207523 | 50 | None | - | 1 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 46884063 | 8141 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 322 | 5 | 0 | 3 | 4.7 | C[C@@H](c1ccccn1)c1c(CCN2CCC2)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091775 | 8141 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 322 | 5 | 0 | 3 | 4.7 | C[C@@H](c1ccccn1)c1c(CCN2CCC2)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 44250284 | 195222 | 0 | None | 1230 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 436 | 6 | 0 | 5 | 4.6 | CN(CC1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL550818 | 195222 | 0 | None | 1230 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 436 | 6 | 0 | 5 | 4.6 | CN(CC1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 44250284 | 195222 | 0 | None | 1230 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 436 | 6 | 0 | 5 | 4.6 | CN(CC1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2010.03.027 | |||
| CHEMBL550818 | 195222 | 0 | None | 1230 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 436 | 6 | 0 | 5 | 4.6 | CN(CC1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2010.03.027 | |||
| CHEMBL5276489 | 194643 | 0 | None | 70 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 4.4 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315725 | 194643 | 0 | None | 70 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 4.4 | O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCCC1 | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5275284 | 194654 | 0 | None | 5 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 466 | 8 | 1 | 5 | 3.9 | CC(C)C(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315872 | 194654 | 0 | None | 5 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 466 | 8 | 1 | 5 | 3.9 | CC(C)C(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 9870185 | 84096 | 0 | None | -2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 489 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2207666 | 84096 | 0 | None | -2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 489 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| 59296104 | 84216 | 0 | None | -1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 503 | 7 | 2 | 5 | 3.8 | CN(C[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)C(=O)c1c[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208433 | 84216 | 0 | None | -1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 503 | 7 | 2 | 5 | 3.8 | CN(C[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)C(=O)c1c[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| 59295994 | 84217 | 0 | None | 1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 489 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1cc(=O)[nH]c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208434 | 84217 | 0 | None | 1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 489 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1cc(=O)[nH]c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| 59296090 | 84092 | 0 | None | -1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.3 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)cc1C(F)(F)F | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207662 | 84092 | 0 | None | -1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.3 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)cc1C(F)(F)F | 10.1016/j.bmcl.2012.09.112 | |||
| 9870185 | 84096 | 0 | None | -2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 489 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207666 | 84096 | 0 | None | -2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 489 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| 10103 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 133017 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 2413 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL91397 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| DB11614 | 3416 | 72 | None | 25 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 155523802 | 170857 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 400 | 2 | 0 | 2 | 5.9 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4454015 | 170857 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 400 | 2 | 0 | 2 | 5.9 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccccc2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 155537274 | 172263 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 378 | 1 | 0 | 2 | 5.7 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4474559 | 172263 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 378 | 1 | 0 | 2 | 5.7 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(C2CCCC2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 168276508 | 190266 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 1140 | 28 | 6 | 11 | 6.9 | C[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)NCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1 | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5175488 | 190266 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 1140 | 28 | 6 | 11 | 6.9 | C[C@@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)NCCNC(=O)CCCCCNC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4ccc(-c5cccs5)n4[B-]3(F)F)C=C2)cc1 | 10.1021/acs.jmedchem.2c00125 | |||
| 44395497 | 66832 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 560 | 11 | 2 | 5 | 5.4 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL186125 | 66832 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 560 | 11 | 2 | 5 | 5.4 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 9998826 | 120477 | 0 | None | -69 | 5 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.1 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccccc1 | 10.1021/jm950759z | |||
| CHEMBL354210 | 120477 | 0 | None | -69 | 5 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.1 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccccc1 | 10.1021/jm950759z | |||
| 72152556 | 162938 | 4 | None | -2 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 335 | 5 | 1 | 5 | 2.5 | Fc1ccc(N2CCN(CCNc3cncc(Cl)n3)CC2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4174330 | 162938 | 4 | None | -2 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 335 | 5 | 1 | 5 | 2.5 | Fc1ccc(N2CCN(CCNc3cncc(Cl)n3)CC2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| 44288769 | 101148 | 0 | None | -275 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 542 | 7 | 1 | 4 | 4.5 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3F)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL295395 | 101148 | 0 | None | -275 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 542 | 7 | 1 | 4 | 4.5 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3F)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| 9958732 | 165991 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 532 | 9 | 2 | 5 | 4.6 | NC(=O)N(O)CCC#Cc1ccc(OCCN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL425358 | 165991 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 532 | 9 | 2 | 5 | 4.6 | NC(=O)N(O)CCC#Cc1ccc(OCCN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 127052294 | 140302 | 0 | None | -15 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3806079 | 140302 | 0 | None | -15 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 168290397 | 191971 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5201087 | 191971 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| 44304385 | 203178 | 0 | None | -61 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 404 | 11 | 0 | 5 | 4.4 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64259 | 203178 | 0 | None | -61 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 404 | 11 | 0 | 5 | 4.4 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 168281536 | 192881 | 0 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 369 | 12 | 4 | 5 | 1.7 | Cc1nnc(CCCN/C(N)=N/C(=O)NCCCCCCCCN)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5189006 | 192881 | 0 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 369 | 12 | 4 | 5 | 1.7 | Cc1nnc(CCCN/C(N)=N/C(=O)NCCCCCCCCN)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221966 | 192881 | 0 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 369 | 12 | 4 | 5 | 1.7 | Cc1nnc(CCCN/C(N)=N/C(=O)NCCCCCCCCN)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168290397 | 191971 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5201087 | 191971 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| 11753159 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 7679 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158814 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 68938028 | 81260 | 0 | None | -6 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1ccccc1C[C@@H](C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158772 | 81260 | 0 | None | -6 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1ccccc1C[C@@H](C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 12001832 | 81272 | 0 | None | -63 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 522 | 8 | 1 | 4 | 5.7 | Cc1c(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158784 | 81272 | 0 | None | -63 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 522 | 8 | 1 | 4 | 5.7 | Cc1c(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 66615627 | 81278 | 0 | None | -158 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 536 | 8 | 1 | 4 | 6.1 | Cc1c(OC2CCN(CC3CCN([C@@](C)(Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158790 | 81278 | 0 | None | -158 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 536 | 8 | 1 | 4 | 6.1 | Cc1c(OC2CCN(CC3CCN([C@@](C)(Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 71460419 | 81310 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 524 | 8 | 1 | 4 | 5.9 | O=C(O)[C@H](Cc1ccc(Cl)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158838 | 81310 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 524 | 8 | 1 | 4 | 5.9 | O=C(O)[C@H](Cc1ccc(Cl)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 59295939 | 84213 | 0 | None | -12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 461 | 7 | 3 | 4 | 4.1 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208430 | 84213 | 0 | None | -12 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 461 | 7 | 3 | 4 | 4.1 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 12660330 | 154590 | 3 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 255 | 7 | 1 | 2 | 3.3 | CNCCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3964404 | 154590 | 3 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 255 | 7 | 1 | 2 | 3.3 | CNCCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3991396 | 154590 | 3 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 255 | 7 | 1 | 2 | 3.3 | CNCCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 9888211 | 21416 | 13 | None | -39 | 10 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 417 | 6 | 1 | 3 | 4.5 | O=C1c2ccccc2C(=O)N1CCCCN1CC=C(c2c[nH]c3ccc(F)cc23)CC1 | 10.1021/jm070516u | |||
| CHEMBL131495 | 21416 | 13 | None | -39 | 10 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 417 | 6 | 1 | 3 | 4.5 | O=C1c2ccccc2C(=O)N1CCCCN1CC=C(c2c[nH]c3ccc(F)cc23)CC1 | 10.1021/jm070516u | |||
| 11753159 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1016/j.bmcl.2012.08.124 | |||
| 7679 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2158814 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 10.1016/j.bmcl.2012.08.124 | |||
| 71462390 | 82245 | 0 | None | 6 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 500 | 5 | 1 | 6 | 4.3 | O=C(c1ccc(-c2nn[nH]n2)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171026 | 82245 | 0 | None | 6 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 500 | 5 | 1 | 6 | 4.3 | O=C(c1ccc(-c2nn[nH]n2)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963315 | 82252 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 511 | 5 | 1 | 5 | 4.4 | O=C(NS(=O)(=O)c1ccccc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171033 | 82252 | 0 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 511 | 5 | 1 | 5 | 4.4 | O=C(NS(=O)(=O)c1ccccc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 71455217 | 82261 | 0 | None | 3 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1cccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171042 | 82261 | 0 | None | 3 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1cccc(S(=O)(=O)NC(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| 95338888 | 162526 | 1 | None | 1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 286 | 5 | 0 | 3 | 4.1 | CCCc1nc(CN2CC[C@H](c3ccccc3)C2)cs1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4167807 | 162526 | 1 | None | 1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 286 | 5 | 0 | 3 | 4.1 | CCCc1nc(CN2CC[C@H](c3ccccc3)C2)cs1 | 10.1021/acs.jmedchem.8b00718 | |||
| 14554145 | 30890 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3cc(Cl)c(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL139760 | 30890 | 0 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 386 | 0 | 0 | 2 | 4.9 | CC(=O)N1CCC(=C2c3cc(Cl)c(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 9549064 | 98011 | 3 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 318 | 5 | 0 | 4 | 3.9 | CCCc1ccc2c(c1)sc(=O)n2CCN1CCCCCC1 | 10.1007/s00044-005-0131-1 | |||
| CHEMBL272899 | 98011 | 3 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 318 | 5 | 0 | 4 | 3.9 | CCCc1ccc2c(c1)sc(=O)n2CCN1CCCCCC1 | 10.1007/s00044-005-0131-1 | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm501086v | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm501086v | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm501086v | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm501086v | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm501086v | |||
| 162669496 | 182595 | 0 | None | -45 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 466 | 4 | 0 | 3 | 5.1 | C[C@H]1CN(CC[C@H]2CC[C@H](N3C(=O)[C@H]4[C@H]5C=C[C@H](C5)[C@H]4C3=O)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL4788140 | 182595 | 0 | None | -45 | 4 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 466 | 4 | 0 | 3 | 5.1 | C[C@H]1CN(CC[C@H]2CC[C@H](N3C(=O)[C@H]4[C@H]5C=C[C@H](C5)[C@H]4C3=O)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| 122196381 | 124295 | 0 | None | -295 | 5 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 485 | 8 | 0 | 6 | 6.3 | Fc1ccc2c(C3CCN(CCCOc4ccc(Cc5nc6ccccc6o5)cc4)CC3)noc2c1 | 10.1016/j.bmcl.2015.09.045 | |||
| CHEMBL3634821 | 124295 | 0 | None | -295 | 5 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 485 | 8 | 0 | 6 | 6.3 | Fc1ccc2c(C3CCN(CCCOc4ccc(Cc5nc6ccccc6o5)cc4)CC3)noc2c1 | 10.1016/j.bmcl.2015.09.045 | |||
| 71454365 | 84201 | 0 | None | -1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 465 | 8 | 2 | 6 | 4.6 | O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)COc1ccc2ncsc2c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208418 | 84201 | 0 | None | -1 | 2 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 465 | 8 | 2 | 6 | 4.6 | O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)COc1ccc2ncsc2c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 17178058 | 146487 | 26 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 253 | 3 | 1 | 2 | 3.5 | c1ccc(-c2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3922367 | 146487 | 26 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 253 | 3 | 1 | 2 | 3.5 | c1ccc(-c2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 20252868 | 154482 | 1 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 241 | 6 | 1 | 2 | 3.0 | NCCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3981091 | 154482 | 1 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 241 | 6 | 1 | 2 | 3.0 | NCCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3990430 | 154482 | 1 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 241 | 6 | 1 | 2 | 3.0 | NCCCOc1ccccc1Cc1ccccc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 44270793 | 51343 | 0 | None | -30 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 328 | 6 | 2 | 4 | 2.9 | O=C(NN1CCC(c2ccccc2)CC1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL15813 | 51343 | 0 | None | -30 | 2 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 328 | 6 | 2 | 4 | 2.9 | O=C(NN1CCC(c2ccccc2)CC1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 155536080 | 172114 | 0 | None | -21 | 10 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 219 | 2 | 1 | 2 | 2.9 | CC[C@H]1c2cc(OC)ccc2CC[C@@]1(C)N | 10.1021/acsmedchemlett.9b00225 | |||
| CHEMBL4472703 | 172114 | 0 | None | -21 | 10 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 219 | 2 | 1 | 2 | 2.9 | CC[C@H]1c2cc(OC)ccc2CC[C@@]1(C)N | 10.1021/acsmedchemlett.9b00225 | |||
| 11723317 | 102894 | 0 | None | -100 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 316 | 9 | 3 | 2 | 2.8 | S=C(NCCCCCc1c[nH]cn1)NCCc1ccccc1 | 10.1021/jm00012a025 | |||
| CHEMBL305929 | 102894 | 0 | None | -100 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 316 | 9 | 3 | 2 | 2.8 | S=C(NCCCCCc1c[nH]cn1)NCCc1ccccc1 | 10.1021/jm00012a025 | |||
| 10015196 | 103620 | 0 | None | -158 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 254 | 8 | 3 | 2 | 2.4 | CCC/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| CHEMBL308717 | 103620 | 0 | None | -158 | 3 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 254 | 8 | 3 | 2 | 2.4 | CCC/N=C(\S)NCCCCCc1c[nH]cn1 | 10.1021/jm00012a025 | |||
| 10803416 | 54615 | 0 | None | -1023 | 2 | Guinea pig | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 290 | 6 | 2 | 5 | 2.5 | O=C(Nc1ccccc1[N+](=O)[O-])OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16109 | 54615 | 0 | None | -1023 | 2 | Guinea pig | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 290 | 6 | 2 | 5 | 2.5 | O=C(Nc1ccccc1[N+](=O)[O-])OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 90654502 | 110311 | 0 | None | -741 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 319 | 9 | 2 | 4 | 1.9 | C[C@H](NCc1ccc(OCCCN2CCCCC2)cc1)C(N)=O | 10.1016/j.ejmech.2014.03.014 | |||
| CHEMBL3238446 | 110311 | 0 | None | -741 | 2 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 319 | 9 | 2 | 4 | 1.9 | C[C@H](NCc1ccc(OCCCN2CCCCC2)cc1)C(N)=O | 10.1016/j.ejmech.2014.03.014 | |||
| 53317594 | 57751 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 318 | 6 | 0 | 4 | 3.4 | C[C@H](C1=C(CCN(C)CC#N)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669409 | 57751 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 318 | 6 | 0 | 4 | 3.4 | C[C@H](C1=C(CCN(C)CC#N)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 155544150 | 173334 | 0 | None | 8 | 2 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 316 | 5 | 0 | 3 | 2.8 | CC1CCN(CCCOc2ccc3c(c2)C(=O)N(C)CC3)CC1 | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4526723 | 173334 | 0 | None | 8 | 2 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 316 | 5 | 0 | 3 | 2.8 | CC1CCN(CCCOc2ccc3c(c2)C(=O)N(C)CC3)CC1 | 10.1016/j.bmcl.2019.04.015 | |||
| 72152555 | 162730 | 5 | None | 1 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 345 | 7 | 1 | 5 | 3.1 | Clc1cncc(NCCCCN2CCN(c3ccccc3)CC2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4171171 | 162730 | 5 | None | 1 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 345 | 7 | 1 | 5 | 3.1 | Clc1cncc(NCCCCN2CCN(c3ccccc3)CC2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| 44326320 | 112819 | 0 | None | 2 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 295 | 2 | 0 | 3 | 4.0 | CN(C)CC1C[C@H]2c3ccccc3Oc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL330713 | 112819 | 0 | None | 2 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 295 | 2 | 0 | 3 | 4.0 | CN(C)CC1C[C@H]2c3ccccc3Oc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 1853 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1016/S0960-894X(00)80290-5 | |||
| 60680 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL10971 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1016/S0960-894X(00)80290-5 | |||
| 1853 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1016/s0960-894x(98)00626-x | |||
| 60680 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL10971 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1016/s0960-894x(98)00626-x | |||
| 1853 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1021/jm00105a069 | |||
| 60680 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1021/jm00105a069 | |||
| CHEMBL10971 | 3551 | 38 | None | - | 1 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 352 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)CCc1c(C2=C2CCN(CC2)C(=O)C)nccc1 | 10.1021/jm00105a069 | |||
| 45485498 | 197671 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 231 | 5 | 0 | 1 | 3.8 | Cc1ccc(CCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL571073 | 197671 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 231 | 5 | 0 | 1 | 3.8 | Cc1ccc(CCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 46884062 | 8359 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 296 | 5 | 1 | 3 | 4.2 | CNCCc1sc2ccccc2c1[C@@H](C)c1ccccn1 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1093044 | 8359 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 296 | 5 | 1 | 3 | 4.2 | CNCCc1sc2ccccc2c1[C@@H](C)c1ccccn1 | 10.1016/j.bmcl.2010.01.134 | |||
| 95339542 | 162030 | 1 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 286 | 4 | 0 | 3 | 4.3 | CC(C)c1nc(CN2CC[C@H](c3ccccc3)C2)cs1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4159893 | 162030 | 1 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 286 | 4 | 0 | 3 | 4.3 | CC(C)c1nc(CN2CC[C@H](c3ccccc3)C2)cs1 | 10.1021/acs.jmedchem.8b00718 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 44335571 | 5272 | 0 | None | -128 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 3.3 | N#Cc1ccc(-c2ccc(OCCCN3CCOCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL106483 | 5272 | 0 | None | -128 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 3.3 | N#Cc1ccc(-c2ccc(OCCCN3CCOCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 40011786 | 69028 | 3 | None | -32 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 282 | 2 | 0 | 4 | 2.7 | c1ccc2c(N3CCN(C4CCCC4)CC3)ncnc2c1 | 10.1021/jm2011589 | |||
| CHEMBL1923530 | 69028 | 3 | None | -32 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 282 | 2 | 0 | 4 | 2.7 | c1ccc2c(N3CCN(C4CCCC4)CC3)ncnc2c1 | 10.1021/jm2011589 | |||
| 25491778 | 162665 | 1 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 378 | 6 | 0 | 5 | 5.1 | CO[C@@H]1CCCN(Cc2nc(-c3cccc(Oc4ccccc4)c3)oc2C)C1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4170001 | 162665 | 1 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 378 | 6 | 0 | 5 | 5.1 | CO[C@@H]1CCCN(Cc2nc(-c3cccc(Oc4ccccc4)c3)oc2C)C1 | 10.1021/acs.jmedchem.8b00718 | |||
| 11023546 | 78478 | 0 | None | 2 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 317 | 1 | 0 | 4 | 3.1 | CN1CCN([C@H]2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| CHEMBL2111783 | 78478 | 0 | None | 2 | 4 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 317 | 1 | 0 | 4 | 3.1 | CN1CCN([C@H]2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm049632c | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm049632c | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm049632c | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm049632c | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm049632c | |||
| 44401194 | 71295 | 0 | None | -4 | 7 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 313 | 2 | 0 | 3 | 4.1 | CN(C)C[C@@H]1CC2c3ccccc3Oc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL195706 | 71295 | 0 | None | -4 | 7 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 313 | 2 | 0 | 3 | 4.1 | CN(C)C[C@@H]1CC2c3ccccc3Oc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 56835171 | 69740 | 0 | None | -204 | 9 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 295 | 2 | 2 | 6 | 1.9 | Nc1nc(N2CCNCC2)c2ccc(-c3ccco3)cc2n1 | 10.1016/j.bmcl.2011.10.104 | |||
| CHEMBL1935574 | 69740 | 0 | None | -204 | 9 | Mouse | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 295 | 2 | 2 | 6 | 1.9 | Nc1nc(N2CCNCC2)c2ccc(-c3ccco3)cc2n1 | 10.1016/j.bmcl.2011.10.104 | |||
| 44304412 | 201648 | 0 | None | -223 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 517 | 13 | 1 | 6 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL60598 | 201648 | 0 | None | -223 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 517 | 13 | 1 | 6 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304753 | 203195 | 0 | None | -363 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 466 | 13 | 1 | 6 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)Cc3ccncc3)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64321 | 203195 | 0 | None | -363 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 466 | 13 | 1 | 6 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)Cc3ccncc3)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 112936267 | 137295 | 1 | None | 2 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 373 | 6 | 1 | 5 | 3.6 | CN1CCN(c2cc(-c3ccccc3)nc(NCCc3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752383 | 137295 | 1 | None | 2 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 373 | 6 | 1 | 5 | 3.6 | CN1CCN(c2cc(-c3ccccc3)nc(NCCc3ccccc3)n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 132060776 | 162402 | 0 | None | -1 | 16 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 419 | 4 | 0 | 4 | 4.4 | O=C(OCc1ccccc1)N1CCc2ccc(N3CCN(C4CCCC4)CC3)cc2C1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4165863 | 162402 | 0 | None | -1 | 16 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 419 | 4 | 0 | 4 | 4.4 | O=C(OCc1ccccc1)N1CCc2ccc(N3CCN(C4CCCC4)CC3)cc2C1 | 10.1016/j.ejmech.2018.02.024 | |||
| 168296769 | 192332 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 758 | 20 | 7 | 9 | 0.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5206578 | 192332 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 758 | 20 | 7 | 9 | 0.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304256 | 168019 | 0 | None | -123 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 360 | 12 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(CCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL432144 | 168019 | 0 | None | -123 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 360 | 12 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(CCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 127035836 | 137518 | 0 | None | 5 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 399 | 4 | 1 | 5 | 3.9 | Cc1ccc(CNc2nc3c(c(N4CCN(C)CC4)n2)CCc2ccccc2-3)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3754176 | 137518 | 0 | None | 5 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 399 | 4 | 1 | 5 | 3.9 | Cc1ccc(CNc2nc3c(c(N4CCN(C)CC4)n2)CCc2ccccc2-3)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| 71525678 | 89725 | 0 | None | -3548 | 6 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 258 | 3 | 2 | 6 | 0.6 | CCc1cnc2c(N3CC(NC)C3)nc(N)nc2c1 | 10.1016/j.bmcl.2013.02.091 | |||
| CHEMBL2376800 | 89725 | 0 | None | -3548 | 6 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 258 | 3 | 2 | 6 | 0.6 | CCc1cnc2c(N3CC(NC)C3)nc(N)nc2c1 | 10.1016/j.bmcl.2013.02.091 | |||
| 129103322 | 167373 | 0 | None | -53 | 6 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | O=C1CCc2cc(C(O)CCCN3CCC(c4noc5cc(F)ccc45)CC3)cc3c2N1CC3 | 10.1021/acs.jmedchem.8b01096 | |||
| CHEMBL4294799 | 167373 | 0 | None | -53 | 6 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 463 | 6 | 1 | 5 | 4.5 | O=C1CCc2cc(C(O)CCCN3CCC(c4noc5cc(F)ccc45)CC3)cc3c2N1CC3 | 10.1021/acs.jmedchem.8b01096 | |||
| 168296769 | 192332 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 758 | 20 | 7 | 9 | 0.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5206578 | 192332 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 758 | 20 | 7 | 9 | 0.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 2812 | 4779 | 101 | None | -28 | 34 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
| CHEMBL104 | 4779 | 101 | None | -28 | 34 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | nan | |||
| 44335384 | 4638 | 0 | None | -489 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.9 | CC1CCCCN1CCCOc1ccc(-c2ccc(C#N)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL102984 | 4638 | 0 | None | -489 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.9 | CC1CCCCN1CCCOc1ccc(-c2ccc(C#N)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 44304277 | 100947 | 0 | None | -457 | 3 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 401 | 10 | 1 | 5 | 2.4 | CN[C@@H](C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1)C(C)C | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL294087 | 100947 | 0 | None | -457 | 3 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 401 | 10 | 1 | 5 | 2.4 | CN[C@@H](C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1)C(C)C | 10.1016/s0960-894x(02)00310-4 | |||
| 46884638 | 7724 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1cnc(CC2=C(CCN(C)C)Cc3ccccc32)cn1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1088899 | 7724 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1cnc(CC2=C(CCN(C)C)Cc3ccccc32)cn1 | 10.1016/j.bmcl.2010.02.055 | |||
| 155566038 | 175742 | 0 | None | 26 | 2 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 318 | 5 | 1 | 4 | 1.5 | CN1CCc2ccc(OCCCN3CCC(O)CC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4583183 | 175742 | 0 | None | 26 | 2 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 318 | 5 | 1 | 4 | 1.5 | CN1CCc2ccc(OCCCN3CCC(O)CC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 51111982 | 162578 | 6 | None | 1 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 344 | 5 | 0 | 4 | 3.2 | N#Cc1c(CN2CCN(CCc3ccccc3)CC2)cn2ccccc12 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4168691 | 162578 | 6 | None | 1 | 3 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 344 | 5 | 0 | 4 | 3.2 | N#Cc1c(CN2CCN(CCc3ccccc3)CC2)cn2ccccc12 | 10.1021/acs.jmedchem.8b00718 | |||
| 11623845 | 8323 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 4.6 | CC(c1nccs1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092767 | 8323 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 4.6 | CC(c1nccs1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm00105a069 | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm00105a069 | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm00105a069 | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL5274312 | 193809 | 0 | None | -3 | 5 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 383 | 4 | 0 | 3 | 5.0 | CC[Si](C#Cc1cccc2c1OC(C(F)(F)F)C([N+](=O)[O-])=C2)(CC)CC | 10.1016/j.bmcl.2022.128981 | |||
| 44335351 | 5067 | 0 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 402 | 7 | 0 | 4 | 4.6 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(Cl)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105385 | 5067 | 0 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 402 | 7 | 0 | 4 | 4.6 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(Cl)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 44304021 | 102795 | 0 | None | -9 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 374 | 8 | 0 | 5 | 3.4 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)C=C(C)C)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL305313 | 102795 | 0 | None | -9 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 374 | 8 | 0 | 5 | 3.4 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)C=C(C)C)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 10069595 | 203128 | 0 | None | -112 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 400 | 11 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C3CCC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64100 | 203128 | 0 | None | -112 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 400 | 11 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C3CCC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335350 | 5080 | 0 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 398 | 8 | 0 | 5 | 3.9 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(OC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105483 | 5080 | 0 | None | -1 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 398 | 8 | 0 | 5 | 3.9 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(OC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 44335336 | 4558 | 0 | None | -27 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 335 | 6 | 1 | 4 | 3.4 | N#Cc1ccc(-c2ccc(OCCCN3CCC(N)CC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL102452 | 4558 | 0 | None | -27 | 4 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 335 | 6 | 1 | 4 | 3.4 | N#Cc1ccc(-c2ccc(OCCCN3CCC(N)CC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 25109291 | 191386 | 10 | None | -83176 | 8 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 327 | 1 | 2 | 6 | 1.7 | Nc1nc2c(c(N3CCNCC3)n1)CCC1=C2[C@@H]2CCCC[C@@H]2O1 | 10.1021/jm8007618 | |||
| CHEMBL519240 | 191386 | 10 | None | -83176 | 8 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 327 | 1 | 2 | 6 | 1.7 | Nc1nc2c(c(N3CCNCC3)n1)CCC1=C2[C@@H]2CCCC[C@@H]2O1 | 10.1021/jm8007618 | |||
| 168273640 | 192805 | 0 | None | -100 | 6 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 568 | 15 | 8 | 10 | -0.1 | N/C(=N\C(=O)NCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5176229 | 192805 | 0 | None | -100 | 6 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 568 | 15 | 8 | 10 | -0.1 | N/C(=N\C(=O)NCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221444 | 192805 | 0 | None | -100 | 6 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 568 | 15 | 8 | 10 | -0.1 | N/C(=N\C(=O)NCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 44304012 | 202832 | 0 | None | -18620 | 3 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 389 | 11 | 1 | 5 | 2.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](C)N)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62421 | 202832 | 0 | None | -18620 | 3 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 389 | 11 | 1 | 5 | 2.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](C)N)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44289035 | 100514 | 0 | None | -186 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 524 | 7 | 1 | 4 | 4.4 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL291166 | 100514 | 0 | None | -186 | 7 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 524 | 7 | 1 | 4 | 4.4 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| 50985821 | 176218 | 31 | None | -2 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 474 | 5 | 2 | 5 | 6.2 | N=c1c2c(-c3ccccc3)c(-c3ccccc3)n(Cc3ccccc3)c2ncn1[C@H]1CC[C@H](O)CC1 | 10.1021/acs.jmedchem.2c00204 | |||
| CHEMBL4594433 | 176218 | 31 | None | -2 | 3 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 474 | 5 | 2 | 5 | 6.2 | N=c1c2c(-c3ccccc3)c(-c3ccccc3)n(Cc3ccccc3)c2ncn1[C@H]1CC[C@H](O)CC1 | 10.1021/acs.jmedchem.2c00204 | |||
| 44343572 | 10286 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 383 | 3 | 0 | 3 | 3.9 | CCCC(=O)N1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL116144 | 10286 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 383 | 3 | 0 | 3 | 3.9 | CCCC(=O)N1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| 71457970 | 78470 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 355 | 1 | 0 | 3 | 3.1 | CC(=O)N1CCN([C@@H]2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL2111767 | 78470 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 355 | 1 | 0 | 3 | 3.1 | CC(=O)N1CCN([C@@H]2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| 19918406 | 111359 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 367 | 1 | 0 | 3 | 3.2 | O=C1CCC2CN(C3c4ccc(Cl)cc4CCc4cccnc43)CCN12 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL326978 | 111359 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 367 | 1 | 0 | 3 | 3.2 | O=C1CCC2CN(C3c4ccc(Cl)cc4CCc4cccnc43)CCN12 | 10.1016/s0960-894x(98)00626-x | |||
| 11848625 | 5792 | 0 | None | -38 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 451 | 8 | 1 | 7 | 4.9 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)cc(OC2CCOCC2)c1 | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL1078745 | 5792 | 0 | None | -38 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 451 | 8 | 1 | 7 | 4.9 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)cc(OC2CCOCC2)c1 | 10.1016/j.bmcl.2009.09.024 | |||
| 44334407 | 109085 | 0 | None | -1202 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 462 | 10 | 1 | 5 | 3.8 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3cccc(Cl)c3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL321320 | 109085 | 0 | None | -1202 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 462 | 10 | 1 | 5 | 3.8 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3cccc(Cl)c3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 56835171 | 69740 | 0 | None | -223 | 9 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 295 | 2 | 2 | 6 | 1.9 | Nc1nc(N2CCNCC2)c2ccc(-c3ccco3)cc2n1 | 10.1016/j.bmcl.2011.10.104 | |||
| CHEMBL1935574 | 69740 | 0 | None | -223 | 9 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 295 | 2 | 2 | 6 | 1.9 | Nc1nc(N2CCNCC2)c2ccc(-c3ccco3)cc2n1 | 10.1016/j.bmcl.2011.10.104 | |||
| 127052465 | 140731 | 0 | None | -97 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 340 | 5 | 0 | 3 | 3.6 | O=C1c2ccccc2C(=O)N1CCCCN1CCC2CCCCC2C1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3817911 | 140731 | 0 | None | -97 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 340 | 5 | 0 | 3 | 3.6 | O=C1c2ccccc2C(=O)N1CCCCN1CCC2CCCCC2C1 | 10.1016/j.bmc.2016.05.053 | |||
| 127052465 | 140731 | 0 | None | -97 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 340 | 5 | 0 | 3 | 3.6 | O=C1c2ccccc2C(=O)N1CCCCN1CCC2CCCCC2C1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3817911 | 140731 | 0 | None | -97 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 340 | 5 | 0 | 3 | 3.6 | O=C1c2ccccc2C(=O)N1CCCCN1CCC2CCCCC2C1 | 10.1016/j.bmc.2016.05.053 | |||
| 162662563 | 182046 | 0 | None | -61 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 391 | 7 | 0 | 4 | 4.5 | Fc1ccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4781093 | 182046 | 0 | None | -61 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 391 | 7 | 0 | 4 | 4.5 | Fc1ccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm049495j | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm049495j | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm049495j | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm049495j | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1021/jm049495j | |||
| 10660 | 14416 | 58 | None | 2 | 12 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 469 | 6 | 1 | 7 | 3.0 | CN(C)CCOC(c1ccccc1)c1ccccc1.Cn1c(=O)c2[nH]c(Cl)nc2n(C)c1=O | nan | |||
| CHEMBL1200406 | 14416 | 58 | None | 2 | 12 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 469 | 6 | 1 | 7 | 3.0 | CN(C)CCOC(c1ccccc1)c1ccccc1.Cn1c(=O)c2[nH]c(Cl)nc2n(C)c1=O | nan | |||
| 44343938 | 113063 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 320 | 1 | 0 | 2 | 3.0 | CC(=O)N1CCN(C2c3ccccc3CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL331159 | 113063 | 0 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 320 | 1 | 0 | 2 | 3.0 | CC(=O)N1CCN(C2c3ccccc3CCc3ccccc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| 44334035 | 110045 | 0 | None | -741 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 476 | 10 | 1 | 7 | 4.1 | O=C(N[C@H]1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)C1)c1csc(-c2cccnc2)n1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL323517 | 110045 | 0 | None | -741 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 476 | 10 | 1 | 7 | 4.1 | O=C(N[C@H]1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)C1)c1csc(-c2cccnc2)n1 | 10.1016/s0960-894x(02)00685-6 | |||
| 2771 | 195017 | 74 | None | -2 | 27 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | nan | |||
| CHEMBL1200781 | 195017 | 74 | None | -2 | 27 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | nan | |||
| CHEMBL549 | 195017 | 74 | None | -2 | 27 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | nan | |||
| 168277300 | 190180 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 754 | 19 | 5 | 7 | 3.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5174142 | 190180 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 754 | 19 | 5 | 7 | 3.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| 10268636 | 5283 | 0 | None | -436 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 335 | 7 | 1 | 4 | 3.3 | CN[C@@H]1CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)C1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL106545 | 5283 | 0 | None | -436 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 335 | 7 | 1 | 4 | 3.3 | CN[C@@H]1CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)C1 | 10.1016/s0960-894x(02)00648-0 | |||
| 44335222 | 163456 | 0 | None | -1 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 369 | 7 | 0 | 5 | 3.3 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccncc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL419912 | 163456 | 0 | None | -1 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 369 | 7 | 0 | 5 | 3.3 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccncc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168294166 | 193014 | 0 | None | -1 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1ccc(-c2sc(N)nc2C)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5209081 | 193014 | 0 | None | -1 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1ccc(-c2sc(N)nc2C)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222775 | 193014 | 0 | None | -1 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1ccc(-c2sc(N)nc2C)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 44304329 | 203227 | 0 | None | -1230 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 385 | 8 | 1 | 5 | 1.9 | O=C(c1ccc(OCCCN2CCN(C(=O)[C@H]3CCCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64461 | 203227 | 0 | None | -1230 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 385 | 8 | 1 | 5 | 1.9 | O=C(c1ccc(OCCCN2CCN(C(=O)[C@H]3CCCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 168277300 | 190180 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 754 | 19 | 5 | 7 | 3.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5174142 | 190180 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 754 | 19 | 5 | 7 | 3.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O)C(C)C | 10.1021/acs.jmedchem.2c00125 | |||
| 71450550 | 83807 | 0 | None | -7 | 16 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1ccccc1CCN1C2C3C4CC5C6C4C2C6C1(O)C53 | 10.1016/j.bmcl.2012.08.046 | |||
| CHEMBL2205836 | 83807 | 0 | None | -7 | 16 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1ccccc1CCN1C2C3C4CC5C6C4C2C6C1(O)C53 | 10.1016/j.bmcl.2012.08.046 | |||
| 44455426 | 155149 | 0 | None | -5 | 12 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 405 | 9 | 1 | 4 | 4.2 | COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| CHEMBL402143 | 155149 | 0 | None | -5 | 12 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 405 | 9 | 1 | 4 | 4.2 | COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| 9894665 | 103813 | 1 | None | -114 | 8 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 585 | 10 | 2 | 8 | 3.3 | CC(C)Oc1ccccc1N1CCN(C[C@@H](O)CNC(=O)c2ccc3c(c2)C(=O)N(c2ccc(N(C)C)cc2)C3=O)CC1 | 10.1021/jm9905918 | |||
| CHEMBL309106 | 103813 | 1 | None | -114 | 8 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 585 | 10 | 2 | 8 | 3.3 | CC(C)Oc1ccccc1N1CCN(C[C@@H](O)CNC(=O)c2ccc3c(c2)C(=O)N(c2ccc(N(C)C)cc2)C3=O)CC1 | 10.1021/jm9905918 | |||
| 46884119 | 8150 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | CC(c1cccc(F)n1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091793 | 8150 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 328 | 5 | 0 | 3 | 4.7 | CC(c1cccc(F)n1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 57334404 | 90512 | 0 | None | -3 | 5 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 512 | 8 | 0 | 6 | 6.8 | O=c1cc(-c2ccccc2)c2ccc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc2o1 | 10.1021/jm400408r | |||
| CHEMBL2387265 | 90512 | 0 | None | -3 | 5 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 512 | 8 | 0 | 6 | 6.8 | O=c1cc(-c2ccccc2)c2ccc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc2o1 | 10.1021/jm400408r | |||
| 2389 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2015.09.045 | |||
| 5073 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2015.09.045 | |||
| 96 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2015.09.045 | |||
| CHEMBL85 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2015.09.045 | |||
| DB00734 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1016/j.bmcl.2015.09.045 | |||
| 44335368 | 5050 | 0 | None | 2 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 393 | 7 | 0 | 5 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3cccc(C#N)c3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105268 | 5050 | 0 | None | 2 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 393 | 7 | 0 | 5 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3cccc(C#N)c3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 44304282 | 203113 | 0 | None | -1 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 8 | 0 | 5 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3cccc(C)c3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64021 | 203113 | 0 | None | -1 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 410 | 8 | 0 | 5 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3cccc(C)c3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 11808247 | 18075 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL126667 | 18075 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819366 | 18075 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 127052294 | 140302 | 0 | None | -15 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3806079 | 140302 | 0 | None | -15 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 164610892 | 185198 | 0 | None | -53 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 394 | 8 | 4 | 4 | 3.2 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)CC1CCCCC1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4857560 | 185198 | 0 | None | -53 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 394 | 8 | 4 | 4 | 3.2 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)CC1CCCCC1 | 10.1016/j.ejmech.2021.113190 | |||
| 11808247 | 18075 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL126667 | 18075 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819366 | 18075 | 0 | None | -4 | 9 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 285 | 5 | 0 | 2 | 3.7 | Fc1ccc(OCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 71452382 | 83794 | 0 | None | -120 | 10 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1ccc(CCN2C3C4C5CC6C7C5C3C7C2(O)C64)cc1 | 10.1016/j.bmcl.2012.08.046 | |||
| CHEMBL2205812 | 83794 | 0 | None | -120 | 10 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1ccc(CCN2C3C4C5CC6C7C5C3C7C2(O)C64)cc1 | 10.1016/j.bmcl.2012.08.046 | |||
| 1353 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm010982y | |||
| 3559 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm010982y | |||
| 86 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm010982y | |||
| CHEMBL54 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm010982y | |||
| DB00502 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm010982y | |||
| 1353 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm0309811 | |||
| 3559 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm0309811 | |||
| 86 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm0309811 | |||
| CHEMBL54 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm0309811 | |||
| DB00502 | 1911 | 93 | None | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm0309811 | |||
| 46882224 | 6348 | 0 | None | -354 | 5 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 543 | 10 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)CC)ccc4o3)CC2)cc(OC2CCOCC2)c1 | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL1082036 | 6348 | 0 | None | -354 | 5 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 543 | 10 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)CC)ccc4o3)CC2)cc(OC2CCOCC2)c1 | 10.1016/j.bmcl.2009.09.024 | |||
| 20293994 | 199815 | 8 | None | 1 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 239 | 6 | 1 | 1 | 3.8 | CNCCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL594138 | 199815 | 8 | None | 1 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 239 | 6 | 1 | 1 | 3.8 | CNCCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| 11393516 | 5172 | 0 | None | -467 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 335 | 6 | 1 | 4 | 3.3 | N#Cc1ccc(-c2ccc(OCCCN3CCCNCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105967 | 5172 | 0 | None | -467 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 335 | 6 | 1 | 4 | 3.3 | N#Cc1ccc(-c2ccc(OCCCN3CCCNCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 69355600 | 78685 | 0 | None | -954 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 336 | 6 | 1 | 4 | 3.5 | C[C@@]1(O)CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)C1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL2112461 | 78685 | 0 | None | -954 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 336 | 6 | 1 | 4 | 3.5 | C[C@@]1(O)CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)C1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168278543 | 192851 | 0 | None | -2 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 358 | 4 | 4 | 4 | 1.6 | N/C(=N\C(=O)NCc1ccccc1)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5184846 | 192851 | 0 | None | -2 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 358 | 4 | 4 | 4 | 1.6 | N/C(=N\C(=O)NCc1ccccc1)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221764 | 192851 | 0 | None | -2 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 358 | 4 | 4 | 4 | 1.6 | N/C(=N\C(=O)NCc1ccccc1)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168284289 | 192906 | 0 | None | -3 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 428 | 8 | 4 | 4 | 3.1 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5194860 | 192906 | 0 | None | -3 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 428 | 8 | 4 | 4 | 3.1 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222123 | 192906 | 0 | None | -3 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 428 | 8 | 4 | 4 | 3.1 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| 44301729 | 200942 | 0 | None | -1 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 382 | 11 | 2 | 3 | 5.0 | Clc1ccc(C(CCNCCCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL60175 | 200942 | 0 | None | -1 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 382 | 11 | 2 | 3 | 5.0 | Clc1ccc(C(CCNCCCCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00357-3 | |||
| 141485892 | 170978 | 0 | None | 4 | 2 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 288 | 5 | 0 | 3 | 2.2 | CN1CCc2ccc(OCCCN3CCCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4456092 | 170978 | 0 | None | 4 | 2 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 288 | 5 | 0 | 3 | 2.2 | CN1CCc2ccc(OCCCN3CCCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 44622872 | 197716 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 413 | 8 | 1 | 2 | 6.0 | Cc1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL571389 | 197716 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 413 | 8 | 1 | 2 | 6.0 | Cc1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 66615619 | 81271 | 0 | None | -79 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 522 | 8 | 1 | 4 | 5.7 | Cc1c(Cl)ccc(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158783 | 81271 | 0 | None | -79 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 522 | 8 | 1 | 4 | 5.7 | Cc1c(Cl)ccc(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 71462103 | 81302 | 1 | None | 2 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 5.2 | O=C(O)COc1ccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158830 | 81302 | 1 | None | 2 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 5.2 | O=C(O)COc1ccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| 59296099 | 84090 | 0 | None | -50 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 494 | 7 | 3 | 5 | 3.7 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]nc3C(F)(F)F)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207660 | 84090 | 0 | None | -50 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 494 | 7 | 3 | 5 | 3.7 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]nc3C(F)(F)F)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| 2337 | 3256 | 77 | None | -1 | 62 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm070516u | |||
| 50 | 3256 | 77 | None | -1 | 62 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm070516u | |||
| 5002 | 3256 | 77 | None | -1 | 62 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm070516u | |||
| CHEMBL716 | 3256 | 77 | None | -1 | 62 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm070516u | |||
| DB01224 | 3256 | 77 | None | -1 | 62 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1021/jm070516u | |||
| 71449859 | 82248 | 0 | None | 10 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 600 | 10 | 1 | 8 | 5.1 | O=C(O)CCCCn1nnc(-c2ccc(C(=O)N3CCC(N4CCC(Oc5ccc(Cl)c(Cl)c5)CC4)CC3)cc2)n1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171029 | 82248 | 0 | None | 10 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 600 | 10 | 1 | 8 | 5.1 | O=C(O)CCCCn1nnc(-c2ccc(C(=O)N3CCC(N4CCC(Oc5ccc(Cl)c(Cl)c5)CC4)CC3)cc2)n1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963347 | 82264 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 579 | 5 | 1 | 5 | 5.4 | O=C(NS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171045 | 82264 | 0 | None | -1 | 2 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 579 | 5 | 1 | 5 | 5.4 | O=C(NS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 11702578 | 8148 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1ccnc(C(C)c2c(CCN(C)C)sc3ccccc23)c1 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091791 | 8148 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1ccnc(C(C)c2c(CCN(C)C)sc3ccccc23)c1 | 10.1016/j.bmcl.2010.01.134 | |||
| 25212275 | 174421 | 0 | None | -9332 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 682 | 13 | 0 | 8 | 7.4 | O=C(OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1)c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL455288 | 174421 | 0 | None | -9332 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 682 | 13 | 0 | 8 | 7.4 | O=C(OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1)c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| 10436842 | 100256 | 0 | None | -501 | 7 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 524 | 7 | 1 | 4 | 4.6 | CC1=C(C(=O)NCCCN2CCC(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL288772 | 100256 | 0 | None | -501 | 7 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 524 | 7 | 1 | 4 | 4.6 | CC1=C(C(=O)NCCCN2CCC(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| 44304247 | 202809 | 0 | None | -38 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 412 | 11 | 0 | 5 | 4.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccco3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62312 | 202809 | 0 | None | -38 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 412 | 11 | 0 | 5 | 4.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccco3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 71451390 | 81266 | 0 | None | -7 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 474 | 8 | 1 | 4 | 4.7 | O=C(O)[C@H](Cc1ccc(F)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)cc3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158778 | 81266 | 0 | None | -7 | 2 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 474 | 8 | 1 | 4 | 4.7 | O=C(O)[C@H](Cc1ccc(F)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)cc3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 1353 | 1911 | 93 | None | -213 | 83 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm070516u | |||
| 3559 | 1911 | 93 | None | -213 | 83 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm070516u | |||
| 86 | 1911 | 93 | None | -213 | 83 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm070516u | |||
| CHEMBL54 | 1911 | 93 | None | -213 | 83 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm070516u | |||
| DB00502 | 1911 | 93 | None | -213 | 83 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm070516u | |||
| 44304291 | 202852 | 0 | None | -891 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 388 | 11 | 0 | 4 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62527 | 202852 | 0 | None | -891 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 388 | 11 | 0 | 4 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)C(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335238 | 5089 | 0 | None | -1862 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 348 | 6 | 0 | 3 | 5.3 | CC1CCCC(C)N1CCCOc1ccc(-c2ccc(C#N)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105515 | 5089 | 0 | None | -1862 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 348 | 6 | 0 | 3 | 5.3 | CC1CCCC(C)N1CCCOc1ccc(-c2ccc(C#N)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168294182 | 193048 | 0 | None | -57 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 314 | 6 | 4 | 2 | 1.7 | C[C@@H](NC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5208722 | 193048 | 0 | None | -57 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 314 | 6 | 4 | 2 | 1.7 | C[C@@H](NC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222960 | 193048 | 0 | None | -57 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 314 | 6 | 4 | 2 | 1.7 | C[C@@H](NC(=O)/N=C(\N)NCCCc1c[nH]cn1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 10017820 | 204195 | 0 | None | -199 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 302 | 8 | 3 | 2 | 2.8 | S=C(NCCCCCc1c[nH]cn1)NCc1ccccc1 | 10.1021/jm00012a025 | |||
| CHEMBL70811 | 204195 | 0 | None | -199 | 3 | Guinea pig | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 302 | 8 | 3 | 2 | 2.8 | S=C(NCCCCCc1c[nH]cn1)NCc1ccccc1 | 10.1021/jm00012a025 | |||
| 18878 | 144203 | 90 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 177 | 2 | 1 | 2 | 1.8 | c1ccc(OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3904359 | 144203 | 90 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 177 | 2 | 1 | 2 | 1.8 | c1ccc(OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 10686633 | 56532 | 0 | None | -1621 | 2 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 313 | 5 | 2 | 3 | 3.6 | O=C(Nc1ccccc1C(F)(F)F)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16373 | 56532 | 0 | None | -1621 | 2 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 313 | 5 | 2 | 3 | 3.6 | O=C(Nc1ccccc1C(F)(F)F)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10682710 | 57493 | 1 | None | -3801 | 2 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 259 | 6 | 2 | 3 | 2.3 | O=C(NCc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16592 | 57493 | 1 | None | -3801 | 2 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 259 | 6 | 2 | 3 | 2.3 | O=C(NCc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10474353 | 58777 | 0 | None | -4168 | 2 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 371 | 5 | 2 | 3 | 3.2 | O=C(Nc1ccc(I)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16874 | 58777 | 0 | None | -4168 | 2 | Guinea pig | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 371 | 5 | 2 | 3 | 3.2 | O=C(Nc1ccc(I)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 2775690 | 93011 | 53 | None | -15 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 295 | 1 | 1 | 3 | 3.0 | Cc1ccc2nc(C(F)(F)F)cc(N3CCNCC3)c2c1 | 10.1021/ml400312j | |||
| CHEMBL2441619 | 93011 | 53 | None | -15 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 295 | 1 | 1 | 3 | 3.0 | Cc1ccc2nc(C(F)(F)F)cc(N3CCNCC3)c2c1 | 10.1021/ml400312j | |||
| 11265950 | 195913 | 0 | None | -6 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL559251 | 195913 | 0 | None | -6 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| 11265950 | 195913 | 0 | None | -6 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL559251 | 195913 | 0 | None | -6 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 11265950 | 195913 | 0 | None | -6 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1021/jm900933k | |||
| CHEMBL559251 | 195913 | 0 | None | -6 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1021/jm900933k | |||
| 11580427 | 196610 | 11 | None | 1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@@H](c1ccccn1)c1c(CCN(C)C)sc2ccccc12 | 10.1021/jm900933k | |||
| CHEMBL564144 | 196610 | 11 | None | 1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@@H](c1ccccn1)c1c(CCN(C)C)sc2ccccc12 | 10.1021/jm900933k | |||
| 11465618 | 102398 | 23 | None | -14 | 19 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | CN1CCN([C@@H]2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CC1(C)C | 10.1016/j.bmcl.2022.128879 | |||
| CHEMBL3039528 | 102398 | 23 | None | -14 | 19 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | CN1CCN([C@@H]2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CC1(C)C | 10.1016/j.bmcl.2022.128879 | |||
| CHEMBL5191141 | 102398 | 23 | None | -14 | 19 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | CN1CCN([C@@H]2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CC1(C)C | 10.1016/j.bmcl.2022.128879 | |||
| 44312705 | 103098 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 454 | 7 | 2 | 5 | 4.1 | NC(=O)N(O)Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1 | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL307609 | 103098 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 454 | 7 | 2 | 5 | 4.1 | NC(=O)N(O)Cc1ccc(CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)o1 | 10.1016/j.bmcl.2004.02.005 | |||
| 11580427 | 196610 | 11 | None | 1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@@H](c1ccccn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.07.117 | |||
| CHEMBL564144 | 196610 | 11 | None | 1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@@H](c1ccccn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.07.117 | |||
| 46884699 | 8305 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 307 | 5 | 0 | 3 | 3.9 | Cc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092663 | 8305 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 307 | 5 | 0 | 3 | 3.9 | Cc1ccc2c(c1)CC(CCN(C)C)=C2[C@@H](C)c1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| 14127191 | 11297 | 0 | None | - | 1 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | CN(C)CC/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL1179239 | 11297 | 0 | None | - | 1 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | CN(C)CC/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL65822 | 11297 | 0 | None | - | 1 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | CN(C)CC/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 15749428 | 100876 | 0 | None | - | 1 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.0 | CN(C)CC/C=C1\c2ccccc2COc2ccc(CCC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL293652 | 100876 | 0 | None | - | 1 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.0 | CN(C)CC/C=C1\c2ccccc2COc2ccc(CCC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 9805944 | 56227 | 37 | None | -6 | 9 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 7 | 2 | 3 | 4.7 | CNC(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1 | 10.1021/jm800510m | |||
| CHEMBL1627 | 56227 | 37 | None | -6 | 9 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 7 | 2 | 3 | 4.7 | CNC(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1 | 10.1021/jm800510m | |||
| 2726 | 919 | 68 | None | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| 621 | 919 | 68 | None | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| 83 | 919 | 68 | None | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL71 | 919 | 68 | None | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| DB00477 | 919 | 68 | None | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1016/j.bmcl.2008.09.012 | |||
| 44326336 | 111413 | 0 | None | 5 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 311 | 2 | 0 | 3 | 4.3 | CN(C)CC1C[C@@H]2c3ccccc3Sc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL327306 | 111413 | 0 | None | 5 | 3 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 311 | 2 | 0 | 3 | 4.3 | CN(C)CC1C[C@@H]2c3ccccc3Sc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 53320189 | 57755 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 291 | 5 | 0 | 3 | 3.1 | c1ccc2c(c1)CC(CCN1CCC1)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669412 | 57755 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 291 | 5 | 0 | 3 | 3.1 | c1ccc2c(c1)CC(CCN1CCC1)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 9949441 | 114461 | 0 | None | 2 | 5 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 331 | 2 | 0 | 4 | 3.5 | CCN1CCN(C2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| CHEMBL333455 | 114461 | 0 | None | 2 | 5 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 331 | 2 | 0 | 4 | 3.5 | CCN1CCN(C2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| 135398745 | 2914 | 112 | None | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0309811 | |||
| 47 | 2914 | 112 | None | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0309811 | |||
| CHEMBL715 | 2914 | 112 | None | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0309811 | |||
| DB00334 | 2914 | 112 | None | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0309811 | |||
| 44401243 | 168494 | 0 | None | -1 | 9 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.6 | CN(C)C[C@H]1CC2c3ccccc3Oc3ccc(Cl)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL435301 | 168494 | 0 | None | -1 | 9 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 329 | 2 | 0 | 3 | 4.6 | CN(C)C[C@H]1CC2c3ccccc3Oc3ccc(Cl)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 46830289 | 8360 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 299 | 5 | 0 | 4 | 3.8 | C[C@H](c1c(CCN(C)C)sc2ccccc12)n1cccn1 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1093058 | 8360 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 299 | 5 | 0 | 4 | 3.8 | C[C@H](c1c(CCN(C)C)sc2ccccc12)n1cccn1 | 10.1016/j.bmcl.2010.01.134 | |||
| 6726 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 7151 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 749 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL648 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| DB01176 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/j.bmcl.2013.12.024 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 10.1016/j.bmcl.2011.09.001 | |||
| 49782794 | 17916 | 0 | None | -16 | 5 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 409 | 4 | 1 | 4 | 4.0 | CC(C)C(=O)NCc1ccc2c(c1)[C@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| CHEMBL1259189 | 17916 | 0 | None | -16 | 5 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 409 | 4 | 1 | 4 | 4.0 | CC(C)C(=O)NCc1ccc2c(c1)[C@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| 45272889 | 195900 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 422 | 6 | 1 | 5 | 4.2 | Fc1ccc(Cn2c(N3CCC(NCC4CCOCC4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL559060 | 195900 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 422 | 6 | 1 | 5 | 4.2 | Fc1ccc(Cn2c(N3CCC(NCC4CCOCC4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | nan | |||
| 25056048 | 102613 | 0 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.0 | CN(C)CCC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL304185 | 102613 | 0 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 4.0 | CN(C)CCC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 46884201 | 8145 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 4.6 | C[C@@H](c1cscn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091782 | 8145 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 4.6 | C[C@@H](c1cscn1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 11023546 | 78478 | 0 | None | 2 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 317 | 1 | 0 | 4 | 3.1 | CN1CCN([C@H]2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| CHEMBL2111783 | 78478 | 0 | None | 2 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 317 | 1 | 0 | 4 | 3.1 | CN1CCN([C@H]2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| 1212 | 1662 | 50 | None | -41 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| 204 | 1662 | 50 | None | -41 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| 3372 | 1662 | 50 | None | -41 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| CHEMBL726 | 1662 | 50 | None | -41 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| DB00623 | 1662 | 50 | None | -41 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | nan | |||
| 49836299 | 18744 | 0 | None | 10 | 5 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | O=C(O)C1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | |||
| CHEMBL1277770 | 18744 | 0 | None | 10 | 5 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 375 | 2 | 1 | 2 | 4.4 | O=C(O)C1CCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 | 10.1021/jm100856p | |||
| 46889258 | 7541 | 0 | None | 316 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 302 | 6 | 0 | 5 | 2.2 | CCOCCn1c(N2CC[C@H](N(C)C)C2)nc2ccccc21 | 10.1016/j.bmcl.2010.03.027 | |||
| CHEMBL1087493 | 7541 | 0 | None | 316 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 302 | 6 | 0 | 5 | 2.2 | CCOCCn1c(N2CC[C@H](N(C)C)C2)nc2ccccc21 | 10.1016/j.bmcl.2010.03.027 | |||
| 51039226 | 57768 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 370 | 7 | 0 | 4 | 4.5 | C[C@H](C1=C(CCN(C)Cc2ccncc2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669425 | 57768 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 370 | 7 | 0 | 4 | 4.5 | C[C@H](C1=C(CCN(C)Cc2ccncc2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 44267118 | 9698 | 0 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 396 | 1 | 1 | 3 | 4.3 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(C(C)O)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL11313 | 9698 | 0 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 396 | 1 | 1 | 3 | 4.3 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(C(C)O)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 17867054 | 48941 | 0 | None | -1 | 4 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 435 | 5 | 0 | 5 | 4.3 | Cn1c(=O)sc2cc(CCN3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL15601 | 48941 | 0 | None | -1 | 4 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 435 | 5 | 0 | 5 | 4.3 | Cn1c(=O)sc2cc(CCN3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 137646281 | 157806 | 0 | None | -91 | 17 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.8 | COc1ccccc1N1CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1 | 10.1021/acs.jmedchem.9b00412 | |||
| CHEMBL4083252 | 157806 | 0 | None | -91 | 17 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.8 | COc1ccccc1N1CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1 | 10.1021/acs.jmedchem.9b00412 | |||
| 72152557 | 163072 | 5 | None | -1 | 3 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | Clc1cncc(NCCCN2CCN(c3ccccc3)CC2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4176490 | 163072 | 5 | None | -1 | 3 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | Clc1cncc(NCCCN2CCN(c3ccccc3)CC2)n1 | 10.1021/acs.jmedchem.8b00718 | |||
| 1212 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1016/j.bmcl.2008.09.012 | |||
| 204 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1016/j.bmcl.2008.09.012 | |||
| 3372 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL726 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1016/j.bmcl.2008.09.012 | |||
| DB00623 | 1662 | 50 | None | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1016/j.bmcl.2008.09.012 | |||
| 25212276 | 190066 | 0 | None | -112 | 6 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 508 | 11 | 0 | 3 | 7.4 | CN(CCCC12CCC(c3ccccc31)c1ccccc12)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL517244 | 190066 | 0 | None | -112 | 6 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 508 | 11 | 0 | 3 | 7.4 | CN(CCCC12CCC(c3ccccc31)c1ccccc12)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/j.bmcl.2009.07.047 | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/j.bmcl.2009.07.047 | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/j.bmcl.2009.07.047 | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1016/j.bmcl.2009.07.047 | |||
| 44308991 | 163497 | 0 | None | -8 | 2 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 435 | 12 | 1 | 5 | 3.8 | O=S(=O)(c1ccc(Cl)cc1)N(CCCCc1c[nH]cn1)CCCCn1ccnc1 | 10.1016/s0960-894x(98)00379-5 | |||
| CHEMBL420181 | 163497 | 0 | None | -8 | 2 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 435 | 12 | 1 | 5 | 3.8 | O=S(=O)(c1ccc(Cl)cc1)N(CCCCc1c[nH]cn1)CCCCn1ccnc1 | 10.1016/s0960-894x(98)00379-5 | |||
| 168296738 | 192269 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 714 | 18 | 6 | 8 | 1.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5205682 | 192269 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 714 | 18 | 6 | 8 | 1.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168296738 | 192269 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 714 | 18 | 6 | 8 | 1.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5205682 | 192269 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 714 | 18 | 6 | 8 | 1.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 9818650 | 203525 | 0 | None | -1621 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 323 | 5 | 1 | 3 | 4.4 | c1ccc2c(NCCCN3CCCC3)c3c(nc2c1)CCCCC3 | 10.1016/s0960-894x(03)00356-1 | |||
| CHEMBL66388 | 203525 | 0 | None | -1621 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 323 | 5 | 1 | 3 | 4.4 | c1ccc2c(NCCCN3CCCC3)c3c(nc2c1)CCCCC3 | 10.1016/s0960-894x(03)00356-1 | |||
| 162664702 | 182210 | 0 | None | -29 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 407 | 7 | 0 | 4 | 5.0 | Clc1ccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4783066 | 182210 | 0 | None | -29 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 407 | 7 | 0 | 4 | 5.0 | Clc1ccc(-c2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| 53326712 | 57748 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 307 | 7 | 0 | 3 | 3.8 | CCCN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669406 | 57748 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 307 | 7 | 0 | 3 | 3.8 | CCCN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 10480204 | 116527 | 0 | None | - | 1 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 478 | 6 | 1 | 5 | 5.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCN(c3ccc(F)cc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL336204 | 116527 | 0 | None | - | 1 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 478 | 6 | 1 | 5 | 5.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCN(c3ccc(F)cc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 2389 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C4MD00578C | |||
| 5073 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C4MD00578C | |||
| 96 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C4MD00578C | |||
| CHEMBL85 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C4MD00578C | |||
| DB00734 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1039/C4MD00578C | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2004.08.060 | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2004.08.060 | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2004.08.060 | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1016/j.bmcl.2004.08.060 | |||
| 13091358 | 70455 | 0 | None | -1023 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 389 | 6 | 1 | 3 | 4.8 | OC1(c2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2CCCOc1ccc(F)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946122 | 70455 | 0 | None | -1023 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 389 | 6 | 1 | 3 | 4.8 | OC1(c2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2CCCOc1ccc(F)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| 13091356 | 113538 | 0 | None | -1023 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 389 | 6 | 1 | 3 | 4.8 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCOc1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL3321789 | 113538 | 0 | None | -1023 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 389 | 6 | 1 | 3 | 4.8 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCOc1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| 44304376 | 202970 | 0 | None | -7 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 423 | 11 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccccn3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL63036 | 202970 | 0 | None | -7 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 423 | 11 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccccn3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 10455457 | 203403 | 0 | None | -707 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 431 | 10 | 0 | 5 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)N3CCOCC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL65518 | 203403 | 0 | None | -707 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 431 | 10 | 0 | 5 | 3.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)N3CCOCC3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 112936352 | 137494 | 1 | None | 17 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 389 | 6 | 1 | 6 | 3.5 | COc1ccc(CNc2cc(-c3ccccc3)nc(N3CCN(C)CC3)n2)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3754008 | 137494 | 1 | None | 17 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 389 | 6 | 1 | 6 | 3.5 | COc1ccc(CNc2cc(-c3ccccc3)nc(N3CCN(C)CC3)n2)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| 873049 | 69029 | 8 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 269 | 3 | 0 | 5 | 2.2 | c1ccc2c(c1)n(CCN1CCCCC1)c1ncnn21 | 10.1021/jm2011589 | |||
| CHEMBL1923531 | 69029 | 8 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 269 | 3 | 0 | 5 | 2.2 | c1ccc2c(c1)n(CCN1CCCCC1)c1ncnn21 | 10.1021/jm2011589 | |||
| 73353884 | 92322 | 0 | None | -3 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 295 | 3 | 1 | 3 | 2.7 | c1cc2c(cc1CN[C@H]1C3C4CC5C6C4CC3C6C51)OCO2 | 10.1016/j.bmc.2013.07.045 | |||
| CHEMBL2429890 | 92322 | 0 | None | -3 | 8 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 295 | 3 | 1 | 3 | 2.7 | c1cc2c(cc1CN[C@H]1C3C4CC5C6C4CC3C6C51)OCO2 | 10.1016/j.bmc.2013.07.045 | |||
| 213 | 3853 | 55 | None | -8 | 44 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| 2717 | 3853 | 55 | None | -8 | 44 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| 5533 | 3853 | 55 | None | -8 | 44 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| CHEMBL621 | 3853 | 55 | None | -8 | 44 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| DB00656 | 3853 | 55 | None | -8 | 44 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | nan | |||
| 9864676 | 127808 | 0 | None | -2 | 5 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 4.5 | O=C(CCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| CHEMBL366388 | 127808 | 0 | None | -2 | 5 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 380 | 6 | 0 | 3 | 4.5 | O=C(CCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| 44401105 | 69576 | 0 | None | -4 | 9 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 373 | 2 | 0 | 3 | 4.7 | CN(C)C[C@H]1CC2c3ccccc3Oc3ccc(Br)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL193435 | 69576 | 0 | None | -4 | 9 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 373 | 2 | 0 | 3 | 4.7 | CN(C)C[C@H]1CC2c3ccccc3Oc3ccc(Br)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 10000169 | 22222 | 0 | None | - | 1 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 385 | 5 | 1 | 5 | 3.4 | O=C(O)c1ccc2c(c1)C(SCCN1CCOCC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL132306 | 22222 | 0 | None | - | 1 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 385 | 5 | 1 | 5 | 3.4 | O=C(O)c1ccc2c(c1)C(SCCN1CCOCC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 129103161 | 167070 | 0 | None | -588 | 13 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 461 | 6 | 0 | 5 | 4.6 | O=C(CCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2c3c(c1)CCN3C(=O)CC2 | 10.1021/acs.jmedchem.8b01096 | |||
| CHEMBL4289498 | 167070 | 0 | None | -588 | 13 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 461 | 6 | 0 | 5 | 4.6 | O=C(CCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2c3c(c1)CCN3C(=O)CC2 | 10.1021/acs.jmedchem.8b01096 | |||
| 162657344 | 180932 | 0 | None | -489 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 388 | 8 | 1 | 5 | 4.4 | c1ccc(Nc2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4758080 | 180932 | 0 | None | -489 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 388 | 8 | 1 | 5 | 4.4 | c1ccc(Nc2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| 162666847 | 182457 | 0 | None | -239 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 387 | 8 | 0 | 4 | 4.3 | c1ccc(Cc2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4786308 | 182457 | 0 | None | -239 | 2 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 387 | 8 | 0 | 4 | 4.3 | c1ccc(Cc2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| 95232163 | 163089 | 1 | None | -2 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 338 | 7 | 1 | 5 | 1.5 | O[C@@H](COC[C@@H]1CCCO1)CN1CCN(c2ccccc2F)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4176800 | 163089 | 1 | None | -2 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 338 | 7 | 1 | 5 | 1.5 | O[C@@H](COC[C@@H]1CCCO1)CN1CCN(c2ccccc2F)CC1 | 10.1021/acs.jmedchem.8b00718 | |||
| 44304304 | 170063 | 0 | None | -67 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 423 | 9 | 0 | 6 | 3.5 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)/C=C/c3cccnc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL444307 | 170063 | 0 | None | -67 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 423 | 9 | 0 | 6 | 3.5 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)/C=C/c3cccnc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335558 | 110070 | 0 | None | -43 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.7 | CC1CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL323562 | 110070 | 0 | None | -43 | 4 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.7 | CC1CCN(CCCOc2ccc(-c3ccc(C#N)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 3300652 | 69022 | 35 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 263 | 1 | 2 | 5 | 2.3 | NC1=NC(c2ccccc2)n2c(nc3ccccc32)N1 | 10.1021/jm2011589 | |||
| CHEMBL1923523 | 69022 | 35 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 263 | 1 | 2 | 5 | 2.3 | NC1=NC(c2ccccc2)n2c(nc3ccccc32)N1 | 10.1021/jm2011589 | |||
| 44304032 | 201487 | 0 | None | -95 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 413 | 11 | 0 | 6 | 3.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cnco3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL60509 | 201487 | 0 | None | -95 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 413 | 11 | 0 | 6 | 3.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cnco3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 129103315 | 167122 | 0 | None | -5 | 6 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 477 | 7 | 1 | 5 | 4.9 | O=C1CCc2cc(C(O)CCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc3c2N1CC3 | 10.1021/acs.jmedchem.8b01096 | |||
| CHEMBL4290311 | 167122 | 0 | None | -5 | 6 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 477 | 7 | 1 | 5 | 4.9 | O=C1CCc2cc(C(O)CCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc3c2N1CC3 | 10.1021/acs.jmedchem.8b01096 | |||
| 127041705 | 136676 | 0 | None | -1 | 5 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 525 | 5 | 0 | 5 | 5.3 | O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CCC(CN2CCC(c3noc4cc(F)ccc34)CC2)CC1 | 10.1039/C4MD00578C | |||
| CHEMBL3740256 | 136676 | 0 | None | -1 | 5 | Guinea pig | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 525 | 5 | 0 | 5 | 5.3 | O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CCC(CN2CCC(c3noc4cc(F)ccc34)CC2)CC1 | 10.1039/C4MD00578C | |||
| 44267139 | 9371 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.3 | COc1cnc2c(c1)CCc1cc(Cl)ccc1C2=C1CCN(C(C)=O)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL11136 | 9371 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 382 | 1 | 0 | 3 | 4.3 | COc1cnc2c(c1)CCc1cc(Cl)ccc1C2=C1CCN(C(C)=O)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 44568347 | 191651 | 0 | None | -20 | 15 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.2 | CCN(CC)CCCOC(=O)N1c2ccccc2Sc2ccccc21 | 10.1016/j.bmcl.2013.04.082 | |||
| CHEMBL519609 | 191651 | 0 | None | -20 | 15 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.2 | CCN(CC)CCCOC(=O)N1c2ccccc2Sc2ccccc21 | 10.1016/j.bmcl.2013.04.082 | |||
| 162655547 | 180796 | 0 | None | 20 | 5 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 306 | 4 | 0 | 2 | 3.8 | CN(C)CCCN1C(=O)c2ccccc2/C=C\c2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| CHEMBL4756446 | 180796 | 0 | None | 20 | 5 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 306 | 4 | 0 | 2 | 3.8 | CN(C)CCCN1C(=O)c2ccccc2/C=C\c2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| 44334503 | 4995 | 0 | None | -281 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 349 | 9 | 3 | 6 | 0.2 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@@H](N)CO)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL104994 | 4995 | 0 | None | -281 | 3 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 349 | 9 | 3 | 6 | 0.2 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@@H](N)CO)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44335407 | 171844 | 0 | None | -1 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 452 | 8 | 0 | 5 | 4.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(OC(F)(F)F)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL446885 | 171844 | 0 | None | -1 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 452 | 8 | 0 | 5 | 4.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc(OC(F)(F)F)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168280835 | 190722 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 818 | 20 | 6 | 8 | 3.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5182490 | 190722 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 818 | 20 | 6 | 8 | 3.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168293792 | 192177 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5204037 | 192177 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304293 | 202962 | 0 | None | -15 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 491 | 10 | 1 | 6 | 4.0 | N[C@H](Cc1cc2ccccc2s1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL63002 | 202962 | 0 | None | -15 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 491 | 10 | 1 | 6 | 4.0 | N[C@H](Cc1cc2ccccc2s1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 168280835 | 190722 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 818 | 20 | 6 | 8 | 3.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5182490 | 190722 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 818 | 20 | 6 | 8 | 3.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168293792 | 192177 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5204037 | 192177 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44582678 | 181574 | 0 | None | -3 | 10 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 401 | 9 | 1 | 4 | 4.3 | COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(C)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| CHEMBL476839 | 181574 | 0 | None | -3 | 10 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 401 | 9 | 1 | 4 | 4.3 | COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(C)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| 71937057 | 119575 | 3 | None | -1 | 3 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 341 | 6 | 2 | 4 | 2.0 | Cc1cccc(N2CCN(CCCNC(=O)c3cn[nH]c3C)CC2)c1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL3461530 | 119575 | 3 | None | -1 | 3 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 341 | 6 | 2 | 4 | 2.0 | Cc1cccc(N2CCN(CCCNC(=O)c3cn[nH]c3C)CC2)c1 | 10.1021/acs.jmedchem.8b00718 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2008.06.030 | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2008.06.030 | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2008.06.030 | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2008.06.030 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmcl.2014.07.018 | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmcl.2014.07.018 | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmcl.2014.07.018 | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmcl.2014.07.018 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2011.12.019 | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2011.12.019 | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2011.12.019 | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1016/j.bmc.2011.12.019 | |||
| 44334781 | 5406 | 0 | None | -1513 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 458 | 11 | 1 | 6 | 3.1 | COc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL107162 | 5406 | 0 | None | -1513 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 458 | 11 | 1 | 6 | 3.1 | COc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 20659961 | 116095 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 434 | 2 | 0 | 2 | 6.2 | O=C(CC1CCCCC1)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL3357045 | 116095 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 434 | 2 | 0 | 2 | 6.2 | O=C(CC1CCCCC1)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| 71449142 | 79518 | 0 | None | -7 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 442 | 9 | 0 | 6 | 4.2 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(SC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL2113738 | 79518 | 0 | None | -7 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 442 | 9 | 0 | 6 | 4.2 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(SC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335430 | 5297 | 0 | None | -1 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 374 | 7 | 0 | 5 | 4.0 | CCOC(=O)N1CCN(CCCOc2ccc(-c3cccs3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL106602 | 5297 | 0 | None | -1 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 374 | 7 | 0 | 5 | 4.0 | CCOC(=O)N1CCN(CCCOc2ccc(-c3cccs3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 9880208 | 4924 | 0 | None | -537 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 322 | 6 | 1 | 4 | 3.1 | N#Cc1ccc(-c2ccc(OCCCN3CC[C@@H](O)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL104669 | 4924 | 0 | None | -537 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 322 | 6 | 1 | 4 | 3.1 | N#Cc1ccc(-c2ccc(OCCCN3CC[C@@H](O)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 164622153 | 185568 | 0 | None | -95 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 394 | 6 | 4 | 4 | 3.0 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(Cl)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4863347 | 185568 | 0 | None | -95 | 4 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 394 | 6 | 4 | 4 | 3.0 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccc(Cl)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 164610824 | 185110 | 0 | None | -30 | 4 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 452 | 8 | 4 | 4 | 3.6 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NCC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4856200 | 185110 | 0 | None | -30 | 4 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 452 | 8 | 4 | 4 | 3.6 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NCC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 44334025 | 4547 | 0 | None | -1202 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 462 | 10 | 1 | 5 | 3.8 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccccc3Cl)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL102384 | 4547 | 0 | None | -1202 | 3 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 462 | 10 | 1 | 5 | 3.8 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccccc3Cl)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44304223 | 200389 | 0 | None | -48 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 374 | 12 | 0 | 4 | 4.5 | CCCCCC(=O)c1ccc(OCCCN2CCN(CC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL59798 | 200389 | 0 | None | -48 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 374 | 12 | 0 | 4 | 4.5 | CCCCCC(=O)c1ccc(OCCCN2CCN(CC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 57390225 | 67882 | 0 | None | -53 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 469 | 9 | 2 | 5 | 4.1 | COc1ccc(CN(CCN[C@H]2CCN(C(=O)c3cc4ccccc4[nH]3)C2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910384 | 67882 | 0 | None | -53 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 469 | 9 | 2 | 5 | 4.1 | COc1ccc(CN(CCN[C@H]2CCN(C(=O)c3cc4ccccc4[nH]3)C2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| 44304049 | 102138 | 0 | None | -165 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 421 | 9 | 1 | 5 | 2.9 | N[C@@H](C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1)c1ccccc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL302468 | 102138 | 0 | None | -165 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 421 | 9 | 1 | 5 | 2.9 | N[C@@H](C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1)c1ccccc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 17156312 | 69030 | 14 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 215 | 4 | 1 | 2 | 3.4 | CC(C)NCc1ccc(-c2ccccc2)o1 | 10.1021/jm2011589 | |||
| CHEMBL1923532 | 69030 | 14 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 215 | 4 | 1 | 2 | 3.4 | CC(C)NCc1ccc(-c2ccccc2)o1 | 10.1021/jm2011589 | |||
| 44304003 | 203134 | 0 | None | -1584 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 384 | 9 | 1 | 6 | 1.4 | N#CC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64124 | 203134 | 0 | None | -1584 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 384 | 9 | 1 | 6 | 1.4 | N#CC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 164609493 | 184436 | 0 | None | -2630 | 6 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 350 | 6 | 4 | 5 | 1.9 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccco1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4846380 | 184436 | 0 | None | -2630 | 6 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 350 | 6 | 4 | 5 | 1.9 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1ccco1 | 10.1016/j.ejmech.2021.113190 | |||
| 162676676 | 183589 | 0 | None | -223 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 389 | 8 | 0 | 5 | 4.5 | c1ccc(Oc2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4800672 | 183589 | 0 | None | -223 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 389 | 8 | 0 | 5 | 4.5 | c1ccc(Oc2ccc(OCCCN3CCN(c4ccncc4)CC3)cc2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| 60165681 | 75356 | 0 | None | -1 | 6 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 413 | 7 | 0 | 5 | 5.1 | O=C(CCCCN1CCN(c2ccc(Cl)cc2)CC1)c1nc2ccccc2s1 | 10.1016/j.ejmech.2012.03.042 | |||
| CHEMBL2037528 | 75356 | 0 | None | -1 | 6 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 413 | 7 | 0 | 5 | 5.1 | O=C(CCCCN1CCN(c2ccc(Cl)cc2)CC1)c1nc2ccccc2s1 | 10.1016/j.ejmech.2012.03.042 | |||
| 2389 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/acs.jmedchem.8b01096 | |||
| 5073 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/acs.jmedchem.8b01096 | |||
| 96 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/acs.jmedchem.8b01096 | |||
| CHEMBL85 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/acs.jmedchem.8b01096 | |||
| DB00734 | 3331 | 118 | None | -52 | 67 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/acs.jmedchem.8b01096 | |||
| 44324737 | 207238 | 0 | None | -158 | 5 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 473 | 6 | 0 | 7 | 3.8 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(Cc4ccc5ccccc5c4)CC3)[C@@H]1CO2 | 10.1021/jm049619s | |||
| CHEMBL92860 | 207238 | 0 | None | -158 | 5 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 473 | 6 | 0 | 7 | 3.8 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(Cc4ccc5ccccc5c4)CC3)[C@@H]1CO2 | 10.1021/jm049619s | |||
| 53326725 | 57758 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 327 | 5 | 0 | 3 | 3.4 | FC1(F)CN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669415 | 57758 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 327 | 5 | 0 | 3 | 3.4 | FC1(F)CN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 118721934 | 116096 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 423 | 3 | 1 | 3 | 4.6 | CC(C)C[C@@H](N)C(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| CHEMBL3357049 | 116096 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 423 | 3 | 1 | 3 | 4.6 | CC(C)C[C@@H](N)C(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm501086v | |||
| 44304320 | 163274 | 0 | None | -1862 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.9 | CC[C@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL418666 | 163274 | 0 | None | -1862 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.9 | CC[C@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304449 | 200499 | 0 | None | -323 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 531 | 14 | 1 | 6 | 5.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL59870 | 200499 | 0 | None | -323 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 531 | 14 | 1 | 6 | 5.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304348 | 100602 | 0 | None | -11748 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 387 | 10 | 1 | 5 | 2.3 | CCC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL291821 | 100602 | 0 | None | -11748 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 387 | 10 | 1 | 5 | 2.3 | CCC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304056 | 102724 | 1 | None | -5370 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 401 | 10 | 1 | 5 | 2.6 | CC(C)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL304888 | 102724 | 1 | None | -5370 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 401 | 10 | 1 | 5 | 2.6 | CC(C)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304462 | 202882 | 0 | None | -6606 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 405 | 12 | 2 | 6 | 1.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)CO)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62660 | 202882 | 0 | None | -6606 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 405 | 12 | 2 | 6 | 1.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](N)CO)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304316 | 203133 | 0 | None | -389 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 485 | 8 | 0 | 6 | 3.6 | CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64120 | 203133 | 0 | None | -389 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 485 | 8 | 0 | 6 | 3.6 | CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 1278 | 2150 | 84 | None | -1778 | 8 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | |||
| 1279 | 2150 | 84 | None | -1778 | 8 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | |||
| 4908365 | 2150 | 84 | None | -1778 | 8 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL129198 | 2150 | 84 | None | -1778 | 8 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1016/j.bmcl.2011.09.001 | |||
| 164610289 | 185133 | 0 | None | -77 | 4 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 438 | 7 | 4 | 4 | 3.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4856602 | 185133 | 0 | None | -77 | 4 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 438 | 7 | 4 | 4 | 3.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 10411944 | 22228 | 0 | None | - | 1 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 460 | 6 | 1 | 5 | 4.9 | O=C(O)c1ccc2c(c1)C(SCCN1CCN(c3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL132311 | 22228 | 0 | None | - | 1 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 460 | 6 | 1 | 5 | 4.9 | O=C(O)c1ccc2c(c1)C(SCCN1CCN(c3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 44326124 | 106955 | 0 | None | 1 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 427 | 3 | 0 | 3 | 6.6 | c1ccc(C2CCN(CC3C[C@@H]4c5ccccc5Sc5ccccc5[C@H]4O3)CC2)cc1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL314968 | 106955 | 0 | None | 1 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 427 | 3 | 0 | 3 | 6.6 | c1ccc(C2CCN(CC3C[C@@H]4c5ccccc5Sc5ccccc5[C@H]4O3)CC2)cc1 | 10.1016/j.bmcl.2004.03.069 | |||
| 73213195 | 104459 | 0 | None | -1 | 12 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.6 | CN1CCc2c(c3cccc4c3n2Cc2ccccc2C4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL3104092 | 104459 | 0 | None | -1 | 12 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.6 | CN1CCc2c(c3cccc4c3n2Cc2ccccc2C4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| 44326219 | 207158 | 0 | None | -8 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 444 | 3 | 0 | 3 | 5.7 | Clc1cccc(N2CCN(CC3C[C@@H]4c5ccccc5Cc5ccccc5[C@H]4O3)CC2)c1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL92333 | 207158 | 0 | None | -8 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 444 | 3 | 0 | 3 | 5.7 | Clc1cccc(N2CCN(CC3C[C@@H]4c5ccccc5Cc5ccccc5[C@H]4O3)CC2)c1 | 10.1016/j.bmcl.2004.03.069 | |||
| 73355415 | 92533 | 0 | None | -23 | 13 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 277 | 3 | 1 | 1 | 2.1 | C1C2C3CC4C2C2C1C3[C@H](NCC13C5C6C7C5C1C7C63)C42 | 10.1016/j.bmc.2013.07.045 | |||
| CHEMBL2432039 | 92533 | 0 | None | -23 | 13 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 277 | 3 | 1 | 1 | 2.1 | C1C2C3CC4C2C2C1C3[C@H](NCC13C5C6C7C5C1C7C63)C42 | 10.1016/j.bmc.2013.07.045 | |||
| 44304269 | 100544 | 0 | None | -75 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 423 | 11 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccncc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL291394 | 100544 | 0 | None | -75 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 423 | 11 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccncc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 53325600 | 57763 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 376 | 7 | 0 | 5 | 4.6 | C[C@H](C1=C(CCN(C)Cc2nccs2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669420 | 57763 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 376 | 7 | 0 | 5 | 4.6 | C[C@H](C1=C(CCN(C)Cc2nccs2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 14554129 | 10535 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 366 | 1 | 0 | 2 | 4.7 | CCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL116935 | 10535 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 366 | 1 | 0 | 2 | 4.7 | CCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 46929648 | 16759 | 0 | None | 3 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 355 | 5 | 2 | 3 | 4.3 | FC(F)(F)c1ccc(SC[C@@H](c2c[nH]cn2)C2CCNCC2)cc1 | 10.1021/jm100643t | |||
| CHEMBL1243395 | 16759 | 0 | None | 3 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 355 | 5 | 2 | 3 | 4.3 | FC(F)(F)c1ccc(SC[C@@H](c2c[nH]cn2)C2CCNCC2)cc1 | 10.1021/jm100643t | |||
| 73213195 | 104459 | 0 | None | -1 | 12 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.6 | CN1CCc2c(c3cccc4c3n2Cc2ccccc2C4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL3104092 | 104459 | 0 | None | -1 | 12 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.6 | CN1CCc2c(c3cccc4c3n2Cc2ccccc2C4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| 44521012 | 199979 | 0 | None | 1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 237 | 3 | 1 | 1 | 3.3 | CNCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL595158 | 199979 | 0 | None | 1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 237 | 3 | 1 | 1 | 3.3 | CNCCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 133 | 2496 | 52 | None | -102 | 42 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| 1723 | 2496 | 52 | None | -102 | 42 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| 28693 | 2496 | 52 | None | -102 | 42 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| CHEMBL19215 | 2496 | 52 | None | -102 | 42 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| DB13520 | 2496 | 52 | None | -102 | 42 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | nan | |||
| 132060743 | 162236 | 0 | None | -1 | 13 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 351 | 3 | 0 | 4 | 3.1 | CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)C3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4163428 | 162236 | 0 | None | -1 | 13 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 351 | 3 | 0 | 4 | 3.1 | CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)C3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| 164620704 | 186083 | 0 | None | -33 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 416 | 8 | 4 | 4 | 3.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)c1ccc(C(C)C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4871482 | 186083 | 0 | None | -33 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 416 | 8 | 4 | 4 | 3.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)c1ccc(C(C)C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 44343626 | 114149 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 341 | 1 | 0 | 3 | 2.7 | CN1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1=O | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL332936 | 114149 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 341 | 1 | 0 | 3 | 2.7 | CN1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1=O | 10.1016/s0960-894x(98)00626-x | |||
| 53321512 | 57757 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 309 | 5 | 0 | 3 | 3.1 | FC1CN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669414 | 57757 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 309 | 5 | 0 | 3 | 3.1 | FC1CN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 71459761 | 84080 | 0 | None | -81 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 540 | 7 | 0 | 5 | 6.1 | COc1ccccc1N1CCN(Cc2cc(CN3CCN(c4ccc(Cl)cc4)CC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| CHEMBL2207642 | 84080 | 0 | None | -81 | 7 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 540 | 7 | 0 | 5 | 6.1 | COc1ccccc1N1CCN(Cc2cc(CN3CCN(c4ccc(Cl)cc4)CC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| 10326069 | 39296 | 1 | None | -27 | 9 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 589 | 10 | 3 | 8 | 3.3 | CNC(=O)C1=C(C)NC(C)=C(C(=O)NCCCN2CCC(C(=O)OC)(c3ccccc3)CC2)C1c1ccc([N+](=O)[O-])cc1 | 10.1021/jm980506g | |||
| CHEMBL147077 | 39296 | 1 | None | -27 | 9 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 589 | 10 | 3 | 8 | 3.3 | CNC(=O)C1=C(C)NC(C)=C(C(=O)NCCCN2CCC(C(=O)OC)(c3ccccc3)CC2)C1c1ccc([N+](=O)[O-])cc1 | 10.1021/jm980506g | |||
| 25055258 | 12056 | 0 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 349 | 4 | 1 | 3 | 4.2 | O=C(O)c1ccc2c(c1)/C(=C\CCN1CCCC1)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| CHEMBL1183550 | 12056 | 0 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 349 | 4 | 1 | 3 | 4.2 | O=C(O)c1ccc2c(c1)/C(=C\CCN1CCCC1)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| CHEMBL304223 | 12056 | 0 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 349 | 4 | 1 | 3 | 4.2 | O=C(O)c1ccc2c(c1)/C(=C\CCN1CCCC1)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| 135398737 | 958 | 93 | None | -4 | 89 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9601720 | |||
| 38 | 958 | 93 | None | -4 | 89 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9601720 | |||
| 722 | 958 | 93 | None | -4 | 89 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9601720 | |||
| CHEMBL42 | 958 | 93 | None | -4 | 89 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9601720 | |||
| DB00363 | 958 | 93 | None | -4 | 89 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm9601720 | |||
| 49782998 | 17917 | 0 | None | -31 | 5 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 409 | 4 | 1 | 4 | 4.0 | CC(C)C(=O)NCc1ccc2c(c1)[C@@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| CHEMBL1259190 | 17917 | 0 | None | -31 | 5 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 409 | 4 | 1 | 4 | 4.0 | CC(C)C(=O)NCc1ccc2c(c1)[C@@H](N1CCN(C)CC1)Cc1ccccc1S2 | 10.1021/jm100652h | |||
| 46884120 | 8056 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1cccnc1[C@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091069 | 8056 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1cccnc1[C@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 44389293 | 128805 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 577 | 11 | 1 | 6 | 5.7 | COC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL366925 | 128805 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 577 | 11 | 1 | 6 | 5.7 | COC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL5272464 | 194625 | 0 | None | 11 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 480 | 10 | 1 | 5 | 4.4 | CCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| CHEMBL5315453 | 194625 | 0 | None | 11 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 480 | 10 | 1 | 5 | 4.4 | CCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O | 10.1021/acsmedchemlett.7b00112 | |||
| 69260946 | 81294 | 1 | None | 19 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.5 | O=C(O)c1cccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158823 | 81294 | 1 | None | 19 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.5 | O=C(O)c1cccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| 69274365 | 81297 | 1 | None | 7 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)Cc1cccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158826 | 81297 | 1 | None | 7 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)Cc1cccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71449585 | 81300 | 0 | None | 7 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 5.2 | O=C(O)COc1cccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158829 | 81300 | 0 | None | 7 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 492 | 8 | 1 | 5 | 5.2 | O=C(O)COc1cccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| 59295969 | 84017 | 0 | None | -1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 608 | 10 | 4 | 7 | 2.9 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(S(=O)(=O)NC3CC3)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207285 | 84017 | 0 | None | -1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 608 | 10 | 4 | 7 | 2.9 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(S(=O)(=O)NC3CC3)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| 71454296 | 84095 | 0 | None | -1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 521 | 7 | 2 | 6 | 3.3 | Cn1cc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c(C(F)(F)F)cc1=O | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207665 | 84095 | 0 | None | -1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 521 | 7 | 2 | 6 | 3.3 | Cn1cc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c(C(F)(F)F)cc1=O | 10.1016/j.bmcl.2012.09.112 | |||
| 155521446 | 170583 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 402 | 2 | 0 | 4 | 4.7 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccncn2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4450560 | 170583 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 402 | 2 | 0 | 4 | 4.7 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccncn2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 10069660 | 206908 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 401 | 2 | 0 | 3 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2cccnc2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL90893 | 206908 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 401 | 2 | 0 | 3 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2cccnc2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 28125512 | 203423 | 25 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 5284599 | 203423 | 25 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL65699 | 203423 | 25 | None | - | 1 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1\c2ccccc2COc2ccc(CC(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 46884202 | 8202 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 4.6 | C[C@@H](c1cncs1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092118 | 8202 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 316 | 5 | 0 | 4 | 4.6 | C[C@@H](c1cncs1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm030480f | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm030480f | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm030480f | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm030480f | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm030480f | |||
| 49836528 | 18658 | 0 | None | 5 | 5 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 373 | 2 | 1 | 2 | 4.0 | O=C(O)[C@]12C[C@H]1CN(C1CC[C@]3(Cc4ccccc4Cc4ccccc43)C1)C2 | 10.1021/jm100856p | |||
| CHEMBL1276947 | 18658 | 0 | None | 5 | 5 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 373 | 2 | 1 | 2 | 4.0 | O=C(O)[C@]12C[C@H]1CN(C1CC[C@]3(Cc4ccccc4Cc4ccccc43)C1)C2 | 10.1021/jm100856p | |||
| 57393730 | 67884 | 0 | None | -1 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 579 | 8 | 2 | 6 | 5.0 | O=C(c1cc2ccccc2[nH]1)N1CCN(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)CC1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910386 | 67884 | 0 | None | -1 | 3 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 579 | 8 | 2 | 6 | 5.0 | O=C(c1cc2ccccc2[nH]1)N1CCN(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)CC1 | 10.1016/j.bmcl.2011.09.001 | |||
| 1210 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 1213 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 2725 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 33036 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 4411 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 616 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 6976 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 716121 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL1201353 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL1554789 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL505 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| DB01114 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| DB13679 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1016/s0960-894x(98)00626-x | |||
| 1210 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 1213 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 2725 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 33036 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 4411 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 616 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 6976 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 716121 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| CHEMBL1201353 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| CHEMBL1554789 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| CHEMBL505 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| DB01114 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| DB13679 | 918 | 51 | None | -9 | 21 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm00105a069 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0002432 | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0002432 | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0002432 | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm0002432 | |||
| 49836633 | 18659 | 0 | None | 1 | 5 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 347 | 2 | 1 | 2 | 3.6 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | |||
| CHEMBL1276948 | 18659 | 0 | None | 1 | 5 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 347 | 2 | 1 | 2 | 3.6 | O=C(O)C1CN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | |||
| 15749431 | 100995 | 0 | None | - | 1 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 4.1 | CN(C)CCC/C=C1/c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL294345 | 100995 | 0 | None | - | 1 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 4.1 | CN(C)CCC/C=C1/c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 1971 | 2866 | 38 | None | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| 2404 | 2866 | 38 | None | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| 4543 | 2866 | 38 | None | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| CHEMBL445 | 2866 | 38 | None | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| DB00540 | 2866 | 38 | None | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | nan | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.12.023 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 11376787 | 63380 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 591 | 12 | 1 | 6 | 6.1 | CCOC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL179590 | 63380 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 591 | 12 | 1 | 6 | 6.1 | CCOC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 1214 | 2068 | 54 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm049495j | |||
| 1549000 | 2068 | 54 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm049495j | |||
| 1566 | 2068 | 54 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm049495j | |||
| 28145931 | 2068 | 54 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm049495j | |||
| CHEMBL1201191 | 2068 | 54 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm049495j | |||
| DB06282 | 2068 | 54 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 10.1021/jm049495j | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1016/j.bmcl.2020.127681 | |||
| 12992629 | 122599 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 584 | 8 | 2 | 5 | 6.1 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL360202 | 122599 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 584 | 8 | 2 | 5 | 6.1 | NC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 21509921 | 104458 | 0 | None | -4 | 24 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL3104091 | 104458 | 0 | None | -4 | 24 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| 9870460 | 102859 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 496 | 7 | 2 | 5 | 3.8 | NC(=O)N(O)CCC#C[C@@H]1CC[C@@H](CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)O1 | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL305662 | 102859 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 496 | 7 | 2 | 5 | 3.8 | NC(=O)N(O)CCC#C[C@@H]1CC[C@@H](CN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)O1 | 10.1016/j.bmcl.2004.02.005 | |||
| 71462100 | 81280 | 0 | None | -39 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 502 | 8 | 1 | 4 | 5.4 | Cc1cc(OC2CCN(CC3CCN([C@@](C)(Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158792 | 81280 | 0 | None | -39 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 502 | 8 | 1 | 4 | 5.4 | Cc1cc(OC2CCN(CC3CCN([C@@](C)(Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 10005242 | 81290 | 0 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)C(c1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158819 | 81290 | 0 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)C(c1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 69347980 | 81304 | 1 | None | 5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)c1cccc(CN2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158832 | 81304 | 1 | None | 5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)c1cccc(CN2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072040 | 81307 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 490 | 8 | 1 | 4 | 5.2 | O=C(O)[C@H](Cc1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158835 | 81307 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 490 | 8 | 1 | 4 | 5.2 | O=C(O)[C@H](Cc1ccccc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072044 | 81309 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 524 | 8 | 1 | 4 | 5.9 | O=C(O)[C@H](Cc1ccccc1Cl)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158837 | 81309 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 524 | 8 | 1 | 4 | 5.9 | O=C(O)[C@H](Cc1ccccc1Cl)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072050 | 81311 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1ccccc1F)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158839 | 81311 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1ccccc1F)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71072118 | 81313 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1ccc(F)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158841 | 81313 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 508 | 8 | 1 | 4 | 5.4 | O=C(O)[C@H](Cc1ccc(F)cc1)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 59295946 | 84013 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 612 | 11 | 5 | 8 | 1.7 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(S(=O)(=O)NCCO)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207281 | 84013 | 0 | None | -5 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 612 | 11 | 5 | 8 | 1.7 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(S(=O)(=O)NCCO)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| 59295974 | 84102 | 0 | None | -19 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 581 | 8 | 3 | 7 | 3.2 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4cc(S(C)(=O)=O)ccc34)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207672 | 84102 | 0 | None | -19 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 581 | 8 | 3 | 7 | 3.2 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4cc(S(C)(=O)=O)ccc34)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| 21509921 | 104458 | 0 | None | -4 | 24 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| CHEMBL3104091 | 104458 | 0 | None | -4 | 24 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 288 | 0 | 0 | 2 | 3.7 | CN1CCc2c(c3cccc4c3n2-c2ccccc2CC4)C1 | 10.1016/j.bmcl.2013.12.024 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2726 | 919 | 68 | None | -6 | 72 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm070516u | |||
| 621 | 919 | 68 | None | -6 | 72 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm070516u | |||
| 83 | 919 | 68 | None | -6 | 72 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm070516u | |||
| CHEMBL71 | 919 | 68 | None | -6 | 72 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm070516u | |||
| DB00477 | 919 | 68 | None | -6 | 72 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1021/jm070516u | |||
| 17963208 | 82253 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 529 | 5 | 1 | 5 | 4.5 | O=C(NS(=O)(=O)c1ccc(F)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171034 | 82253 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 529 | 5 | 1 | 5 | 4.5 | O=C(NS(=O)(=O)c1ccc(F)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963334 | 82257 | 0 | None | -2 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccccc1S(=O)(=O)NC(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171038 | 82257 | 0 | None | -2 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 525 | 5 | 1 | 5 | 4.7 | Cc1ccccc1S(=O)(=O)NC(=O)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 71457010 | 82258 | 0 | None | -10 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 545 | 5 | 1 | 5 | 5.1 | O=C(NS(=O)(=O)c1ccccc1Cl)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171039 | 82258 | 0 | None | -10 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 545 | 5 | 1 | 5 | 5.1 | O=C(NS(=O)(=O)c1ccccc1Cl)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 10143016 | 82273 | 0 | None | 3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 525 | 6 | 1 | 5 | 4.5 | O=C(NS(=O)(=O)Cc1ccccc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171215 | 82273 | 0 | None | 3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 525 | 6 | 1 | 5 | 4.5 | O=C(NS(=O)(=O)Cc1ccccc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 10947658 | 28702 | 0 | None | -457 | 16 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
| CHEMBL137781 | 28702 | 0 | None | -457 | 16 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 335 | 1 | 1 | 2 | 3.0 | C[C@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 | 10.1021/jm020153s | |||
| 9826801 | 107937 | 0 | None | -2187 | 11 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 488 | 6 | 1 | 7 | 3.2 | Cn1nnc(-c2ccc3c(c2)c(C2CCN(CCN4CCNC4=O)CC2)cn3-c2ccc(F)cc2)n1 | 10.1021/jm100652h | |||
| CHEMBL319352 | 107937 | 0 | None | -2187 | 11 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 488 | 6 | 1 | 7 | 3.2 | Cn1nnc(-c2ccc3c(c2)c(C2CCN(CCN4CCNC4=O)CC2)cn3-c2ccc(F)cc2)n1 | 10.1021/jm100652h | |||
| 10414153 | 21539 | 0 | None | - | 1 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 515 | 6 | 2 | 7 | 5.5 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(n3c(O)nc4ccccc43)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL131648 | 21539 | 0 | None | - | 1 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 515 | 6 | 2 | 7 | 5.5 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(n3c(O)nc4ccccc43)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 14885641 | 115088 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 317 | 0 | 0 | 1 | 4.2 | CC(=O)N1CCC(=C2c3ccccc3CCc3ccccc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL334318 | 115088 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 317 | 0 | 0 | 1 | 4.2 | CC(=O)N1CCC(=C2c3ccccc3CCc3ccccc32)CC1 | 10.1021/jm00105a069 | |||
| 46882182 | 5921 | 0 | None | -95 | 5 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 567 | 11 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)N(C)C)ccc4o3)CC2)cc(OCC)c1-n1cccc1 | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL1079686 | 5921 | 0 | None | -95 | 5 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 567 | 11 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)N(C)C)ccc4o3)CC2)cc(OCC)c1-n1cccc1 | 10.1016/j.bmcl.2009.09.024 | |||
| 168288633 | 191778 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 712 | 18 | 5 | 7 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5198008 | 191778 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 712 | 18 | 5 | 7 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304091 | 202951 | 0 | None | -63 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 432 | 14 | 0 | 5 | 5.2 | CCCCCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62949 | 202951 | 0 | None | -63 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 432 | 14 | 0 | 5 | 5.2 | CCCCCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335463 | 4455 | 0 | None | -8 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 357 | 7 | 1 | 4 | 3.2 | CCOC(=O)N1CCN(CCCOc2ccc(-c3cc[nH]c3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL101692 | 4455 | 0 | None | -8 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 357 | 7 | 1 | 4 | 3.2 | CCOC(=O)N1CCN(CCCOc2ccc(-c3cc[nH]c3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 66615606 | 81273 | 0 | None | -398 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 513 | 8 | 1 | 5 | 4.9 | Cc1c(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc(C#N)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158785 | 81273 | 0 | None | -398 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 513 | 8 | 1 | 5 | 4.9 | Cc1c(OC2CCN(CC3CCN([C@@H](Cc4ccc(F)cc4)C(=O)O)CC3)CC2)ccc(C#N)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 50878551 | 90745 | 61 | None | -21 | 18 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| CHEMBL2391541 | 90745 | 61 | None | -21 | 18 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| 71459825 | 84200 | 0 | None | -3 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 433 | 8 | 2 | 5 | 3.9 | N#Cc1ccc(OC[C@@H](O)CNC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)cc1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208417 | 84200 | 0 | None | -3 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 433 | 8 | 2 | 5 | 3.9 | N#Cc1ccc(OC[C@@H](O)CNC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)cc1 | 10.1016/j.bmcl.2012.09.113 | |||
| 71452602 | 84219 | 0 | None | -1 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 433 | 8 | 2 | 5 | 3.9 | N#Cc1cccc(OC[C@@H](O)CNC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208436 | 84219 | 0 | None | -1 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 433 | 8 | 2 | 5 | 3.9 | N#Cc1cccc(OC[C@@H](O)CNC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 59296098 | 84098 | 0 | None | -15 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 446 | 7 | 3 | 6 | 2.0 | N#Cc1ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccccc34)CC2)cc1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207668 | 84098 | 0 | None | -15 | 2 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 446 | 7 | 3 | 6 | 2.0 | N#Cc1ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccccc34)CC2)cc1 | 10.1016/j.bmcl.2012.09.112 | |||
| 168288633 | 191778 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 712 | 18 | 5 | 7 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5198008 | 191778 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 712 | 18 | 5 | 7 | 2.5 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 18672441 | 95395 | 0 | None | -691 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 306 | 6 | 0 | 3 | 4.1 | N#Cc1ccc(-c2ccc(OCCCN3CCCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL25688 | 95395 | 0 | None | -691 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 306 | 6 | 0 | 3 | 4.1 | N#Cc1ccc(-c2ccc(OCCCN3CCCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168290815 | 192973 | 0 | None | -10232 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 327 | 9 | 4 | 5 | 1.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5200771 | 192973 | 0 | None | -10232 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 327 | 9 | 4 | 5 | 1.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222529 | 192973 | 0 | None | -10232 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 327 | 9 | 4 | 5 | 1.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 10802229 | 56556 | 0 | None | -794 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 273 | 6 | 2 | 3 | 2.8 | C[C@@H](NC(=O)OCCCc1c[nH]cn1)c1ccccc1 | 10.1021/jm9507688 | |||
| CHEMBL16401 | 56556 | 0 | None | -794 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 273 | 6 | 2 | 3 | 2.8 | C[C@@H](NC(=O)OCCCc1c[nH]cn1)c1ccccc1 | 10.1021/jm9507688 | |||
| 10729448 | 56564 | 0 | None | -1584 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 251 | 6 | 2 | 3 | 2.3 | O=C(NCC1CCCC1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16407 | 56564 | 0 | None | -1584 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 251 | 6 | 2 | 3 | 2.3 | O=C(NCC1CCCC1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10588560 | 96574 | 0 | None | -2089 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 277 | 6 | 2 | 3 | 2.4 | O=C(NCc1ccc(F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL263070 | 96574 | 0 | None | -2089 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 277 | 6 | 2 | 3 | 2.4 | O=C(NCc1ccc(F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10852027 | 98688 | 0 | None | -3890 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 304 | 7 | 2 | 5 | 2.2 | O=C(NCc1cccc([N+](=O)[O-])c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL277537 | 98688 | 0 | None | -3890 | 2 | Guinea pig | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 304 | 7 | 2 | 5 | 2.2 | O=C(NCc1cccc([N+](=O)[O-])c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 57345618 | 70459 | 0 | None | -7 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 362 | 6 | 0 | 3 | 4.5 | Fc1ccc(OCCCN2CCCN(c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946126 | 70459 | 0 | None | -7 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 362 | 6 | 0 | 3 | 4.5 | Fc1ccc(OCCCN2CCCN(c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| 44582675 | 189701 | 0 | None | -8 | 15 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 405 | 9 | 1 | 4 | 4.2 | COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| CHEMBL515472 | 189701 | 0 | None | -8 | 15 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 405 | 9 | 1 | 4 | 4.2 | COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| 14554127 | 113325 | 0 | None | 3 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 380 | 2 | 0 | 2 | 5.1 | CCCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL331603 | 113325 | 0 | None | 3 | 2 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 380 | 2 | 0 | 2 | 5.1 | CCCC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm0002432 | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm0002432 | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm0002432 | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm0002432 | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 10.1021/jm0002432 | |||
| 73346042 | 91834 | 5 | None | -5128 | 17 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 405 | 9 | 0 | 8 | 0.9 | Cn1c(=O)cnn(CCCCN2CCN(c3ccccc3OCCF)CC2)c1=O | 10.1016/j.bmc.2013.05.050 | |||
| CHEMBL2413153 | 91834 | 5 | None | -5128 | 17 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 405 | 9 | 0 | 8 | 0.9 | Cn1c(=O)cnn(CCCCN2CCN(c3ccccc3OCCF)CC2)c1=O | 10.1016/j.bmc.2013.05.050 | |||
| 168269172 | 190002 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 684 | 17 | 5 | 7 | 1.8 | C[C@H](NC(=O)CNC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5171289 | 190002 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 684 | 17 | 5 | 7 | 1.8 | C[C@H](NC(=O)CNC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168286426 | 192926 | 0 | None | -58 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 403 | 10 | 4 | 5 | 2.3 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5198795 | 192926 | 0 | None | -58 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 403 | 10 | 4 | 5 | 2.3 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222241 | 192926 | 0 | None | -58 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 403 | 10 | 4 | 5 | 2.3 | CC(CCCc1ccccc1)CNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 164618508 | 185932 | 0 | None | -165 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 374 | 6 | 4 | 4 | 2.7 | Cc1ccc(C(C)NC(=O)/N=C(\N)NCCCc2sc(N)nc2C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4869194 | 185932 | 0 | None | -165 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 374 | 6 | 4 | 4 | 2.7 | Cc1ccc(C(C)NC(=O)/N=C(\N)NCCCc2sc(N)nc2C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 168269172 | 190002 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 684 | 17 | 5 | 7 | 1.8 | C[C@H](NC(=O)CNC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5171289 | 190002 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 684 | 17 | 5 | 7 | 1.8 | C[C@H](NC(=O)CNC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 83632 | 5180 | 7 | None | 1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 225 | 4 | 0 | 1 | 3.4 | CN(C)CC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL10602 | 5180 | 7 | None | 1 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 225 | 4 | 0 | 1 | 3.4 | CN(C)CC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| 60165413 | 75360 | 0 | None | -15 | 7 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 5.5 | O=C(CCCCN1CCC(c2ccccc2)CC1)c1nc2ccccc2s1 | 10.1016/j.ejmech.2012.03.042 | |||
| CHEMBL2037531 | 75360 | 0 | None | -15 | 7 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 5.5 | O=C(CCCCN1CCC(c2ccccc2)CC1)c1nc2ccccc2s1 | 10.1016/j.ejmech.2012.03.042 | |||
| 11848677 | 148352 | 0 | None | -1 | 5 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 460 | 8 | 2 | 8 | 3.0 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL393718 | 148352 | 0 | None | -1 | 5 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 460 | 8 | 2 | 8 | 3.0 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| 10341609 | 200270 | 0 | None | -117 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 412 | 11 | 1 | 5 | 3.4 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3c[nH]cn3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL59715 | 200270 | 0 | None | -117 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 412 | 11 | 1 | 5 | 3.4 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3c[nH]cn3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 168274129 | 192809 | 0 | None | -16 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 370 | 12 | 5 | 6 | 1.0 | NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5176780 | 192809 | 0 | None | -16 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 370 | 12 | 5 | 6 | 1.0 | NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221468 | 192809 | 0 | None | -16 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 370 | 12 | 5 | 6 | 1.0 | NCCCCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168294770 | 193020 | 0 | None | -2 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5208327 | 193020 | 0 | None | -2 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222806 | 193020 | 0 | None | -2 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 436 | 6 | 4 | 4 | 4.3 | Cc1ccc(CC(C)CNC(=O)/N=C(\N)Nc2cccc(-c3sc(N)nc3C)c2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168295803 | 193045 | 0 | None | -3 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.6 | CCCCCNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5207206 | 193045 | 0 | None | -3 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.6 | CCCCCNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222937 | 193045 | 0 | None | -3 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 338 | 6 | 4 | 4 | 1.6 | CCCCCNC(=O)/N=C(\N)NCC1CCc2nc(N)sc2C1 | 10.1021/acs.jmedchem.1c00692 | |||
| 112936262 | 137276 | 1 | None | -3 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 389 | 6 | 1 | 6 | 3.5 | COc1ccc(CNc2nc(-c3ccccc3)cc(N3CCN(C)CC3)n2)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752195 | 137276 | 1 | None | -3 | 2 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 389 | 6 | 1 | 6 | 3.5 | COc1ccc(CNc2nc(-c3ccccc3)cc(N3CCN(C)CC3)n2)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| 164620139 | 185788 | 0 | None | -60 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 436 | 8 | 4 | 4 | 3.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4866734 | 185788 | 0 | None | -60 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 436 | 8 | 4 | 4 | 3.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(c1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 164608941 | 184383 | 0 | None | -123 | 4 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 390 | 7 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NC[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4845733 | 184383 | 0 | None | -123 | 4 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 390 | 7 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NC[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 3168 | 9262 | 92 | None | -87 | 21 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 3.7 | O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1 | nan | |||
| CHEMBL1108 | 9262 | 92 | None | -87 | 21 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 379 | 6 | 1 | 4 | 3.7 | O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1 | nan | |||
| 17590280 | 69023 | 6 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 264 | 4 | 1 | 2 | 3.5 | Cc1cccc2c(CCN)cn(Cc3ccccc3)c12 | 10.1021/jm2011589 | |||
| CHEMBL1923524 | 69023 | 6 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 264 | 4 | 1 | 2 | 3.5 | Cc1cccc2c(CCN)cn(Cc3ccccc3)c12 | 10.1021/jm2011589 | |||
| 168295528 | 193031 | 0 | None | -2951 | 20 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 333 | 6 | 4 | 5 | 0.9 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5206565 | 193031 | 0 | None | -2951 | 20 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 333 | 6 | 4 | 5 | 0.9 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222872 | 193031 | 0 | None | -2951 | 20 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 333 | 6 | 4 | 5 | 0.9 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 4440801 | 168284 | 9 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 298 | 3 | 1 | 6 | 1.5 | OCCN1CCN(c2ncnc3c2oc2ccccc23)CC1 | 10.1021/jm2011589 | |||
| CHEMBL434001 | 168284 | 9 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 298 | 3 | 1 | 6 | 1.5 | OCCN1CCN(c2ncnc3c2oc2ccccc23)CC1 | 10.1021/jm2011589 | |||
| 12016525 | 202915 | 0 | None | -2630 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 359 | 8 | 1 | 5 | 1.5 | C[C@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62804 | 202915 | 0 | None | -2630 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 359 | 8 | 1 | 5 | 1.5 | C[C@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 164611143 | 184716 | 0 | None | -234 | 4 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.9 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(c1ccccc1)C(F)(F)F | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4850448 | 184716 | 0 | None | -234 | 4 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 414 | 6 | 4 | 4 | 2.9 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(c1ccccc1)C(F)(F)F | 10.1016/j.ejmech.2021.113190 | |||
| 9830741 | 207856 | 1 | None | -275 | 6 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 475 | 6 | 1 | 4 | 5.0 | C[C@@H]1OC(=O)N(C(=O)NCCCN2CCC(c3ccc(F)cc3)CC2)[C@H]1c1ccc(F)c(F)c1 | 10.1021/jm000085e | |||
| CHEMBL96467 | 207856 | 1 | None | -275 | 6 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 475 | 6 | 1 | 4 | 5.0 | C[C@@H]1OC(=O)N(C(=O)NCCCN2CCC(c3ccc(F)cc3)CC2)[C@H]1c1ccc(F)c(F)c1 | 10.1021/jm000085e | |||
| 122196373 | 124287 | 0 | None | -2 | 5 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 471 | 7 | 0 | 6 | 6.4 | Fc1ccc2c(C3CCN(CCCOc4ccc(-c5nc6ccccc6o5)cc4)CC3)noc2c1 | 10.1016/j.bmcl.2015.09.045 | |||
| CHEMBL3634813 | 124287 | 0 | None | -2 | 5 | Guinea pig | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 471 | 7 | 0 | 6 | 6.4 | Fc1ccc2c(C3CCN(CCCOc4ccc(-c5nc6ccccc6o5)cc4)CC3)noc2c1 | 10.1016/j.bmcl.2015.09.045 | |||
| 46929554 | 16754 | 0 | None | -31 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 349 | 5 | 1 | 3 | 4.7 | FC(F)(F)c1ccc(SCC(c2ccncc2)c2c[nH]cn2)cc1 | 10.1021/jm100643t | |||
| CHEMBL1243367 | 16754 | 0 | None | -31 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 349 | 5 | 1 | 3 | 4.7 | FC(F)(F)c1ccc(SCC(c2ccncc2)c2c[nH]cn2)cc1 | 10.1021/jm100643t | |||
| 1854 | 3552 | 7 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 355 | 1 | 0 | 3 | 3.1 | Clc1ccc2c(c1)CCc1c(C2N2CCN(CC2)C(=O)C)nccc1 | 10.1016/s0960-894x(98)00626-x | |||
| 9950564 | 3552 | 7 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 355 | 1 | 0 | 3 | 3.1 | Clc1ccc2c(c1)CCc1c(C2N2CCN(CC2)C(=O)C)nccc1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL326821 | 3552 | 7 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 355 | 1 | 0 | 3 | 3.1 | Clc1ccc2c(c1)CCc1c(C2N2CCN(CC2)C(=O)C)nccc1 | 10.1016/s0960-894x(98)00626-x | |||
| 141485889 | 171198 | 0 | None | - | 1 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 290 | 7 | 0 | 3 | 2.4 | CCN(CC)CCCOc1ccc2c(c1)C(=O)N(C)CC2 | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4459304 | 171198 | 0 | None | - | 1 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 290 | 7 | 0 | 3 | 2.4 | CCN(CC)CCCOc1ccc2c(c1)C(=O)N(C)CC2 | 10.1016/j.bmcl.2019.04.015 | |||
| 9906447 | 195577 | 2 | None | -7585 | 13 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 351 | 5 | 0 | 3 | 4.8 | C[C@@H]1CCCN1CCc1cc2cc(C(=O)c3ccc(F)cc3)ccc2o1 | 10.1021/jm201690h | |||
| CHEMBL2031738 | 195577 | 2 | None | -7585 | 13 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 351 | 5 | 0 | 3 | 4.8 | C[C@@H]1CCCN1CCc1cc2cc(C(=O)c3ccc(F)cc3)ccc2o1 | 10.1021/jm201690h | |||
| CHEMBL555146 | 195577 | 2 | None | -7585 | 13 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 351 | 5 | 0 | 3 | 4.8 | C[C@@H]1CCCN1CCc1cc2cc(C(=O)c3ccc(F)cc3)ccc2o1 | 10.1021/jm201690h | |||
| 25147772 | 173409 | 9 | None | -6 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 373 | 4 | 1 | 6 | 3.7 | CN1CCN(c2nc(NCc3cccs3)c3cc(Cl)ccc3n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL452847 | 173409 | 9 | None | -6 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 373 | 4 | 1 | 6 | 3.7 | CN1CCN(c2nc(NCc3cccs3)c3cc(Cl)ccc3n2)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 168274690 | 190538 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5179725 | 190538 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 71681209 | 90272 | 0 | None | -138 | 5 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 464 | 7 | 0 | 6 | 5.7 | Cc1c(C)c2ccc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc2oc1=O | 10.1021/jm400408r | |||
| CHEMBL2385102 | 90272 | 0 | None | -138 | 5 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 464 | 7 | 0 | 6 | 5.7 | Cc1c(C)c2ccc(OCCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc2oc1=O | 10.1021/jm400408r | |||
| 44304327 | 200882 | 0 | None | -1380 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 535 | 11 | 1 | 6 | 4.3 | CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL60143 | 200882 | 0 | None | -1380 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 535 | 11 | 1 | 6 | 4.3 | CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 168268716 | 192762 | 0 | None | -1 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 372 | 3 | 4 | 4 | 3.5 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NC2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5170276 | 192762 | 0 | None | -1 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 372 | 3 | 4 | 4 | 3.5 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NC2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221176 | 192762 | 0 | None | -1 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 372 | 3 | 4 | 4 | 3.5 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NC2CCCCC2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168274690 | 190538 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5179725 | 190538 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 770 | 20 | 6 | 8 | 2.3 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 10051425 | 204666 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 494 | 7 | 2 | 5 | 4.0 | NC(=O)N(O)CCC#Cc1ccc(CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)o1 | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL73706 | 204666 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 494 | 7 | 2 | 5 | 4.0 | NC(=O)N(O)CCC#Cc1ccc(CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)o1 | 10.1016/j.bmcl.2004.02.005 | |||
| 44334782 | 5425 | 0 | None | -1318 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 442 | 10 | 1 | 5 | 3.4 | Cc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL107293 | 5425 | 0 | None | -1318 | 3 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 442 | 10 | 1 | 5 | 3.4 | Cc1ccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 71457844 | 84076 | 0 | None | -2884 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 429 | 6 | 0 | 4 | 5.1 | COc1ccccc1N1CCN(Cc2cc(CN3CCCCC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| CHEMBL2207638 | 84076 | 0 | None | -2884 | 7 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 429 | 6 | 0 | 4 | 5.1 | COc1ccccc1N1CCN(Cc2cc(CN3CCCCC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| 73349359 | 92543 | 0 | None | -8 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 341 | 6 | 1 | 4 | 2.9 | COc1cc(CN[C@H]2C3C4CC5C6C4CC3C6C52)cc(OC)c1OC | 10.1016/j.bmc.2013.07.045 | |||
| CHEMBL2432051 | 92543 | 0 | None | -8 | 8 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 341 | 6 | 1 | 4 | 2.9 | COc1cc(CN[C@H]2C3C4CC5C6C4CC3C6C52)cc(OC)c1OC | 10.1016/j.bmc.2013.07.045 | |||
| 44591012 | 175580 | 0 | None | -114 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 522 | 10 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL457957 | 175580 | 0 | None | -114 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 522 | 10 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| 44304439 | 102798 | 0 | None | -5 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 436 | 12 | 0 | 4 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)Cc3ccccc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL305338 | 102798 | 0 | None | -5 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 436 | 12 | 0 | 4 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)Cc3ccccc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304245 | 203328 | 0 | None | -13 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 425 | 11 | 0 | 5 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cccn3C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64884 | 203328 | 0 | None | -13 | 3 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 425 | 11 | 0 | 5 | 4.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cccn3C)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44334281 | 4759 | 0 | None | -181 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 433 | 9 | 2 | 6 | 2.8 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL103828 | 4759 | 0 | None | -181 | 3 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 433 | 9 | 2 | 6 | 2.8 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 168281024 | 190915 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 741 | 19 | 6 | 8 | 1.1 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185247 | 190915 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 741 | 19 | 6 | 8 | 1.1 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304459 | 172600 | 0 | None | -151 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 13 | 0 | 5 | 4.8 | CCCCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL449040 | 172600 | 0 | None | -151 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 13 | 0 | 5 | 4.8 | CCCCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304283 | 203173 | 0 | None | -42 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 452 | 8 | 0 | 5 | 4.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(C(C)(C)C)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64247 | 203173 | 0 | None | -42 | 3 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 452 | 8 | 0 | 5 | 4.8 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(C(C)(C)C)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 10472082 | 5141 | 0 | None | -831 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.9 | C[C@@H]1CC[C@@H](C)N1CCCOc1ccc(-c2ccc(C#N)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105762 | 5141 | 0 | None | -831 | 4 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 334 | 6 | 0 | 3 | 4.9 | C[C@@H]1CC[C@@H](C)N1CCCOc1ccc(-c2ccc(C#N)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168281024 | 190915 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 741 | 19 | 6 | 8 | 1.1 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185247 | 190915 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 741 | 19 | 6 | 8 | 1.1 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 9923186 | 107542 | 0 | None | -288 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 322 | 6 | 1 | 4 | 3.1 | N#Cc1ccc(-c2ccc(OCCCN3CC[C@H](O)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL318801 | 107542 | 0 | None | -288 | 4 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 322 | 6 | 1 | 4 | 3.1 | N#Cc1ccc(-c2ccc(OCCCN3CC[C@H](O)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168273745 | 192808 | 0 | None | -114 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 332 | 6 | 4 | 4 | 1.5 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5178472 | 192808 | 0 | None | -114 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 332 | 6 | 4 | 4 | 1.5 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221451 | 192808 | 0 | None | -114 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 332 | 6 | 4 | 4 | 1.5 | N/C(=N\C(=O)NCc1ccccc1)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 2435 | 3590 | 83 | None | -95 | 48 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm030480f | |||
| 60149 | 3590 | 83 | None | -95 | 48 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm030480f | |||
| 98 | 3590 | 83 | None | -95 | 48 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm030480f | |||
| CHEMBL12713 | 3590 | 83 | None | -95 | 48 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm030480f | |||
| DB06144 | 3590 | 83 | None | -95 | 48 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1021/jm030480f | |||
| 44304399 | 203193 | 0 | None | -28 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 418 | 13 | 0 | 5 | 4.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCCCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64317 | 203193 | 0 | None | -28 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 418 | 13 | 0 | 5 | 4.8 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCCCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44335456 | 4553 | 0 | None | -18 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 336 | 6 | 1 | 4 | 3.5 | N#Cc1ccc(-c2ccc(OCCCN3CCC(O)CC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL102416 | 4553 | 0 | None | -18 | 4 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 336 | 6 | 1 | 4 | 3.5 | N#Cc1ccc(-c2ccc(OCCCN3CCC(O)CC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 127036978 | 137281 | 0 | None | -1 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 415 | 5 | 1 | 6 | 3.6 | COc1ccc(CNc2nc3c(c(N4CCN(C)CC4)n2)CCc2ccccc2-3)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752225 | 137281 | 0 | None | -1 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 415 | 5 | 1 | 6 | 3.6 | COc1ccc(CNc2nc3c(c(N4CCN(C)CC4)n2)CCc2ccccc2-3)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm0205651 | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm0205651 | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm0205651 | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm0205651 | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1021/jm0205651 | |||
| 10474964 | 130471 | 0 | None | -181 | 7 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 3.3 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| CHEMBL368061 | 130471 | 0 | None | -181 | 7 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 3.3 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| CHEMBL5206021 | 130471 | 0 | None | -181 | 7 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 381 | 5 | 1 | 3 | 3.3 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 | 10.1021/jm950759z | |||
| 9827677 | 168422 | 0 | None | -288 | 7 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 510 | 7 | 2 | 4 | 4.2 | CC1=C(C(=O)NCCCN2CCC(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL43491 | 168422 | 0 | None | -288 | 7 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 510 | 7 | 2 | 4 | 4.2 | CC1=C(C(=O)NCCCN2CCC(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| 71212556 | 143562 | 0 | None | -7 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 433 | 3 | 1 | 6 | 4.6 | Cc1ccc2c(c1)Oc1sc(Cl)cc1C(N1CCN(CC(C)(C)C(=O)O)CC1)=N2 | nan | |||
| CHEMBL3899169 | 143562 | 0 | None | -7 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 433 | 3 | 1 | 6 | 4.6 | Cc1ccc2c(c1)Oc1sc(Cl)cc1C(N1CCN(CC(C)(C)C(=O)O)CC1)=N2 | nan | |||
| 51002362 | 82622 | 0 | None | 3 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 448 | 5 | 1 | 7 | 3.8 | COc1ccc(S(=O)(=O)n2cc(C)c3cc(Cl)cnc32)cc1NC1CCN(C)CC1 | 10.1021/jm300955x | |||
| CHEMBL2179222 | 82622 | 0 | None | 3 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 448 | 5 | 1 | 7 | 3.8 | COc1ccc(S(=O)(=O)n2cc(C)c3cc(Cl)cnc32)cc1NC1CCN(C)CC1 | 10.1021/jm300955x | |||
| 164618283 | 184544 | 0 | None | -158 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 390 | 7 | 4 | 5 | 2.4 | COc1ccc(C(C)NC(=O)/N=C(\N)NCCCc2sc(N)nc2C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4848026 | 184544 | 0 | None | -158 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 390 | 7 | 4 | 5 | 2.4 | COc1ccc(C(C)NC(=O)/N=C(\N)NCCCc2sc(N)nc2C)cc1 | 10.1016/j.ejmech.2021.113190 | |||
| 164614645 | 185132 | 0 | None | -57 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 402 | 8 | 4 | 4 | 3.0 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(c1ccccc1)C(C)C | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4856572 | 185132 | 0 | None | -57 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 402 | 8 | 4 | 4 | 3.0 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(c1ccccc1)C(C)C | 10.1016/j.ejmech.2021.113190 | |||
| 11530223 | 8149 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1cccc(C(C)c2c(CCN(C)C)sc3ccccc23)n1 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091792 | 8149 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 340 | 6 | 0 | 4 | 4.6 | COc1cccc(C(C)c2c(CCN(C)C)sc3ccccc23)n1 | 10.1016/j.bmcl.2010.01.134 | |||
| 45273828 | 195834 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 374 | 4 | 0 | 4 | 4.9 | Fc1ccc(Cn2c(N3CCC(n4cccc4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL558339 | 195834 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 374 | 4 | 0 | 4 | 4.9 | Fc1ccc(Cn2c(N3CCC(n4cccc4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 10343536 | 4962 | 0 | None | -3715 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 446 | 10 | 1 | 5 | 3.2 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL104809 | 4962 | 0 | None | -3715 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 446 | 10 | 1 | 5 | 3.2 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 132060746 | 163070 | 0 | None | -3 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 405 | 4 | 0 | 4 | 4.4 | O=C(OCc1ccccc1)N1Cc2ccc(N3CCN(C4CCCC4)CC3)cc2C1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4176474 | 163070 | 0 | None | -3 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 405 | 4 | 0 | 4 | 4.4 | O=C(OCc1ccccc1)N1Cc2ccc(N3CCN(C4CCCC4)CC3)cc2C1 | 10.1016/j.ejmech.2018.02.024 | |||
| 91864602 | 140738 | 0 | None | -169 | 8 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 313 | 5 | 0 | 2 | 4.4 | O=C(CCCN1CCc2ccccc2C1)c1ccc(Cl)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818047 | 140738 | 0 | None | -169 | 8 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 313 | 5 | 0 | 2 | 4.4 | O=C(CCCN1CCc2ccccc2C1)c1ccc(Cl)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 44301676 | 199197 | 0 | None | 8 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 396 | 11 | 1 | 3 | 5.3 | CN(CCCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL58973 | 199197 | 0 | None | 8 | 2 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 396 | 11 | 1 | 3 | 5.3 | CN(CCCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| 44326357 | 111609 | 0 | None | 2 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.9 | CN(C)CC1C[C@@H]2c3ccccc3N(C)c3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL328356 | 111609 | 0 | None | 2 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 308 | 2 | 0 | 3 | 3.9 | CN(C)CC1C[C@@H]2c3ccccc3N(C)c3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 5074 | 3332 | 80 | None | -10 | 30 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 10.1021/jm00112a025 | |||
| 97 | 3332 | 80 | None | -10 | 30 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 10.1021/jm00112a025 | |||
| CHEMBL267777 | 3332 | 80 | None | -10 | 30 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 10.1021/jm00112a025 | |||
| DB12693 | 3332 | 80 | None | -10 | 30 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 477 | 5 | 0 | 5 | 5.5 | Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F | 10.1021/jm00112a025 | |||
| 44521013 | 199793 | 0 | None | 13 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 251 | 3 | 0 | 1 | 3.7 | CN(C)CCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL593988 | 199793 | 0 | None | 13 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 251 | 3 | 0 | 1 | 3.7 | CN(C)CCC1c2ccccc2Cc2ccccc21 | 10.1016/j.bmc.2009.08.016 | |||
| 23722970 | 69020 | 21 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/jm2011589 | |||
| CHEMBL1923521 | 69020 | 21 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/jm2011589 | |||
| CHEMBL3977546 | 69020 | 21 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/jm2011589 | |||
| 135515431 | 4247 | 34 | None | 3 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 328 | 1 | 2 | 6 | 2.6 | CN1CCN(C2=Nc3ccccc3Nc3sc(CO)cc32)CC1 | 10.1016/S0960-894X(96)00567-7 | |||
| CHEMBL100454 | 4247 | 34 | None | 3 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 328 | 1 | 2 | 6 | 2.6 | CN1CCN(C2=Nc3ccccc3Nc3sc(CO)cc32)CC1 | 10.1016/S0960-894X(96)00567-7 | |||
| 15749430 | 102513 | 0 | None | - | 1 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 4.1 | CN(C)CCC/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| CHEMBL304042 | 102513 | 0 | None | - | 1 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 4.1 | CN(C)CCC/C=C1\c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00089a020 | |||
| 69262172 | 81293 | 1 | None | -3 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.5 | O=C(O)c1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158822 | 81293 | 1 | None | -3 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.5 | O=C(O)c1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 59296010 | 84214 | 0 | None | -3 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 490 | 7 | 3 | 6 | 2.9 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1n[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208431 | 84214 | 0 | None | -3 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 490 | 7 | 3 | 6 | 2.9 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1n[nH]c(=O)c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| 59295958 | 84012 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2ccc(F)cc12 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207280 | 84012 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2ccc(F)cc12 | 10.1016/j.bmcl.2012.09.112 | |||
| 23722970 | 69020 | 21 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/jm2011589 | |||
| CHEMBL1923521 | 69020 | 21 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/jm2011589 | |||
| CHEMBL3977546 | 69020 | 21 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 4 | 1 | 2 | 3.4 | c1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/jm2011589 | |||
| 134132469 | 154561 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 301 | 4 | 1 | 2 | 4.1 | Clc1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3910939 | 154561 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 301 | 4 | 1 | 2 | 4.1 | Clc1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3991161 | 154561 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 301 | 4 | 1 | 2 | 4.1 | Clc1ccc(Cc2ccccc2OC2CCNCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 134155595 | 154595 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 6 | 0 | 2 | 3.4 | c1ccc(Cc2ccccc2OCCN2CCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3962094 | 154595 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 6 | 0 | 2 | 3.4 | c1ccc(Cc2ccccc2OCCN2CCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3991444 | 154595 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 267 | 6 | 0 | 2 | 3.4 | c1ccc(Cc2ccccc2OCCN2CCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 135398745 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm070516u | |||
| 47 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm070516u | |||
| CHEMBL715 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm070516u | |||
| DB00334 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1021/jm070516u | |||
| 11291 | 98796 | 25 | None | 4 | 2 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1021/jm00017a019 | |||
| CHEMBL278398 | 98796 | 25 | None | 4 | 2 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | 10.1021/jm00017a019 | |||
| 5255691 | 11014 | 1 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 313 | 1 | 1 | 3 | 2.8 | Clc1ccc2c(c1)CCc1cccnc1C2N1CCNCC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL117406 | 11014 | 1 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 313 | 1 | 1 | 3 | 2.8 | Clc1ccc2c(c1)CCc1cccnc1C2N1CCNCC1 | 10.1016/s0960-894x(98)00626-x | |||
| 44343920 | 12790 | 0 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 327 | 1 | 0 | 3 | 3.2 | CN1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL118807 | 12790 | 0 | None | - | 1 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 327 | 1 | 0 | 3 | 3.2 | CN1CCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| 155554396 | 174617 | 0 | None | 158 | 2 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 304 | 5 | 0 | 4 | 1.4 | CN1CCc2ccc(OCCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4557586 | 174617 | 0 | None | 158 | 2 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 304 | 5 | 0 | 4 | 1.4 | CN1CCc2ccc(OCCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 45270339 | 195398 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 4 | 0 | 4 | 4.2 | O=C1CCCCN1C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL552026 | 195398 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 4 | 0 | 4 | 4.2 | O=C1CCCCN1C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 11393666 | 192986 | 0 | None | -16 | 19 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 340 | 2 | 1 | 2 | 4.6 | CC1(C)CN([C@@H]2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CCN1 | 10.1016/j.bmcl.2022.128879 | |||
| CHEMBL5201983 | 192986 | 0 | None | -16 | 19 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 340 | 2 | 1 | 2 | 4.6 | CC1(C)CN([C@@H]2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CCN1 | 10.1016/j.bmcl.2022.128879 | |||
| CHEMBL5222597 | 192986 | 0 | None | -16 | 19 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 340 | 2 | 1 | 2 | 4.6 | CC1(C)CN([C@@H]2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CCN1 | 10.1016/j.bmcl.2022.128879 | |||
| 53322838 | 57762 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 375 | 7 | 0 | 4 | 5.2 | C[C@H](C1=C(CCN(C)Cc2cccs2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669419 | 57762 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 375 | 7 | 0 | 4 | 5.2 | C[C@H](C1=C(CCN(C)Cc2cccs2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 135398737 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.ejmech.2014.01.012 | |||
| 38 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.ejmech.2014.01.012 | |||
| 722 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.ejmech.2014.01.012 | |||
| CHEMBL42 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.ejmech.2014.01.012 | |||
| DB00363 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1016/j.ejmech.2014.01.012 | |||
| 45272895 | 195657 | 18 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 389 | 4 | 0 | 5 | 4.6 | Cc1cnn(C2CCN(c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)c1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL556450 | 195657 | 18 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 389 | 4 | 0 | 5 | 4.6 | Cc1cnn(C2CCN(c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)c1 | 10.1016/j.bmcl.2009.05.086 | |||
| 45272895 | 195657 | 18 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 389 | 4 | 0 | 5 | 4.6 | Cc1cnn(C2CCN(c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)c1 | 10.1016/j.bmcl.2010.03.027 | |||
| CHEMBL556450 | 195657 | 18 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 389 | 4 | 0 | 5 | 4.6 | Cc1cnn(C2CCN(c3nc4ccccc4n3Cc3ccc(F)cc3)CC2)c1 | 10.1016/j.bmcl.2010.03.027 | |||
| 9980189 | 115227 | 0 | None | - | 1 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCN1CCc3ccccc3C1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL334678 | 115227 | 0 | None | - | 1 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 431 | 5 | 1 | 4 | 5.2 | O=C(O)c1ccc2c(c1)C(SCCN1CCc3ccccc3C1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 44304402 | 201212 | 0 | None | -3 | 3 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 415 | 12 | 0 | 6 | 4.5 | CCCCCC(=O)c1ccc(OCCCN2CCN(Cc3nccs3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL60360 | 201212 | 0 | None | -3 | 3 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 415 | 12 | 0 | 6 | 4.5 | CCCCCC(=O)c1ccc(OCCCN2CCN(Cc3nccs3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 23562970 | 100913 | 0 | None | -10 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 340 | 8 | 2 | 3 | 3.8 | Clc1ccc(C(CCNCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL293895 | 100913 | 0 | None | -10 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 340 | 8 | 2 | 3 | 3.8 | Clc1ccc(C(CCNCCc2c[nH]cn2)c2ccccn2)cc1 | 10.1016/s0960-894x(03)00357-3 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.5b00516 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.5b00516 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.5b00516 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.5b00516 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.5b00516 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1021/acs.jmedchem.5b00516 | |||
| 10339767 | 53188 | 0 | None | -602 | 3 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 380 | 6 | 0 | 4 | 4.8 | Cn1c(=O)sc2cc(CCCCN3CCC(c4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL15986 | 53188 | 0 | None | -602 | 3 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 380 | 6 | 0 | 4 | 4.8 | Cn1c(=O)sc2cc(CCCCN3CCC(c4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 44333987 | 108549 | 0 | None | -66 | 3 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 433 | 9 | 2 | 6 | 2.8 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL320174 | 108549 | 0 | None | -66 | 3 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 433 | 9 | 2 | 6 | 2.8 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44304088 | 202387 | 0 | None | -23 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 402 | 8 | 0 | 5 | 4.0 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)C3CCCCC3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL61070 | 202387 | 0 | None | -23 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 402 | 8 | 0 | 5 | 4.0 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)C3CCCCC3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 91864602 | 140738 | 0 | None | -169 | 8 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 313 | 5 | 0 | 2 | 4.4 | O=C(CCCN1CCc2ccccc2C1)c1ccc(Cl)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818047 | 140738 | 0 | None | -169 | 8 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 313 | 5 | 0 | 2 | 4.4 | O=C(CCCN1CCc2ccccc2C1)c1ccc(Cl)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 57400700 | 67878 | 0 | None | -83 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 470 | 8 | 1 | 6 | 3.4 | COc1ccc(CN(CCN2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910380 | 67878 | 0 | None | -83 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 470 | 8 | 1 | 6 | 3.4 | COc1ccc(CN(CCN2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| 18539962 | 102131 | 0 | None | -223 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 318 | 10 | 1 | 4 | 3.1 | CCCCCC(=O)c1ccc(OCCCN2CCNCC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL302445 | 102131 | 0 | None | -223 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 318 | 10 | 1 | 4 | 3.1 | CCCCCC(=O)c1ccc(OCCCN2CCNCC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 168283321 | 192895 | 0 | None | -2 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 364 | 7 | 4 | 4 | 2.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5183015 | 192895 | 0 | None | -2 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 364 | 7 | 4 | 4 | 2.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222057 | 192895 | 0 | None | -2 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 364 | 7 | 4 | 4 | 2.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCC(C)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| 127052293 | 140238 | 3 | None | -131 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3805361 | 140238 | 3 | None | -131 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 10.1016/j.bmcl.2020.127681 | |||
| 57399432 | 70465 | 0 | None | -2 | 8 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 399 | 6 | 0 | 4 | 5.5 | Clc1ccc(N2CCCN(CCCCc3nc4ccccc4s3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946254 | 70465 | 0 | None | -2 | 8 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 399 | 6 | 0 | 4 | 5.5 | Clc1ccc(N2CCCN(CCCCc3nc4ccccc4s3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| 45485462 | 197686 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 419 | 8 | 1 | 2 | 6.6 | CC1CCC(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)CC1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL571174 | 197686 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 419 | 8 | 1 | 2 | 6.6 | CC1CCC(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)CC1 | 10.1016/j.bmcl.2009.07.047 | |||
| 29136870 | 69021 | 7 | None | 46 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 301 | 2 | 0 | 7 | 0.7 | CN1CCN(c2nc(N3CCCC3)c3cnn(C)c3n2)CC1 | 10.1021/jm2011589 | |||
| CHEMBL1923522 | 69021 | 7 | None | 46 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 301 | 2 | 0 | 7 | 0.7 | CN1CCN(c2nc(N3CCCC3)c3cnn(C)c3n2)CC1 | 10.1021/jm2011589 | |||
| 289 | 242 | 12 | None | -56 | 14 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 301 | 8 | 0 | 2 | 4.9 | CCCCC1CCN(CC1)CCCC(=O)c1ccccc1C | 10.1021/jm100697g | |||
| 9948320 | 242 | 12 | None | -56 | 14 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 301 | 8 | 0 | 2 | 4.9 | CCCCC1CCN(CC1)CCCC(=O)c1ccccc1C | 10.1021/jm100697g | |||
| CHEMBL1242950 | 242 | 12 | None | -56 | 14 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 301 | 8 | 0 | 2 | 4.9 | CCCCC1CCN(CC1)CCCC(=O)c1ccccc1C | 10.1021/jm100697g | |||
| 44288877 | 168599 | 0 | None | -87 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 549 | 7 | 1 | 5 | 4.3 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL43594 | 168599 | 0 | None | -87 | 5 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 549 | 7 | 1 | 5 | 4.3 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1C | 10.1016/s0960-894x(99)00696-4 | |||
| 44304031 | 100672 | 0 | None | -85 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 452 | 10 | 0 | 6 | 4.1 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)/C=C/c3ccc(OC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL292275 | 100672 | 0 | None | -85 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 452 | 10 | 0 | 6 | 4.1 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)/C=C/c3ccc(OC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 164611342 | 185088 | 0 | None | -134 | 6 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 346 | 6 | 4 | 4 | 1.8 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4856005 | 185088 | 0 | None | -134 | 6 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 346 | 6 | 4 | 4 | 1.8 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 3041343 | 109799 | 5 | None | -10 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 377 | 6 | 1 | 3 | 3.4 | O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCCCC1 | 10.1016/j.ejmech.2014.03.014 | |||
| CHEMBL3233067 | 109799 | 5 | None | -10 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 377 | 6 | 1 | 3 | 3.4 | O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCCCC1 | 10.1016/j.ejmech.2014.03.014 | |||
| 132060770 | 162639 | 0 | None | 5 | 10 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 451 | 7 | 0 | 6 | 3.5 | CCOC(=O)CCN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)CC3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4169689 | 162639 | 0 | None | 5 | 10 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 451 | 7 | 0 | 6 | 3.5 | CCOC(=O)CCN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)CC3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| 29136870 | 69021 | 7 | None | 46 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 301 | 2 | 0 | 7 | 0.7 | CN1CCN(c2nc(N3CCCC3)c3cnn(C)c3n2)CC1 | 10.1021/jm2011589 | |||
| CHEMBL1923522 | 69021 | 7 | None | 46 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 301 | 2 | 0 | 7 | 0.7 | CN1CCN(c2nc(N3CCCC3)c3cnn(C)c3n2)CC1 | 10.1021/jm2011589 | |||
| 3069135 | 70164 | 3 | None | -8 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 314 | 6 | 0 | 3 | 3.4 | Fc1ccc(OCCCN2CCN(c3ccccc3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL1940412 | 70164 | 3 | None | -8 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 314 | 6 | 0 | 3 | 3.4 | Fc1ccc(OCCCN2CCN(c3ccccc3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| 44334042 | 163489 | 0 | None | -562 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 453 | 10 | 1 | 6 | 3.0 | N#Cc1ccccc1S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)C1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL420108 | 163489 | 0 | None | -562 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 453 | 10 | 1 | 6 | 3.0 | N#Cc1ccccc1S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)C1 | 10.1016/s0960-894x(02)00685-6 | |||
| 11848624 | 89146 | 0 | None | -15 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 381 | 7 | 1 | 6 | 4.3 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1OC | 10.1021/jm701143p | |||
| CHEMBL236587 | 89146 | 0 | None | -15 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 381 | 7 | 1 | 6 | 4.3 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1OC | 10.1021/jm701143p | |||
| 11848624 | 89146 | 0 | None | -15 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 381 | 7 | 1 | 6 | 4.3 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL236587 | 89146 | 0 | None | -15 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 381 | 7 | 1 | 6 | 4.3 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| 46884637 | 7723 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1nccnc1CC1=C(CCN(C)C)Cc2ccccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1088898 | 7723 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 293 | 5 | 0 | 3 | 3.3 | Cc1nccnc1CC1=C(CCN(C)C)Cc2ccccc21 | 10.1016/j.bmcl.2010.02.055 | |||
| 44288917 | 100255 | 0 | None | -34 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 510 | 7 | 2 | 4 | 4.0 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL288768 | 100255 | 0 | None | -34 | 4 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 510 | 7 | 2 | 4 | 4.0 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| 71072104 | 81263 | 0 | None | -15 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 520 | 9 | 1 | 5 | 5.3 | COc1ccccc1C[C@@H](C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158775 | 81263 | 0 | None | -15 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 520 | 9 | 1 | 5 | 5.3 | COc1ccccc1C[C@@H](C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71460416 | 81264 | 0 | None | -2 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 520 | 9 | 1 | 5 | 5.3 | COc1ccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158776 | 81264 | 0 | None | -2 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 520 | 9 | 1 | 5 | 5.3 | COc1ccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| 66615617 | 81276 | 0 | None | -31 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1c(OC2CCN(CC3CCN([C@@H](Cc4ccccc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158788 | 81276 | 0 | None | -31 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1c(OC2CCN(CC3CCN([C@@H](Cc4ccccc4)C(=O)O)CC3)CC2)ccc(Cl)c1Cl | 10.1016/j.bmcl.2012.08.103 | |||
| 10151756 | 81286 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.1 | O=C(O)C(c1ccccc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158815 | 81286 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.1 | O=C(O)C(c1ccccc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 68846936 | 81287 | 0 | None | 1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)C(c1ccccc1)N1CCCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158816 | 81287 | 0 | None | 1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)C(c1ccccc1)N1CCCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)C1 | 10.1016/j.bmcl.2012.08.103 | |||
| 69260851 | 81295 | 1 | None | 2 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.5 | O=C(O)c1ccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158824 | 81295 | 1 | None | 2 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 462 | 6 | 1 | 4 | 5.5 | O=C(O)c1ccc(N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| 69347719 | 81303 | 1 | None | -3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)c1ccccc1CN1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158831 | 81303 | 1 | None | -3 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 5.4 | O=C(O)c1ccccc1CN1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 59296039 | 84210 | 0 | None | -15 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 467 | 8 | 3 | 6 | 3.2 | COc1cc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)ccc1N | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208427 | 84210 | 0 | None | -15 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 467 | 8 | 3 | 6 | 3.2 | COc1cc(C(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)ccc1N | 10.1016/j.bmcl.2012.09.113 | |||
| 59296024 | 84009 | 0 | None | -9 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 547 | 8 | 3 | 7 | 2.5 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3ccc(S(C)(=O)=O)cc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207277 | 84009 | 0 | None | -9 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 547 | 8 | 3 | 7 | 2.5 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3ccc(S(C)(=O)=O)cc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| 59295928 | 84015 | 0 | None | -63 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 581 | 8 | 3 | 7 | 3.2 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccc(S(C)(=O)=O)cc34)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207283 | 84015 | 0 | None | -63 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 581 | 8 | 3 | 7 | 3.2 | Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)c3c[nH]c(=O)c4ccc(S(C)(=O)=O)cc34)CC2)c1Cl | 10.1016/j.bmcl.2012.09.112 | |||
| 43229249 | 140817 | 1 | None | -16 | 8 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 279 | 5 | 0 | 2 | 3.7 | O=C(CCCN1CCc2ccccc2C1)c1ccccc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818989 | 140817 | 1 | None | -16 | 8 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 279 | 5 | 0 | 2 | 3.7 | O=C(CCCN1CCc2ccccc2C1)c1ccccc1 | 10.1016/j.bmc.2016.05.053 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 134145497 | 149163 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 309 | 6 | 0 | 2 | 4.5 | c1ccc(Cc2ccccc2OCCN2CCCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3943575 | 149163 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 309 | 6 | 0 | 2 | 4.5 | c1ccc(Cc2ccccc2OCCN2CCCCCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 129103318 | 167314 | 0 | None | -870 | 14 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 475 | 7 | 0 | 5 | 5.0 | O=C(CCCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2c3c(c1)CCN3C(=O)CC2 | 10.1016/j.ejmech.2020.112709 | |||
| CHEMBL4293999 | 167314 | 0 | None | -870 | 14 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 475 | 7 | 0 | 5 | 5.0 | O=C(CCCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2c3c(c1)CCN3C(=O)CC2 | 10.1016/j.ejmech.2020.112709 | |||
| 129103318 | 167314 | 0 | None | -870 | 14 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 475 | 7 | 0 | 5 | 5.0 | O=C(CCCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2c3c(c1)CCN3C(=O)CC2 | 10.1021/acs.jmedchem.8b01096 | |||
| CHEMBL4293999 | 167314 | 0 | None | -870 | 14 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 475 | 7 | 0 | 5 | 5.0 | O=C(CCCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2c3c(c1)CCN3C(=O)CC2 | 10.1021/acs.jmedchem.8b01096 | |||
| 10263017 | 207462 | 2 | None | 1 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 223 | 10 | 2 | 2 | 3.0 | NCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm00002a008 | |||
| CHEMBL94249 | 207462 | 2 | None | 1 | 3 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 223 | 10 | 2 | 2 | 3.0 | NCCCCCCCCCCc1c[nH]cn1 | 10.1021/jm00002a008 | |||
| 127036982 | 137467 | 0 | None | 3 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 525 | 6 | 1 | 6 | 5.9 | COc1ccc(CNc2nc(N3CCN(C)CC3)nc3c2CCc2ccccc2-3)cc1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753784 | 137467 | 0 | None | 3 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 525 | 6 | 1 | 6 | 5.9 | COc1ccc(CNc2nc(N3CCN(C)CC3)nc3c2CCc2ccccc2-3)cc1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2015.12.035 | |||
| 550981 | 69031 | 12 | None | -2 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 280 | 5 | 2 | 3 | 2.9 | OC(CNC1CC1)Cn1c2ccccc2c2ccccc21 | 10.1021/jm2011589 | |||
| CHEMBL1923533 | 69031 | 12 | None | -2 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 280 | 5 | 2 | 3 | 2.9 | OC(CNC1CC1)Cn1c2ccccc2c2ccccc21 | 10.1021/jm2011589 | |||
| 10805119 | 54602 | 0 | None | -3235 | 2 | Guinea pig | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 313 | 5 | 2 | 3 | 3.6 | O=C(Nc1cccc(C(F)(F)F)c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16108 | 54602 | 0 | None | -3235 | 2 | Guinea pig | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 313 | 5 | 2 | 3 | 3.6 | O=C(Nc1cccc(C(F)(F)F)c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10062176 | 55835 | 0 | None | -15488 | 2 | Guinea pig | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 279 | 5 | 2 | 3 | 3.2 | O=C(Nc1ccc(Cl)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16231 | 55835 | 0 | None | -15488 | 2 | Guinea pig | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 279 | 5 | 2 | 3 | 3.2 | O=C(Nc1ccc(Cl)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10612308 | 98211 | 0 | None | -6309 | 2 | Guinea pig | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 273 | 7 | 2 | 3 | 2.3 | O=C(NCCc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL274262 | 98211 | 0 | None | -6309 | 2 | Guinea pig | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 273 | 7 | 2 | 3 | 2.3 | O=C(NCCc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 164612760 | 184718 | 0 | None | -54 | 4 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 390 | 7 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NC[C@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4850490 | 184718 | 0 | None | -54 | 4 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 390 | 7 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)NC[C@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 13091273 | 182438 | 0 | None | -275 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 367 | 6 | 1 | 3 | 4.3 | O=C(CCCN1C2CCC1CC(O)(c1ccccc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL478617 | 182438 | 0 | None | -275 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 367 | 6 | 1 | 3 | 4.3 | O=C(CCCN1C2CCC1CC(O)(c1ccccc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL553327 | 182438 | 0 | None | -275 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 367 | 6 | 1 | 3 | 4.3 | O=C(CCCN1C2CCC1CC(O)(c1ccccc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 119812 | 199730 | 65 | None | 23 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 225 | 5 | 1 | 1 | 3.4 | CNCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL593494 | 199730 | 65 | None | 23 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 225 | 5 | 1 | 1 | 3.4 | CNCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| 9932698 | 17909 | 0 | None | -354 | 5 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 435 | 6 | 2 | 4 | 3.4 | NCc1ccc2c(c1)c(C1CCN(CCN3CCNC3=O)CC1)cn2-c1ccc(F)cc1 | 10.1021/jm100652h | |||
| CHEMBL1259172 | 17909 | 0 | None | -354 | 5 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 435 | 6 | 2 | 4 | 3.4 | NCc1ccc2c(c1)c(C1CCN(CCN3CCNC3=O)CC1)cn2-c1ccc(F)cc1 | 10.1021/jm100652h | |||
| 52946023 | 17914 | 0 | None | -95 | 5 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 477 | 7 | 2 | 4 | 3.6 | CC(=O)NCc1ccc2c(c1)c(C1CCN(CCN3CCNC3=O)CC1)cn2-c1ccc(F)cc1 | 10.1021/jm100652h | |||
| CHEMBL1259187 | 17914 | 0 | None | -95 | 5 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 477 | 7 | 2 | 4 | 3.6 | CC(=O)NCc1ccc2c(c1)c(C1CCN(CCN3CCNC3=O)CC1)cn2-c1ccc(F)cc1 | 10.1021/jm100652h | |||
| 45485529 | 197718 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 385 | 6 | 1 | 2 | 5.2 | Cc1ccc(CCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL571391 | 197718 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 385 | 6 | 1 | 2 | 5.2 | Cc1ccc(CCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1016/j.bmcl.2009.07.047 | |||
| 49841845 | 69739 | 0 | None | -1288 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 309 | 2 | 1 | 6 | 2.2 | CN1CCN(c2nc(N)nc3cc(-c4ccco4)ccc23)CC1 | 10.1016/j.bmcl.2011.10.104 | |||
| CHEMBL1935573 | 69739 | 0 | None | -1288 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 309 | 2 | 1 | 6 | 2.2 | CN1CCN(c2nc(N)nc3cc(-c4ccco4)ccc23)CC1 | 10.1016/j.bmcl.2011.10.104 | |||
| 168294767 | 193019 | 0 | None | -3235 | 20 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 313 | 8 | 4 | 5 | 0.9 | CCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5207281 | 193019 | 0 | None | -3235 | 20 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 313 | 8 | 4 | 5 | 0.9 | CCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222802 | 193019 | 0 | None | -3235 | 20 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 313 | 8 | 4 | 5 | 0.9 | CCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 71454294 | 84077 | 0 | None | -1412 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 431 | 6 | 0 | 5 | 4.0 | COc1ccccc1N1CCN(Cc2cc(CN3CCOCC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| CHEMBL2207639 | 84077 | 0 | None | -1412 | 7 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 431 | 6 | 0 | 5 | 4.0 | COc1ccccc1N1CCN(Cc2cc(CN3CCOCC3)c3cccccc2-3)CC1 | 10.1016/j.bmcl.2012.09.064 | |||
| 6918107 | 78146 | 16 | None | -7 | 5 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 319 | 2 | 0 | 4 | 3.5 | Cc1nccn1C[C@H]1CCc2c(c3cccc4c3n2CCC4)C1=O | 10.1021/jm00075a026 | |||
| CHEMBL2103778 | 78146 | 16 | None | -7 | 5 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 319 | 2 | 0 | 4 | 3.5 | Cc1nccn1C[C@H]1CCc2c(c3cccc4c3n2CCC4)C1=O | 10.1021/jm00075a026 | |||
| 127052293 | 140238 | 3 | None | -131 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3805361 | 140238 | 3 | None | -131 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 15723 | 18539 | 111 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 267 | 3 | 2 | 2 | 2.9 | OC(c1ccccc1)(c1ccccc1)C1CCNCC1 | 10.1016/j.bmcl.2009.07.047 | |||
| CHEMBL127508 | 18539 | 111 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 267 | 3 | 2 | 2 | 2.9 | OC(c1ccccc1)(c1ccccc1)C1CCNCC1 | 10.1016/j.bmcl.2009.07.047 | |||
| 44312568 | 204773 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 498 | 7 | 2 | 5 | 3.4 | NC(=O)N(O)CCC#C[C@@H]1CC[C@@H](CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)O1 | 10.1016/j.bmcl.2004.02.005 | |||
| CHEMBL74779 | 204773 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 498 | 7 | 2 | 5 | 3.4 | NC(=O)N(O)CCC#C[C@@H]1CC[C@@H](CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)O1 | 10.1016/j.bmcl.2004.02.005 | |||
| 44304243 | 203199 | 0 | None | -48 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 374 | 13 | 0 | 4 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(CCCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64334 | 203199 | 0 | None | -48 | 3 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 374 | 13 | 0 | 4 | 4.6 | CCCCCC(=O)c1ccc(OCCCN2CCN(CCCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 10003483 | 4644 | 0 | None | -2454 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 442 | 10 | 1 | 5 | 3.4 | Cc1cccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)c1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL103027 | 4644 | 0 | None | -2454 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 442 | 10 | 1 | 5 | 3.4 | Cc1cccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)c1 | 10.1016/s0960-894x(02)00685-6 | |||
| 168294161 | 193006 | 0 | None | -3 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1cccc(-c2sc(N)nc2C)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5204739 | 193006 | 0 | None | -3 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1cccc(-c2sc(N)nc2C)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222742 | 193006 | 0 | None | -3 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 3.3 | CCCCCNC(=O)/N=C(\N)Nc1cccc(-c2sc(N)nc2C)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 57390694 | 70466 | 0 | None | -3 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 385 | 5 | 0 | 4 | 5.1 | Clc1ccc(N2CCCN(CCCc3nc4ccccc4s3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946255 | 70466 | 0 | None | -3 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 385 | 5 | 0 | 4 | 5.1 | Clc1ccc(N2CCCN(CCCc3nc4ccccc4s3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| 44582705 | 186996 | 0 | None | -4 | 13 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 399 | 9 | 0 | 4 | 4.5 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| CHEMBL490632 | 186996 | 0 | None | -4 | 13 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 399 | 9 | 0 | 4 | 4.5 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| 3050372 | 70166 | 7 | None | -15 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 296 | 6 | 0 | 3 | 3.3 | c1ccc(OCCCN2CCN(c3ccccc3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL1940414 | 70166 | 7 | None | -15 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 296 | 6 | 0 | 3 | 3.3 | c1ccc(OCCCN2CCN(c3ccccc3)CC2)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| 127036186 | 137414 | 0 | None | -21 | 19 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 254 | 7 | 1 | 1 | 3.7 | C=CCN(CC=C)CCc1c[nH]c2ccc(C)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| CHEMBL3753318 | 137414 | 0 | None | -21 | 19 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 254 | 7 | 1 | 1 | 3.7 | C=CCN(CC=C)CCc1c[nH]c2ccc(C)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| 44304494 | 202992 | 0 | None | -5495 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 489 | 12 | 1 | 6 | 4.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL63125 | 202992 | 0 | None | -5495 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 489 | 12 | 1 | 6 | 4.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 127049856 | 140245 | 0 | None | -23 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@H]1CC[C@@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3805431 | 140245 | 0 | None | -23 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@H]1CC[C@@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 43229249 | 140817 | 1 | None | -16 | 8 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 279 | 5 | 0 | 2 | 3.7 | O=C(CCCN1CCc2ccccc2C1)c1ccccc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818989 | 140817 | 1 | None | -16 | 8 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 279 | 5 | 0 | 2 | 3.7 | O=C(CCCN1CCc2ccccc2C1)c1ccccc1 | 10.1016/j.bmc.2016.05.053 | |||
| 71457264 | 82621 | 0 | None | -2 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 447 | 5 | 1 | 6 | 4.4 | COc1ccc(S(=O)(=O)n2cc(C)c3cc(Cl)ccc32)cc1NC1CCN(C)CC1 | 10.1021/jm300955x | |||
| CHEMBL2179217 | 82621 | 0 | None | -2 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 447 | 5 | 1 | 6 | 4.4 | COc1ccc(S(=O)(=O)n2cc(C)c3cc(Cl)ccc32)cc1NC1CCN(C)CC1 | 10.1021/jm300955x | |||
| 122065 | 189549 | 3 | None | -1380 | 8 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 380 | 5 | 1 | 6 | 1.5 | COc1ccccc1N1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1 | 10.1021/jm970159v | |||
| CHEMBL51433 | 189549 | 3 | None | -1380 | 8 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 380 | 5 | 1 | 6 | 1.5 | COc1ccccc1N1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1 | 10.1021/jm970159v | |||
| 44591098 | 176762 | 0 | None | -199 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 508 | 9 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL460402 | 176762 | 0 | None | -199 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 508 | 9 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)c1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| 162651034 | 180305 | 0 | None | -301 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 435 | 8 | 0 | 5 | 4.6 | O=C(c1ccc(Cl)cc1)c1ccc(OCCCN2CCN(c3ccncc3)CC2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4750996 | 180305 | 0 | None | -301 | 2 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 435 | 8 | 0 | 5 | 4.6 | O=C(c1ccc(Cl)cc1)c1ccc(OCCCN2CCN(c3ccncc3)CC2)cc1 | 10.1016/j.ejmech.2020.113041 | |||
| 11681378 | 8269 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1ccc(C(C)c2c(CCN(C)C)sc3ccccc23)cn1 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092496 | 8269 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1ccc(C(C)c2c(CCN(C)C)sc3ccccc23)cn1 | 10.1016/j.bmcl.2010.01.134 | |||
| 56944383 | 112119 | 0 | None | -125 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 5.1 | O=S(=O)(NCCCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2ccccc2s1 | 10.1021/jm401895u | |||
| CHEMBL3290012 | 112119 | 0 | None | -125 | 12 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 487 | 8 | 1 | 6 | 5.1 | O=S(=O)(NCCCCN1CCC(c2noc3cc(F)ccc23)CC1)c1cc2ccccc2s1 | 10.1021/jm401895u | |||
| 10104 | 3566 | 12 | None | -2 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | CN(CCC1=C([C@@H](c2ccccn2)C)c2c(C1)cccc2)C | 10.1021/jm020895l | |||
| 6604866 | 3566 | 12 | None | -2 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | CN(CCC1=C([C@@H](c2ccccn2)C)c2c(C1)cccc2)C | 10.1021/jm020895l | |||
| CHEMBL1493369 | 3566 | 12 | None | -2 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 292 | 5 | 0 | 2 | 4.1 | CN(CCC1=C([C@@H](c2ccccn2)C)c2c(C1)cccc2)C | 10.1021/jm020895l | |||
| 168286548 | 191389 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 792 | 20 | 6 | 8 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192441 | 191389 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 792 | 20 | 6 | 8 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 1258 | 196 | 12 | None | -34673 | 5 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 359 | 8 | 1 | 5 | 1.5 | C[C@H](C(=O)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1)N | 10.1016/s0960-894x(02)00310-4 | |||
| 9906860 | 196 | 12 | None | -34673 | 5 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 359 | 8 | 1 | 5 | 1.5 | C[C@H](C(=O)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1)N | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL302196 | 196 | 12 | None | -34673 | 5 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 359 | 8 | 1 | 5 | 1.5 | C[C@H](C(=O)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1)N | 10.1016/s0960-894x(02)00310-4 | |||
| 168286548 | 191389 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 792 | 20 | 6 | 8 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5192441 | 191389 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 792 | 20 | 6 | 8 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 21527771 | 70156 | 1 | None | -275 | 10 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 363 | 6 | 1 | 3 | 4.2 | OC1(c2ccc(Cl)cc2)CCN(CCCOc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL1940404 | 70156 | 1 | None | -275 | 10 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 363 | 6 | 1 | 3 | 4.2 | OC1(c2ccc(Cl)cc2)CCN(CCCOc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2014.07.018 | |||
| 56966475 | 105462 | 0 | None | -3467 | 4 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 448 | 8 | 0 | 6 | 4.3 | COc1ccccc1N1CCN(CCCCOc2ccc3c4c(c(=O)oc3c2)CCC4)CC1 | 10.1016/j.ejmech.2014.01.012 | |||
| CHEMBL3120682 | 105462 | 0 | None | -3467 | 4 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 448 | 8 | 0 | 6 | 4.3 | COc1ccccc1N1CCN(CCCCOc2ccc3c4c(c(=O)oc3c2)CCC4)CC1 | 10.1016/j.ejmech.2014.01.012 | |||
| 10177985 | 100656 | 0 | None | -1 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 10 | 1 | 3 | 4.9 | CN(CCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL292195 | 100656 | 0 | None | -1 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 10 | 1 | 3 | 4.9 | CN(CCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmcl.2020.127681 | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmcl.2020.127681 | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/j.bmcl.2020.127681 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1021/jm1013874 | |||
| 10177985 | 100656 | 0 | None | 1 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 10 | 1 | 3 | 4.9 | CN(CCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1021/jm100064d | |||
| CHEMBL292195 | 100656 | 0 | None | 1 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 10 | 1 | 3 | 4.9 | CN(CCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1021/jm100064d | |||
| 15288693 | 52858 | 0 | None | 4 | 3 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 367 | 5 | 0 | 5 | 3.0 | Cn1c(=O)sc2cc(CCN3CCN(Cc4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL15955 | 52858 | 0 | None | 4 | 3 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 367 | 5 | 0 | 5 | 3.0 | Cn1c(=O)sc2cc(CCN3CCN(Cc4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/S0960-894X(96)00567-7 | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/S0960-894X(96)00567-7 | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/S0960-894X(96)00567-7 | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1016/S0960-894X(96)00567-7 | |||
| 10177985 | 100656 | 0 | None | 1 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 10 | 1 | 3 | 4.9 | CN(CCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1021/jm058225d | |||
| CHEMBL292195 | 100656 | 0 | None | 1 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 382 | 10 | 1 | 3 | 4.9 | CN(CCCCc1c[nH]cn1)CCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1021/jm058225d | |||
| 57402472 | 67879 | 0 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 526 | 11 | 1 | 6 | 4.0 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910381 | 67879 | 0 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 526 | 11 | 1 | 6 | 4.0 | COc1ccc(CN(CCN(C)CCN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| 45271166 | 196416 | 1 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 401 | 5 | 0 | 6 | 4.4 | COc1ccc(Cn2c(N3CCC(n4cc(C)cn4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL562894 | 196416 | 1 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 401 | 5 | 0 | 6 | 4.4 | COc1ccc(Cn2c(N3CCC(n4cc(C)cn4)CC3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2009.05.086 | |||
| 9819674 | 12934 | 0 | None | 1 | 5 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 347 | 3 | 1 | 5 | 2.4 | OCCN1CCN(C2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| CHEMBL118919 | 12934 | 0 | None | 1 | 5 | Rat | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 347 | 3 | 1 | 5 | 2.4 | OCCN1CCN(C2Cn3cccc3Sc3ccc(F)cc32)CC1 | 10.1021/jm010982y | |||
| 53320177 | 57747 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 293 | 6 | 0 | 3 | 3.4 | CCN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669405 | 57747 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 293 | 6 | 0 | 3 | 3.4 | CCN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.12.053 | |||
| 10969390 | 59677 | 0 | None | 4 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 324 | 7 | 0 | 2 | 4.5 | CC(C1=C(CCN(C)CCF)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| CHEMBL172233 | 59677 | 0 | None | 4 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 324 | 7 | 0 | 2 | 4.5 | CC(C1=C(CCN(C)CCF)Cc2ccccc21)c1ccccn1 | 10.1021/jm020895l | |||
| 44401041 | 70487 | 0 | None | -1 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 313 | 2 | 0 | 3 | 4.1 | CN(C)C[C@H]1CC2c3ccccc3Oc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| CHEMBL194659 | 70487 | 0 | None | -1 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 313 | 2 | 0 | 3 | 4.1 | CN(C)C[C@H]1CC2c3ccccc3Oc3ccc(F)cc3[C@H]2O1 | 10.1021/jm049632c | |||
| 10070478 | 13466 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1ccc(CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cn1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL1193187 | 13466 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1ccc(CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)cn1 | 10.1021/acs.jmedchem.9b00447 | |||
| 44389301 | 64311 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 619 | 13 | 1 | 6 | 6.8 | CC(C)COC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL181085 | 64311 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 619 | 13 | 1 | 6 | 6.8 | CC(C)COC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 44305842 | 203399 | 0 | None | - | 1 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 381 | 4 | 1 | 4 | 4.1 | O=C(O)c1ccc2c(c1)/C(=C\CCN1CCSCC1)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| CHEMBL65492 | 203399 | 0 | None | - | 1 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 381 | 4 | 1 | 4 | 4.1 | O=C(O)c1ccc2c(c1)/C(=C\CCN1CCSCC1)c1ccccc1CO2 | 10.1021/jm00089a020 | |||
| 46884640 | 7913 | 0 | None | 2187 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cccnn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1090197 | 7913 | 0 | None | 2187 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 279 | 5 | 0 | 3 | 3.0 | CN(C)CCC1=C(Cc2cccnn2)c2ccccc2C1 | 10.1016/j.bmcl.2010.02.055 | |||
| 11846300 | 80266 | 3 | None | 2 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1021/jm800876b | |||
| CHEMBL213912 | 80266 | 3 | None | 2 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1021/jm800876b | |||
| 11846300 | 80266 | 3 | None | 2 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1021/jm051008s | |||
| CHEMBL213912 | 80266 | 3 | None | 2 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1021/jm051008s | |||
| 59295931 | 84212 | 0 | None | -5 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 462 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1n[nH]c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208429 | 84212 | 0 | None | -5 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 462 | 7 | 3 | 5 | 3.5 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1n[nH]c2ccccc12 | 10.1016/j.bmcl.2012.09.113 | |||
| 59295935 | 84010 | 0 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(F)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207278 | 84010 | 0 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 507 | 7 | 3 | 5 | 3.6 | O=C(NC[C@@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1)c1c[nH]c(=O)c2cc(F)ccc12 | 10.1016/j.bmcl.2012.09.112 | |||
| 10408773 | 165299 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 401 | 2 | 0 | 3 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccncc2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL423316 | 165299 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 401 | 2 | 0 | 3 | 5.3 | Clc1ccc2c(c1)CCc1cccnc1C2=C1CCN(Cc2ccncc2)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 155527187 | 171152 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 414 | 2 | 0 | 2 | 6.2 | Cc1cccc(CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)c1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL4458676 | 171152 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 414 | 2 | 0 | 2 | 6.2 | Cc1cccc(CN2CCC(=C3c4ccc(Cl)cc4CCc4cccnc43)CC2)c1 | 10.1021/acs.jmedchem.9b00447 | |||
| 134156988 | 154519 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 281 | 7 | 0 | 2 | 3.8 | c1ccc(Cc2ccccc2OCCCN2CCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3984221 | 154519 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 281 | 7 | 0 | 2 | 3.8 | c1ccc(Cc2ccccc2OCCCN2CCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| CHEMBL3990754 | 154519 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 281 | 7 | 0 | 2 | 3.8 | c1ccc(Cc2ccccc2OCCCN2CCC2)cc1 | 10.1021/acs.jmedchem.6b00981 | |||
| 135398737 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm070516u | |||
| 38 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm070516u | |||
| 722 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm070516u | |||
| CHEMBL42 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm070516u | |||
| DB00363 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1021/jm070516u | |||
| 2389 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm070516u | |||
| 5073 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm070516u | |||
| 96 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm070516u | |||
| CHEMBL85 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm070516u | |||
| DB00734 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm070516u | |||
| 22397436 | 82237 | 0 | None | 6 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 510 | 5 | 0 | 5 | 4.5 | CS(=O)(=O)c1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171019 | 82237 | 0 | None | 6 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 510 | 5 | 0 | 5 | 4.5 | CS(=O)(=O)c1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| 17963183 | 82262 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 545 | 5 | 1 | 5 | 5.1 | O=C(NS(=O)(=O)c1cccc(Cl)c1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171043 | 82262 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 545 | 5 | 1 | 5 | 5.1 | O=C(NS(=O)(=O)c1cccc(Cl)c1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.124 | |||
| 44267108 | 98345 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 366 | 0 | 0 | 2 | 4.6 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(C)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL275109 | 98345 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 366 | 0 | 0 | 2 | 4.6 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(C)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 120445 | 202064 | 4 | None | 16 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 253 | 6 | 0 | 1 | 4.2 | CN(C)CCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL608689 | 202064 | 4 | None | 16 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 253 | 6 | 0 | 1 | 4.2 | CN(C)CCCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| 9998826 | 120477 | 0 | None | -69 | 5 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.1 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccccc1 | 10.1021/jm950759z | |||
| CHEMBL354210 | 120477 | 0 | None | -69 | 5 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 363 | 5 | 1 | 3 | 3.1 | O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccccc1 | 10.1021/jm950759z | |||
| 44266960 | 97156 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 380 | 1 | 0 | 3 | 4.1 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(C=O)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| CHEMBL268022 | 97156 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 380 | 1 | 0 | 3 | 4.1 | CC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(C=O)cnc32)CC1 | 10.1016/S0960-894X(00)80290-5 | |||
| 69082816 | 74937 | 0 | None | -4168 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 431 | 5 | 0 | 3 | 4.1 | C[C@H]1CCCN1C(=O)c1ccc(-c2ccc3c(c2)CCN(CCN2CCCC2)C3=O)cc1 | 10.1021/jm300011d | |||
| CHEMBL2031877 | 74937 | 0 | None | -4168 | 3 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 431 | 5 | 0 | 3 | 4.1 | C[C@H]1CCCN1C(=O)c1ccc(-c2ccc3c(c2)CCN(CCN2CCCC2)C3=O)cc1 | 10.1021/jm300011d | |||
| 145986752 | 167276 | 0 | None | -16 | 17 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 562 | 10 | 1 | 5 | 7.3 | COc1ccc(N(CCCCN2CCC(O)(c3ccc(Cl)c(C(F)(F)F)c3)CC2)c2ccc(OC)cc2)cc1 | 10.1016/j.bmcl.2018.10.036 | |||
| CHEMBL4293307 | 167276 | 0 | None | -16 | 17 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 562 | 10 | 1 | 5 | 7.3 | COc1ccc(N(CCCCN2CCC(O)(c3ccc(Cl)c(C(F)(F)F)c3)CC2)c2ccc(OC)cc2)cc1 | 10.1016/j.bmcl.2018.10.036 | |||
| 56963799 | 74895 | 0 | None | -17782 | 10 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 378 | 6 | 0 | 5 | 4.6 | C[C@@H]1CCCN1CCc1cc2cc(C(=O)c3ccc([N+](=O)[O-])cc3)ccc2o1 | 10.1021/jm201690h | |||
| CHEMBL2031737 | 74895 | 0 | None | -17782 | 10 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 378 | 6 | 0 | 5 | 4.6 | C[C@@H]1CCCN1CCc1cc2cc(C(=O)c3ccc([N+](=O)[O-])cc3)ccc2o1 | 10.1021/jm201690h | |||
| 141485893 | 175738 | 0 | None | - | 1 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 317 | 5 | 0 | 4 | 1.3 | CN1CCN(CCCOc2ccc3c(c2)C(=O)N(C)CC3)CC1 | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4583068 | 175738 | 0 | None | - | 1 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 317 | 5 | 0 | 4 | 1.3 | CN1CCN(CCCOc2ccc3c(c2)C(=O)N(C)CC3)CC1 | 10.1016/j.bmcl.2019.04.015 | |||
| 45833388 | 69024 | 7 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 274 | 4 | 0 | 7 | 1.3 | CN(C)CCSc1nc2ccccc2c2nnnn12 | 10.1021/jm2011589 | |||
| CHEMBL1923525 | 69024 | 7 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 274 | 4 | 0 | 7 | 1.3 | CN(C)CCSc1nc2ccccc2c2nnnn12 | 10.1021/jm2011589 | |||
| 2537688 | 69025 | 3 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 264 | 3 | 1 | 6 | 0.8 | OCCN1CCN(c2ncnc3sccc23)CC1 | 10.1021/jm2011589 | |||
| CHEMBL1923526 | 69025 | 3 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 264 | 3 | 1 | 6 | 0.8 | OCCN1CCN(c2ncnc3sccc23)CC1 | 10.1021/jm2011589 | |||
| 168294776 | 193026 | 0 | None | -11 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 366 | 7 | 3 | 4 | 2.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCC(C)C2CCCCC2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5209479 | 193026 | 0 | None | -11 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 366 | 7 | 3 | 4 | 2.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCC(C)C2CCCCC2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222831 | 193026 | 0 | None | -11 | 4 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 366 | 7 | 3 | 4 | 2.6 | Cc1nnc(CCCN/C(N)=N/C(=O)NCC(C)C2CCCCC2)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 164609017 | 184425 | 0 | None | -125 | 6 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 416 | 10 | 4 | 4 | 3.2 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)CCCc1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4846201 | 184425 | 0 | None | -125 | 6 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 416 | 10 | 4 | 4 | 3.2 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)CCCc1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 44304211 | 102197 | 0 | None | -6918 | 3 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.9 | CC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL302829 | 102197 | 0 | None | -6918 | 3 | Human | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 373 | 9 | 1 | 5 | 1.9 | CC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 129103313 | 166753 | 0 | None | -70 | 6 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 447 | 6 | 0 | 4 | 5.0 | O=C1CCc2cc(CCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc3c2N1CC3 | 10.1021/acs.jmedchem.8b01096 | |||
| CHEMBL4283548 | 166753 | 0 | None | -70 | 6 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 447 | 6 | 0 | 4 | 5.0 | O=C1CCc2cc(CCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc3c2N1CC3 | 10.1021/acs.jmedchem.8b01096 | |||
| 145980875 | 166707 | 0 | None | -5 | 11 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 443 | 7 | 1 | 2 | 6.2 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCCCc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| CHEMBL4282702 | 166707 | 0 | None | -5 | 11 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 443 | 7 | 1 | 2 | 6.2 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCCCc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| 145992489 | 166977 | 0 | None | -2 | 12 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 535 | 7 | 1 | 2 | 7.8 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC=C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| CHEMBL4287623 | 166977 | 0 | None | -2 | 12 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 535 | 7 | 1 | 2 | 7.8 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC=C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| 95104704 | 162138 | 1 | None | 2 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 344 | 6 | 1 | 4 | 3.1 | CCOc1ccc([C@H](O)CN2CCN(c3ccccc3F)CC2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| CHEMBL4161676 | 162138 | 1 | None | 2 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 344 | 6 | 1 | 4 | 3.1 | CCOc1ccc([C@H](O)CN2CCN(c3ccccc3F)CC2)cc1 | 10.1021/acs.jmedchem.8b00718 | |||
| 14885628 | 119434 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 336 | 0 | 0 | 2 | 3.8 | CC(=O)N1CCC(=C2c3ccc(F)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL344942 | 119434 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 336 | 0 | 0 | 2 | 3.8 | CC(=O)N1CCC(=C2c3ccc(F)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 25216680 | 74944 | 0 | None | -7244 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 3.6 | CCNC(=O)c1ccc(-c2ccc3c(c2)CCN(CCN2CCC[C@H]2C)C3=O)cc1 | 10.1021/jm300011d | |||
| CHEMBL2031884 | 74944 | 0 | None | -7244 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 3.6 | CCNC(=O)c1ccc(-c2ccc3c(c2)CCN(CCN2CCC[C@H]2C)C3=O)cc1 | 10.1021/jm300011d | |||
| 44304378 | 163272 | 0 | None | -35 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 423 | 11 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cccnc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL418658 | 163272 | 0 | None | -35 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 423 | 11 | 0 | 5 | 4.1 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cccnc3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 56852956 | 112043 | 1 | None | -186 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 339 | 5 | 0 | 6 | 2.8 | c1cnc(N2CCN(CCCc3nc4ccccc4s3)CC2)nc1 | 10.1016/j.bmc.2014.04.026 | |||
| CHEMBL3289656 | 112043 | 1 | None | -186 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 339 | 5 | 0 | 6 | 2.8 | c1cnc(N2CCN(CCCc3nc4ccccc4s3)CC2)nc1 | 10.1016/j.bmc.2014.04.026 | |||
| 168277996 | 192846 | 0 | None | -60 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5173373 | 192846 | 0 | None | -60 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221736 | 192846 | 0 | None | -60 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 380 | 4 | 4 | 4 | 3.3 | Cc1nc(N)sc1-c1cccc(N/C(N)=N/C(=O)NCc2ccccc2)c1 | 10.1021/acs.jmedchem.1c00692 | |||
| 46216771 | 202165 | 0 | None | -3 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 327 | 6 | 1 | 1 | 4.9 | c1ccc(CCCNCC2c3ccccc3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2009.12.064 | |||
| CHEMBL609328 | 202165 | 0 | None | -3 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 327 | 6 | 1 | 1 | 4.9 | c1ccc(CCCNCC2c3ccccc3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2009.12.064 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm030480f | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm030480f | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm030480f | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm030480f | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 10.1021/jm030480f | |||
| 56852956 | 112043 | 1 | None | -186 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 339 | 5 | 0 | 6 | 2.8 | c1cnc(N2CCN(CCCc3nc4ccccc4s3)CC2)nc1 | 10.1016/j.bmc.2014.04.026 | |||
| CHEMBL3289656 | 112043 | 1 | None | -186 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 339 | 5 | 0 | 6 | 2.8 | c1cnc(N2CCN(CCCc3nc4ccccc4s3)CC2)nc1 | 10.1016/j.bmc.2014.04.026 | |||
| 49841719 | 69737 | 0 | None | -1513 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 2 | 1 | 6 | 2.2 | CN1CCN(c2nc(N)nc3cc(-c4ccoc4)ccc23)CC1 | 10.1016/j.bmcl.2011.10.104 | |||
| CHEMBL1935571 | 69737 | 0 | None | -1513 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 2 | 1 | 6 | 2.2 | CN1CCN(c2nc(N)nc3cc(-c4ccoc4)ccc23)CC1 | 10.1016/j.bmcl.2011.10.104 | |||
| 127051015 | 140874 | 0 | None | -27 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 283 | 5 | 0 | 1 | 4.2 | Fc1ccc(CCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818128 | 140874 | 0 | None | -27 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 283 | 5 | 0 | 1 | 4.2 | Fc1ccc(CCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819731 | 140874 | 0 | None | -27 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 283 | 5 | 0 | 1 | 4.2 | Fc1ccc(CCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 16655023 | 107441 | 2 | None | -60 | 7 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 481 | 7 | 0 | 7 | 3.7 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccc(F)cc4)CC3)[C@@H]1CO2 | 10.1016/j.bmc.2007.03.053 | |||
| CHEMBL318235 | 107441 | 2 | None | -60 | 7 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 481 | 7 | 0 | 7 | 3.7 | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccc(F)cc4)CC3)[C@@H]1CO2 | 10.1016/j.bmc.2007.03.053 | |||
| 44304287 | 202898 | 0 | None | -4 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 428 | 11 | 0 | 5 | 4.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cccs3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL62726 | 202898 | 0 | None | -4 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 428 | 11 | 0 | 5 | 4.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3cccs3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 132356 | 14677 | 1 | None | - | 1 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL1205688 | 14677 | 1 | None | - | 1 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL133778 | 14677 | 1 | None | - | 1 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 44333988 | 4535 | 0 | None | -199 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 367 | 8 | 1 | 5 | 2.6 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3cccnc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL102331 | 4535 | 0 | None | -199 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 367 | 8 | 1 | 5 | 2.6 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3cccnc3)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44304037 | 102693 | 0 | None | -204 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 362 | 9 | 0 | 5 | 3.2 | CCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL304714 | 102693 | 0 | None | -204 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 362 | 9 | 0 | 5 | 3.2 | CCCC(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 127051015 | 140874 | 0 | None | -27 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 283 | 5 | 0 | 1 | 4.2 | Fc1ccc(CCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818128 | 140874 | 0 | None | -27 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 283 | 5 | 0 | 1 | 4.2 | Fc1ccc(CCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819731 | 140874 | 0 | None | -27 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 283 | 5 | 0 | 1 | 4.2 | Fc1ccc(CCCCN2CCc3ccccc3C2)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 24759623 | 96349 | 20 | None | -18 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 318 | 3 | 0 | 4 | 3.0 | CN1CCN(c2nc3ccccc3nc2Cc2ccccc2)CC1 | 10.1021/jm7014217 | |||
| CHEMBL261551 | 96349 | 20 | None | -18 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 318 | 3 | 0 | 4 | 3.0 | CN1CCN(c2nc3ccccc3nc2Cc2ccccc2)CC1 | 10.1021/jm7014217 | |||
| 168294449 | 193018 | 0 | None | -74 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 367 | 7 | 4 | 5 | 1.9 | CC(CNC(=O)/N=C(\N)NCCCc1nnc(N)s1)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5204599 | 193018 | 0 | None | -74 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 367 | 7 | 4 | 5 | 1.9 | CC(CNC(=O)/N=C(\N)NCCCc1nnc(N)s1)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222793 | 193018 | 0 | None | -74 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 367 | 7 | 4 | 5 | 1.9 | CC(CNC(=O)/N=C(\N)NCCCc1nnc(N)s1)C1CCCCC1 | 10.1021/acs.jmedchem.1c00692 | |||
| 162646011 | 179735 | 0 | None | -109 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 347 | 6 | 0 | 4 | 3.8 | c1ccc2cc(OCCCN3CCN(c4ccncc4)CC3)ccc2c1 | 10.1016/j.ejmech.2020.113041 | |||
| CHEMBL4744110 | 179735 | 0 | None | -109 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 347 | 6 | 0 | 4 | 3.8 | c1ccc2cc(OCCCN3CCN(c4ccncc4)CC3)ccc2c1 | 10.1016/j.ejmech.2020.113041 | |||
| 151221 | 202395 | 11 | None | 21 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 239 | 5 | 0 | 1 | 3.8 | CN(C)CCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| CHEMBL610739 | 202395 | 11 | None | 21 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 239 | 5 | 0 | 1 | 3.8 | CN(C)CCC(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.08.016 | |||
| 11659397 | 195282 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 297 | 5 | 0 | 4 | 3.4 | CN(C)CCc1sc2ccccc2c1Cc1cnccn1 | 10.1021/jm900933k | |||
| CHEMBL551340 | 195282 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 297 | 5 | 0 | 4 | 3.4 | CN(C)CCc1sc2ccccc2c1Cc1cnccn1 | 10.1021/jm900933k | |||
| 45267774 | 196207 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 416 | 5 | 0 | 6 | 4.1 | CN(c1ncccn1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| CHEMBL561489 | 196207 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 416 | 5 | 0 | 6 | 4.1 | CN(c1ncccn1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2009.05.086 | |||
| 44334556 | 107267 | 0 | None | -128 | 3 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 449 | 10 | 3 | 7 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL316968 | 107267 | 0 | None | -128 | 3 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 449 | 10 | 3 | 7 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44335172 | 5097 | 0 | None | -3 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 374 | 7 | 0 | 5 | 4.0 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccsc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105567 | 5097 | 0 | None | -3 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 374 | 7 | 0 | 5 | 4.0 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccsc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168286141 | 192924 | 0 | None | -3 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5192993 | 192924 | 0 | None | -3 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222231 | 192924 | 0 | None | -3 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 450 | 8 | 4 | 4 | 4.8 | Cc1nc(N)sc1-c1ccc(N/C(N)=N/C(=O)NCC(C)CCCc2ccccc2)cc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 29298 | 203450 | 1 | None | -794 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 297 | 5 | 1 | 3 | 3.9 | CN(C)CCCNc1c2c(nc3ccccc13)CCCCC2 | 10.1016/s0960-894x(03)00356-1 | |||
| CHEMBL65849 | 203450 | 1 | None | -794 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 297 | 5 | 1 | 3 | 3.9 | CN(C)CCCNc1c2c(nc3ccccc13)CCCCC2 | 10.1016/s0960-894x(03)00356-1 | |||
| 57390224 | 67877 | 0 | None | -38 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 503 | 8 | 1 | 5 | 4.7 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| CHEMBL1910379 | 67877 | 0 | None | -38 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 503 | 8 | 1 | 5 | 4.7 | COc1ccc(CN(CCN2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c2ccccn2)cc1 | 10.1016/j.bmcl.2011.09.001 | |||
| 44335483 | 5293 | 0 | None | -257 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 336 | 6 | 1 | 4 | 3.5 | N#Cc1ccc(-c2ccc(OCCCN3CCCC(O)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL106596 | 5293 | 0 | None | -257 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 336 | 6 | 1 | 4 | 3.5 | N#Cc1ccc(-c2ccc(OCCCN3CCCC(O)C3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 164614549 | 184943 | 0 | None | -549 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 340 | 9 | 4 | 4 | 2.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4853668 | 184943 | 0 | None | -549 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 340 | 9 | 4 | 4 | 2.2 | CCCCCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C | 10.1016/j.ejmech.2021.113190 | |||
| 164626153 | 186378 | 0 | None | -3801 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 378 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1cccc(F)c1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4875600 | 186378 | 0 | None | -3801 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 378 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(C)c1cccc(F)c1 | 10.1016/j.ejmech.2021.113190 | |||
| 164611807 | 184984 | 0 | None | -229 | 4 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 376 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)N[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4854278 | 184984 | 0 | None | -229 | 4 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 376 | 6 | 4 | 4 | 2.5 | Cc1nc(N)sc1CCCN/C(N)=N/C(=S)N[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | nan | |||
| 44207909 | 16699 | 3 | None | -2 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 407 | 7 | 1 | 4 | 2.6 | O=C(Cc1ccccc1)NC1CCN(CCCN2C(=O)COc3ccccc32)CC1 | 10.1021/jm100697g | |||
| CHEMBL1242923 | 16699 | 3 | None | -2 | 9 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 407 | 7 | 1 | 4 | 2.6 | O=C(Cc1ccccc1)NC1CCN(CCCN2C(=O)COc3ccccc32)CC1 | 10.1021/jm100697g | |||
| 10403711 | 96333 | 33 | None | -4168 | 9 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 320 | 3 | 4 | 9 | -1.7 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CC2)[C@@H](O)[C@H]1O | 10.1021/acs.jmedchem.8b01662 | |||
| CHEMBL261482 | 96333 | 33 | None | -4168 | 9 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 320 | 3 | 4 | 9 | -1.7 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CC2)[C@@H](O)[C@H]1O | 10.1021/acs.jmedchem.8b01662 | |||
| 44591099 | 176190 | 0 | None | -295 | 6 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 494 | 10 | 0 | 3 | 7.0 | CN(CCC=C1c2ccccc2CCc2ccccc21)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| CHEMBL459350 | 176190 | 0 | None | -295 | 6 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 494 | 10 | 0 | 3 | 7.0 | CN(CCC=C1c2ccccc2CCc2ccccc21)Cc1ccc(OCCCN2CCCCC2)cc1 | 10.1016/j.bmcl.2008.09.012 | |||
| 44304259 | 100615 | 0 | None | -2 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 462 | 11 | 0 | 5 | 5.4 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3sccc3Cl)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL291882 | 100615 | 0 | None | -2 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 462 | 11 | 0 | 5 | 5.4 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3sccc3Cl)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 71072113 | 81262 | 0 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1ccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158774 | 81262 | 0 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 504 | 8 | 1 | 4 | 5.6 | Cc1ccc(C[C@@H](C(=O)O)N2CCC(CN3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)cc1 | 10.1016/j.bmcl.2012.08.103 | |||
| 66615678 | 81268 | 0 | None | -19 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 488 | 8 | 1 | 4 | 5.0 | Cc1cc(Cl)ccc1OC1CCN(CC2CCN([C@@H](Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158780 | 81268 | 0 | None | -19 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 488 | 8 | 1 | 4 | 5.0 | Cc1cc(Cl)ccc1OC1CCN(CC2CCN([C@@H](Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 66615702 | 81275 | 0 | None | -100 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 522 | 8 | 1 | 4 | 5.8 | C[C@](Cc1ccc(F)cc1)(C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158787 | 81275 | 0 | None | -100 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 522 | 8 | 1 | 4 | 5.8 | C[C@](Cc1ccc(F)cc1)(C(=O)O)N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 71456722 | 81281 | 0 | None | -39 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 486 | 8 | 1 | 4 | 4.9 | Cc1cc(F)ccc1OC1CCN(CC2CCN([C@@](C)(Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| CHEMBL2158793 | 81281 | 0 | None | -39 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 486 | 8 | 1 | 4 | 4.9 | Cc1cc(F)ccc1OC1CCN(CC2CCN([C@@](C)(Cc3ccc(F)cc3)C(=O)O)CC2)CC1 | 10.1016/j.bmcl.2012.08.103 | |||
| 127026052 | 137553 | 0 | None | -4 | 19 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 258 | 7 | 1 | 1 | 3.5 | C=CCN(CC=C)CCc1c[nH]c2ccc(F)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| CHEMBL3754496 | 137553 | 0 | None | -4 | 19 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 258 | 7 | 1 | 1 | 3.5 | C=CCN(CC=C)CCc1c[nH]c2ccc(F)cc12 | 10.1016/j.bmcl.2015.12.053 | |||
| 59296073 | 84205 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 483 | 8 | 2 | 6 | 3.0 | N#Cc1cccc(S(=O)(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| CHEMBL2208422 | 84205 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 483 | 8 | 2 | 6 | 3.0 | N#Cc1cccc(S(=O)(=O)NC[C@@H](O)CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)c1 | 10.1016/j.bmcl.2012.09.113 | |||
| 59296077 | 84008 | 0 | None | -5 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 547 | 8 | 3 | 7 | 2.5 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3cc(S(C)(=O)=O)ccc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| CHEMBL2207276 | 84008 | 0 | None | -5 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 547 | 8 | 3 | 7 | 2.5 | Cc1cc(Cl)ccc1OC1CCN(C[C@H](O)CNC(=O)c2c[nH]c(=O)c3cc(S(C)(=O)=O)ccc23)CC1 | 10.1016/j.bmcl.2012.09.112 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 10.1038/nchembio714 | |||
| 71449858 | 82246 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 582 | 9 | 1 | 6 | 4.8 | O=C(O)CCCS(=O)(=O)c1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| CHEMBL2171027 | 82246 | 0 | None | 1 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 582 | 9 | 1 | 6 | 4.8 | O=C(O)CCCS(=O)(=O)c1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3)CC2)c1 | 10.1016/j.bmcl.2012.08.124 | |||
| 11515125 | 8144 | 0 | None | - | 1 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@@H](c1cccnc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1091778 | 8144 | 0 | None | - | 1 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 310 | 5 | 0 | 3 | 4.6 | C[C@@H](c1cccnc1)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 127049855 | 140228 | 0 | None | -13 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@@H]1CC[C@@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3805220 | 140228 | 0 | None | -13 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 368 | 7 | 3 | 4 | 3.1 | N#C/N=C(/NCCSc1ccccc1)NC[C@@H]1CC[C@@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 168282610 | 190916 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 802 | 20 | 5 | 7 | 4.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185281 | 190916 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 802 | 20 | 5 | 7 | 4.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 2199935 | 119215 | 13 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 215 | 5 | 1 | 2 | 2.8 | CNCCCOc1cccc2ccccc12 | 10.1021/jm2011589 | |||
| CHEMBL343324 | 119215 | 13 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 215 | 5 | 1 | 2 | 2.8 | CNCCCOc1cccc2ccccc12 | 10.1021/jm2011589 | |||
| 168282610 | 190916 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 802 | 20 | 5 | 7 | 4.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5185281 | 190916 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 802 | 20 | 5 | 7 | 4.1 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 10517956 | 56255 | 0 | None | -66 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 295 | 5 | 2 | 3 | 3.7 | O=C(Nc1ccc2ccccc2c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16274 | 56255 | 0 | None | -66 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 295 | 5 | 2 | 3 | 3.7 | O=C(Nc1ccc2ccccc2c1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10833949 | 57191 | 0 | None | -645 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 385 | 6 | 2 | 3 | 2.9 | O=C(NCc1ccc(I)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16496 | 57191 | 0 | None | -645 | 2 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 385 | 6 | 2 | 3 | 2.9 | O=C(NCc1ccc(I)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 168290235 | 192968 | 0 | None | -12882 | 20 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 315 | 6 | 4 | 3 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5201074 | 192968 | 0 | None | -12882 | 20 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 315 | 6 | 4 | 3 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222491 | 192968 | 0 | None | -12882 | 20 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 315 | 6 | 4 | 3 | 1.1 | C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 10085839 | 204502 | 0 | None | -251 | 3 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 294 | 7 | 3 | 2 | 2.9 | S=C(NCCCCCc1c[nH]cn1)NC1CCCCC1 | 10.1021/jm00012a025 | |||
| CHEMBL72571 | 204502 | 0 | None | -251 | 3 | Guinea pig | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 294 | 7 | 3 | 2 | 2.9 | S=C(NCCCCCc1c[nH]cn1)NC1CCCCC1 | 10.1021/jm00012a025 | |||
| 164617783 | 184590 | 0 | None | -123 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.8 | CCC(CNC(=O)/N=C(\N)NCCCc1sc(N)nc1C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4848815 | 184590 | 0 | None | -123 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 388 | 8 | 4 | 4 | 2.8 | CCC(CNC(=O)/N=C(\N)NCCCc1sc(N)nc1C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 10541297 | 57549 | 0 | None | -3090 | 2 | Guinea pig | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 287 | 8 | 2 | 3 | 2.7 | O=C(NCCCc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL16639 | 57549 | 0 | None | -3090 | 2 | Guinea pig | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 287 | 8 | 2 | 3 | 2.7 | O=C(NCCCc1ccccc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 10611565 | 98320 | 0 | None | -3235 | 2 | Guinea pig | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 263 | 5 | 2 | 3 | 2.7 | O=C(Nc1ccc(F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| CHEMBL274989 | 98320 | 0 | None | -3235 | 2 | Guinea pig | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 263 | 5 | 2 | 3 | 2.7 | O=C(Nc1ccc(F)cc1)OCCCc1c[nH]cn1 | 10.1021/jm9507688 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 10.1038/nchembio714 | |||
| 16093484 | 98060 | 6 | None | -3 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 229 | 0 | 2 | 3 | 2.6 | CC1NC(N)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
| CHEMBL273170 | 98060 | 6 | None | -3 | 6 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 229 | 0 | 2 | 3 | 2.6 | CC1NC(N)=Nc2ccc(Cl)c(Cl)c21 | 10.1016/j.bmcl.2007.10.080 | |||
| 137645406 | 157902 | 0 | None | 4 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 491 | 8 | 0 | 7 | 5.4 | COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1 | 10.1021/acs.jmedchem.9b00412 | |||
| CHEMBL4084262 | 157902 | 0 | None | 4 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 491 | 8 | 0 | 7 | 5.4 | COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1 | 10.1021/acs.jmedchem.9b00412 | |||
| 46884153 | 8267 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 344 | 5 | 0 | 3 | 5.2 | C[C@@H](c1ncccc1Cl)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092494 | 8267 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 344 | 5 | 0 | 3 | 5.2 | C[C@@H](c1ncccc1Cl)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 53326726 | 57761 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 359 | 7 | 0 | 4 | 4.7 | C[C@H](C1=C(CCN(C)Cc2ccco2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669418 | 57761 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 359 | 7 | 0 | 4 | 4.7 | C[C@H](C1=C(CCN(C)Cc2ccco2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 135398737 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C4MD00578C | |||
| 38 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C4MD00578C | |||
| 722 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C4MD00578C | |||
| CHEMBL42 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C4MD00578C | |||
| DB00363 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1039/C4MD00578C | |||
| 11846300 | 80266 | 3 | None | 2 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL213912 | 80266 | 3 | None | 2 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(C2=Nc3ccc(Cl)cc3Oc3ccccc32)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 46889257 | 7528 | 0 | None | 301 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 350 | 5 | 0 | 5 | 3.2 | COc1ccc(Cn2c(N3CC[C@@H](N(C)C)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2010.03.027 | |||
| CHEMBL1087367 | 7528 | 0 | None | 301 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 350 | 5 | 0 | 5 | 3.2 | COc1ccc(Cn2c(N3CC[C@@H](N(C)C)C3)nc3ccccc32)cc1 | 10.1016/j.bmcl.2010.03.027 | |||
| 11140 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | nan | |||
| 1784 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | nan | |||
| 26388 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | nan | |||
| CHEMBL398615 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | nan | |||
| DB13591 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | nan | |||
| 100 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| 2637 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| 5452 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| CHEMBL479 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| DB00679 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | nan | |||
| 1547484 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 654 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 9072 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL43064 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| DB00568 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | nan | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1016/j.bmc.2008.06.030 | |||
| 49836295 | 18766 | 0 | None | 2 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | |||
| CHEMBL1277935 | 18766 | 0 | None | 2 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 373 | 2 | 1 | 2 | 4.3 | O=C(O)C1=CCCN(C2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 | 10.1021/jm100856p | |||
| 51039225 | 57765 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 359 | 7 | 1 | 4 | 3.8 | C[C@H](C1=C(CCN(C)Cc2ncc[nH]2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669422 | 57765 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 359 | 7 | 1 | 4 | 3.8 | C[C@H](C1=C(CCN(C)Cc2ncc[nH]2)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 46884669 | 8222 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 309 | 6 | 0 | 4 | 3.0 | COc1ccc2c(c1)CC(CCN(C)C)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| CHEMBL1092258 | 8222 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 309 | 6 | 0 | 4 | 3.0 | COc1ccc2c(c1)CC(CCN(C)C)=C2Cc1cnccn1 | 10.1016/j.bmcl.2010.02.055 | |||
| 9979272 | 207058 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1ncccc1CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| CHEMBL91729 | 207058 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 415 | 2 | 0 | 3 | 5.6 | Cc1ncccc1CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/acs.jmedchem.9b00447 | |||
| 57394285 | 70458 | 0 | None | -24 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 378 | 6 | 0 | 3 | 5.2 | Fc1ccc(SCCCN2CCCN(c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| CHEMBL1946125 | 70458 | 0 | None | -24 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 378 | 6 | 0 | 3 | 5.2 | Fc1ccc(SCCCN2CCCN(c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmc.2012.01.022 | |||
| 44334252 | 4548 | 0 | None | -257 | 3 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 449 | 10 | 3 | 7 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@@H](CO)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL102390 | 4548 | 0 | None | -257 | 3 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 449 | 10 | 3 | 7 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@@H](CO)NC(=O)OC(C)(C)C)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 14554123 | 118982 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 0 | 0 | 2 | 5.3 | CC(C)(C)C(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| CHEMBL342455 | 118982 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 394 | 0 | 0 | 2 | 5.3 | CC(C)(C)C(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1021/jm00105a069 | |||
| 44335412 | 107459 | 0 | None | 1 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 413 | 8 | 0 | 6 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc([N+](=O)[O-])cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL318320 | 107459 | 0 | None | 1 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 413 | 8 | 0 | 6 | 3.8 | CCOC(=O)N1CCN(CCCOc2ccc(-c3ccc([N+](=O)[O-])cc3)cc2)CC1 | 10.1016/s0960-894x(02)00648-0 | |||
| 162655663 | 180807 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 308 | 4 | 0 | 2 | 3.4 | CN(C)CCCN1C(=O)c2ccccc2CCc2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| CHEMBL4756695 | 180807 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 308 | 4 | 0 | 2 | 3.4 | CN(C)CCCN1C(=O)c2ccccc2CCc2ccccc21 | 10.1016/j.bmcl.2020.127493 | |||
| 44304284 | 163279 | 0 | None | -20 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 426 | 9 | 0 | 6 | 3.5 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(OC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL418691 | 163279 | 0 | None | -20 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 426 | 9 | 0 | 6 | 3.5 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)c3ccc(OC)cc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304445 | 202988 | 0 | None | -72 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 531 | 14 | 1 | 6 | 5.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL63112 | 202988 | 0 | None | -72 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 531 | 14 | 1 | 6 | 5.3 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304752 | 203212 | 0 | None | -3890 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 459 | 9 | 1 | 6 | 3.1 | C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL64406 | 203212 | 0 | None | -3890 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 459 | 9 | 1 | 6 | 3.1 | C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 127036981 | 137450 | 0 | None | 1 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 399 | 5 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)c3c(n2)-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753621 | 137450 | 0 | None | 1 | 2 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 399 | 5 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)c3c(n2)-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 2421311 | 69032 | 3 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 302 | 5 | 1 | 5 | 3.4 | NCCSc1nc(C2CCCCC2)n(-c2ccccc2)n1 | 10.1021/jm2011589 | |||
| CHEMBL1923534 | 69032 | 3 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 302 | 5 | 1 | 5 | 3.4 | NCCSc1nc(C2CCCCC2)n(-c2ccccc2)n1 | 10.1021/jm2011589 | |||
| 145988693 | 167166 | 0 | None | -32 | 17 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 524 | 7 | 1 | 3 | 7.1 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCN(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| CHEMBL4291048 | 167166 | 0 | None | -32 | 17 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 524 | 7 | 1 | 3 | 7.1 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCN(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2018.10.036 | |||
| 162662985 | 181979 | 0 | None | -1 | 5 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 414 | 5 | 1 | 3 | 5.3 | C[C@H]1CN(CC[C@H]2CC[C@H](NC(=O)c3ccco3)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| CHEMBL4780335 | 181979 | 0 | None | -1 | 5 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 414 | 5 | 1 | 3 | 5.3 | C[C@H]1CN(CC[C@H]2CC[C@H](NC(=O)c3ccco3)CC2)CCc2ccc(Cl)cc21 | 10.1016/j.bmcl.2020.127681 | |||
| 24740862 | 148008 | 0 | None | -4 | 5 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 369 | 6 | 1 | 5 | 4.4 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1F | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL393436 | 148008 | 0 | None | -4 | 5 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 369 | 6 | 1 | 5 | 4.4 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1F | 10.1016/j.bmcl.2009.09.024 | |||
| 127052467 | 140851 | 0 | None | -23 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 304 | 5 | 1 | 1 | 4.5 | c1ccc2c(c1)CCN(CCCCc1c[nH]c3ccccc13)C2 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819494 | 140851 | 0 | None | -23 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 304 | 5 | 1 | 1 | 4.5 | c1ccc2c(c1)CCN(CCCCc1c[nH]c3ccccc13)C2 | 10.1016/j.bmc.2016.05.053 | |||
| 168290238 | 191975 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 769 | 20 | 6 | 8 | 1.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5201159 | 191975 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 769 | 20 | 6 | 8 | 1.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168290238 | 191975 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 769 | 20 | 6 | 8 | 1.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5201159 | 191975 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 769 | 20 | 6 | 8 | 1.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 127052635 | 140207 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 288 | 5 | 3 | 3 | 2.0 | CC(C)CN/C(=N/C#N)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3805003 | 140207 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 288 | 5 | 3 | 3 | 2.0 | CC(C)CN/C(=N/C#N)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 127052467 | 140851 | 0 | None | -23 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 304 | 5 | 1 | 1 | 4.5 | c1ccc2c(c1)CCN(CCCCc1c[nH]c3ccccc13)C2 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3819494 | 140851 | 0 | None | -23 | 7 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 304 | 5 | 1 | 1 | 4.5 | c1ccc2c(c1)CCN(CCCCc1c[nH]c3ccccc13)C2 | 10.1016/j.bmc.2016.05.053 | |||
| 11948707 | 166167 | 0 | None | -2041 | 13 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 373 | 7 | 0 | 8 | 0.6 | COc1cccc(N2CCN(CCCCn3ncc(=O)n(C)c3=O)CC2)c1 | 10.1016/j.bmcl.2006.01.052 | |||
| CHEMBL426317 | 166167 | 0 | None | -2041 | 13 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 373 | 7 | 0 | 8 | 0.6 | COc1cccc(N2CCN(CCCCn3ncc(=O)n(C)c3=O)CC2)c1 | 10.1016/j.bmcl.2006.01.052 | |||
| 44361141 | 32801 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 340 | 3 | 0 | 2 | 4.1 | CC(=O)N(C)CC/C=C1/c2ccc(Cl)cc2CCc2cccnc21 | 10.1021/jm00105a069 | |||
| CHEMBL141432 | 32801 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 340 | 3 | 0 | 2 | 4.1 | CC(=O)N(C)CC/C=C1/c2ccc(Cl)cc2CCc2cccnc21 | 10.1021/jm00105a069 | |||
| 155559236 | 174852 | 0 | None | - | 1 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 318 | 6 | 0 | 4 | 1.8 | CN1CCc2ccc(OCCCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| CHEMBL4563108 | 174852 | 0 | None | - | 1 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 318 | 6 | 0 | 4 | 1.8 | CN1CCc2ccc(OCCCCN3CCOCC3)cc2C1=O | 10.1016/j.bmcl.2019.04.015 | |||
| 27620 | 140818 | 13 | None | -38 | 8 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 297 | 5 | 0 | 2 | 3.8 | O=C(CCCN1CCc2ccccc2C1)c1ccc(F)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| CHEMBL3818994 | 140818 | 13 | None | -38 | 8 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 297 | 5 | 0 | 2 | 3.8 | O=C(CCCN1CCc2ccccc2C1)c1ccc(F)cc1 | 10.1016/j.bmc.2016.05.053 | |||
| 132060763 | 162861 | 0 | None | -3 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 405 | 5 | 0 | 4 | 4.1 | C=C(C)CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)CC3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| CHEMBL4173095 | 162861 | 0 | None | -3 | 8 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 405 | 5 | 0 | 4 | 4.1 | C=C(C)CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)CC3)CC1 | 10.1016/j.ejmech.2018.02.024 | |||
| 135409492 | 169170 | 50 | None | 1 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 328 | 0 | 1 | 5 | 3.5 | Cc1cc2c(s1)Nc1ccccc1N=C2N1CC[N+](C)([O-])CC1 | 10.1016/S0960-894X(96)00567-7 | |||
| CHEMBL440512 | 169170 | 50 | None | 1 | 3 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 328 | 0 | 1 | 5 | 3.5 | Cc1cc2c(s1)Nc1ccccc1N=C2N1CC[N+](C)([O-])CC1 | 10.1016/S0960-894X(96)00567-7 | |||
| 44304307 | 203233 | 0 | None | -134 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 388 | 12 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)CCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64479 | 203233 | 0 | None | -134 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 388 | 12 | 0 | 4 | 4.2 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)CCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 164610648 | 184838 | 0 | None | -87 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 374 | 7 | 4 | 4 | 2.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC[C@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4852212 | 184838 | 0 | None | -87 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 374 | 7 | 4 | 4 | 2.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC[C@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 164609729 | 185098 | 0 | None | -1412 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 2.3 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)N[C@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4856059 | 185098 | 0 | None | -1412 | 6 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 360 | 6 | 4 | 4 | 2.3 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)N[C@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 25218401 | 74945 | 0 | None | -43651 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 431 | 5 | 0 | 3 | 4.1 | C[C@@H]1CCCN1CCN1CCc2cc(-c3ccc(C(=O)N4CCCC4)cc3)ccc2C1=O | 10.1021/jm300011d | |||
| CHEMBL2031885 | 74945 | 0 | None | -43651 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 431 | 5 | 0 | 3 | 4.1 | C[C@@H]1CCCN1CCN1CCc2cc(-c3ccc(C(=O)N4CCCC4)cc3)ccc2C1=O | 10.1021/jm300011d | |||
| 127048828 | 140320 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 288 | 5 | 3 | 3 | 2.0 | CC(C)CN/C(=N/C#N)NC[C@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3806255 | 140320 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 288 | 5 | 3 | 3 | 2.0 | CC(C)CN/C(=N/C#N)NC[C@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 13091268 | 78224 | 0 | None | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL210578 | 78224 | 0 | None | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 13091268 | 78224 | 0 | None | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.03.057 | |||
| CHEMBL210578 | 78224 | 0 | None | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | 10.1016/j.bmcl.2006.03.057 | |||
| 13091268 | 78224 | 0 | None | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL210578 | 78224 | 0 | None | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm0002432 | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm0002432 | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm0002432 | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm0002432 | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 10.1021/jm0002432 | |||
| 71459604 | 83793 | 0 | None | -15 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1cccc(CCN2C3C4C5CC6C7C5C3C7C2(O)C64)c1 | 10.1016/j.bmcl.2012.08.046 | |||
| CHEMBL2205811 | 83793 | 0 | None | -15 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 4 | 1 | 3 | 2.0 | COc1cccc(CCN2C3C4C5CC6C7C5C3C7C2(O)C64)c1 | 10.1016/j.bmcl.2012.08.046 | |||
| 168288775 | 191446 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5193095 | 191446 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168288775 | 191446 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5193095 | 191446 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 9851785 | 51911 | 0 | None | -371 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 606 | 12 | 1 | 8 | 4.4 | C[C@@H](NC(=O)c1ccc(N(C)C)cc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1 | 10.1016/j.bmcl.2003.11.038 | |||
| CHEMBL158595 | 51911 | 0 | None | -371 | 3 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 606 | 12 | 1 | 8 | 4.4 | C[C@@H](NC(=O)c1ccc(N(C)C)cc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1 | 10.1016/j.bmcl.2003.11.038 | |||
| 44334038 | 4462 | 0 | None | -3162 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 453 | 10 | 1 | 6 | 3.0 | N#Cc1cccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)c1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL101748 | 4462 | 0 | None | -3162 | 3 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 453 | 10 | 1 | 6 | 3.0 | N#Cc1cccc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)c1 | 10.1016/s0960-894x(02)00685-6 | |||
| 127036980 | 137346 | 0 | None | 16 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 385 | 4 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCc3ccccc3)c3c(n2)-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3752885 | 137346 | 0 | None | 16 | 2 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 385 | 4 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCc3ccccc3)c3c(n2)-c2ccccc2CC3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 44335405 | 5103 | 0 | None | -75 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 321 | 6 | 1 | 4 | 2.9 | N#Cc1ccc(-c2ccc(OCCCN3CCNCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| CHEMBL105594 | 5103 | 0 | None | -75 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 321 | 6 | 1 | 4 | 2.9 | N#Cc1ccc(-c2ccc(OCCCN3CCNCC3)cc2)cc1 | 10.1016/s0960-894x(02)00648-0 | |||
| 168283097 | 192893 | 0 | None | -66 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 311 | 9 | 4 | 5 | 0.8 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)o1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5186770 | 192893 | 0 | None | -66 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 311 | 9 | 4 | 5 | 0.8 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)o1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222043 | 192893 | 0 | None | -66 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 311 | 9 | 4 | 5 | 0.8 | CCCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)o1 | 10.1021/acs.jmedchem.1c00692 | |||
| 168284480 | 192910 | 0 | None | -66 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 330 | 6 | 4 | 4 | 1.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5197548 | 192910 | 0 | None | -66 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 330 | 6 | 4 | 4 | 1.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5222137 | 192910 | 0 | None | -66 | 4 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 330 | 6 | 4 | 4 | 1.3 | Cc1nc(N)oc1CCCN/C(N)=N/C(=O)NCc1ccccc1 | 10.1021/acs.jmedchem.1c00692 | |||
| 44395530 | 67073 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 546 | 10 | 2 | 5 | 5.0 | NC(=O)N(O)CCC#Cc1ccc(OCCCN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| CHEMBL187264 | 67073 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 546 | 10 | 2 | 5 | 5.0 | NC(=O)N(O)CCC#Cc1ccc(OCCCN2CCN([C@H](c3ccccc3)c3ccc(Cl)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.08.060 | |||
| 10027435 | 47495 | 0 | None | 11 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 463 | 7 | 0 | 5 | 5.0 | Cn1c(=O)sc2cc(CCCCN3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL15456 | 47495 | 0 | None | 11 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 463 | 7 | 0 | 5 | 5.0 | Cn1c(=O)sc2cc(CCCCN3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 21474204 | 54774 | 0 | None | 3 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 394 | 7 | 0 | 4 | 4.9 | Cn1c(=O)sc2cc(CCCCN3CCC(Cc4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| CHEMBL16123 | 54774 | 0 | None | 3 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 394 | 7 | 0 | 4 | 4.9 | Cn1c(=O)sc2cc(CCCCN3CCC(Cc4ccccc4)CC3)ccc21 | 10.1016/s0960-894x(02)00123-3 | |||
| 10382839 | 116552 | 0 | None | - | 1 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 343 | 5 | 1 | 4 | 3.7 | CN(C)CCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00055a013 | |||
| CHEMBL336317 | 116552 | 0 | None | - | 1 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 343 | 5 | 1 | 4 | 3.7 | CN(C)CCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00055a013 | |||
| CHEMBL538750 | 116552 | 0 | None | - | 1 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 343 | 5 | 1 | 4 | 3.7 | CN(C)CCSC1c2ccccc2COc2ccc(C(=O)O)cc21 | 10.1021/jm00055a013 | |||
| 44326422 | 112393 | 0 | None | 1 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 279 | 2 | 1 | 2 | 3.4 | CNCC1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL329685 | 112393 | 0 | None | 1 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 279 | 2 | 1 | 2 | 3.4 | CNCC1C[C@@H]2c3ccccc3Cc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 11500781 | 8203 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1cccnc1[C@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| CHEMBL1092126 | 8203 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 324 | 5 | 0 | 3 | 4.9 | Cc1cccnc1[C@H](C)c1c(CCN(C)C)sc2ccccc12 | 10.1016/j.bmcl.2010.01.134 | |||
| 10851717 | 78477 | 1 | None | 11 | 5 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 299 | 1 | 0 | 4 | 2.9 | CN1CCN([C@@H]2Cn3cccc3Sc3ccccc32)CC1 | 10.1021/jm010982y | |||
| CHEMBL2111782 | 78477 | 1 | None | 11 | 5 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 299 | 1 | 0 | 4 | 2.9 | CN1CCN([C@@H]2Cn3cccc3Sc3ccccc32)CC1 | 10.1021/jm010982y | |||
| 44389292 | 63811 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 605 | 12 | 1 | 6 | 6.5 | CC(C)OC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| CHEMBL180233 | 63811 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 605 | 12 | 1 | 6 | 6.5 | CC(C)OC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 | 10.1016/j.bmcl.2004.12.023 | |||
| 44326358 | 207302 | 0 | None | 3 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 309 | 2 | 0 | 3 | 3.8 | CN(C)CC1C[C@@H]2c3ccccc3OCc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| CHEMBL93321 | 207302 | 0 | None | 3 | 3 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 309 | 2 | 0 | 3 | 3.8 | CN(C)CC1C[C@@H]2c3ccccc3OCc3ccccc3[C@H]2O1 | 10.1016/j.bmcl.2004.03.069 | |||
| 2398 | 954 | 62 | None | -1 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| 2801 | 954 | 62 | None | -1 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| 701 | 954 | 62 | None | -1 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| CHEMBL415 | 954 | 62 | None | -1 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| DB01242 | 954 | 62 | None | -1 | 29 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | nan | |||
| 132356 | 14677 | 1 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL1205688 | 14677 | 1 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| CHEMBL133778 | 14677 | 1 | None | - | 1 | Guinea pig | 8.0 | pKi | = | 8 | Binding | ChEMBL | 473 | 7 | 1 | 4 | 6.1 | O=C(O)c1ccc2c(c1)C(SCCN1CCC(Cc3ccccc3)CC1)c1ccccc1CO2 | 10.1021/jm00055a013 | |||
| 44334521 | 107836 | 0 | None | -85 | 3 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 262 | 6 | 1 | 4 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](N)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL319231 | 107836 | 0 | None | -85 | 3 | Human | 4.1 | pKi | = | 4.1 | Binding | ChEMBL | 262 | 6 | 1 | 4 | 1.7 | CC(=O)c1ccc(OCCCN2CC[C@H](N)C2)cc1 | 10.1016/s0960-894x(02)00685-6 | |||
| 53321511 | 57754 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 375 | 7 | 0 | 3 | 4.9 | C[C@H](C1=C(CCN(C)CCC(F)(F)F)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| CHEMBL1669411 | 57754 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 375 | 7 | 0 | 3 | 4.9 | C[C@H](C1=C(CCN(C)CCC(F)(F)F)Cc2ccccc21)c1cnccn1 | 10.1016/j.bmcl.2010.12.053 | |||
| 44288847 | 165309 | 0 | None | -64 | 5 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 535 | 7 | 2 | 5 | 3.9 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| CHEMBL42335 | 165309 | 0 | None | -64 | 5 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 535 | 7 | 2 | 5 | 3.9 | CC1=C(C(=O)NCCCN2CCC(C#N)(c3ccc(F)cc3C#N)CC2)[C@@H](c2ccc(F)c(F)c2)CC(=O)N1 | 10.1016/s0960-894x(99)00696-4 | |||
| 44334430 | 4454 | 0 | None | -3019 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 428 | 10 | 1 | 5 | 3.1 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccccc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL101691 | 4454 | 0 | None | -3019 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 428 | 10 | 1 | 5 | 3.1 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccccc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44334234 | 109679 | 0 | None | -9120 | 3 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 432 | 10 | 1 | 7 | 1.8 | Cn1cnc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)c1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL322678 | 109679 | 0 | None | -9120 | 3 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 432 | 10 | 1 | 7 | 1.8 | Cn1cnc(S(=O)(=O)N[C@H]2CCN(CCCOc3ccc(C(=O)C4CC4)cc3)C2)c1 | 10.1016/s0960-894x(02)00685-6 | |||
| 10065083 | 32103 | 1 | None | -141 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 328 | 6 | 0 | 5 | 2.4 | O=C(CCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL140872 | 32103 | 1 | None | -141 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 328 | 6 | 0 | 5 | 2.4 | O=C(CCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 10065083 | 32103 | 1 | None | -141 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 328 | 6 | 0 | 5 | 2.4 | O=C(CCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| CHEMBL140872 | 32103 | 1 | None | -141 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 328 | 6 | 0 | 5 | 2.4 | O=C(CCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1 | 10.1016/j.bmc.2011.12.019 | |||
| 168273267 | 190499 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 698 | 17 | 5 | 7 | 2.2 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5179303 | 190499 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 698 | 17 | 5 | 7 | 2.2 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168273267 | 190499 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 698 | 17 | 5 | 7 | 2.2 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5179303 | 190499 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 698 | 17 | 5 | 7 | 2.2 | C[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 25128822 | 187481 | 0 | None | -1698 | 5 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 295 | 1 | 1 | 5 | 1.6 | CN1CCN(c2nc(N)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL494093 | 187481 | 0 | None | -1698 | 5 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 295 | 1 | 1 | 5 | 1.6 | CN1CCN(c2nc(N)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 10201714 | 198714 | 0 | None | -39 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 411 | 10 | 3 | 3 | 4.3 | O=C(NCCCCc1c[nH]cn1)NCCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| CHEMBL58239 | 198714 | 0 | None | -39 | 2 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 411 | 10 | 3 | 3 | 4.3 | O=C(NCCCCc1c[nH]cn1)NCCC(c1ccc(Cl)cc1)c1ccccn1 | 10.1016/s0960-894x(03)00357-3 | |||
| 44334395 | 4961 | 0 | None | -2630 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 446 | 10 | 1 | 5 | 3.2 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(F)cc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL104808 | 4961 | 0 | None | -2630 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 446 | 10 | 1 | 5 | 3.2 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccc(F)cc3)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 46882133 | 5808 | 0 | None | -5 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 478 | 9 | 2 | 7 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NC(=O)C5CCC5)ccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| CHEMBL1078896 | 5808 | 0 | None | -5 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 478 | 9 | 2 | 7 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NC(=O)C5CCC5)ccc4o3)CC2)ccc1OC | 10.1016/j.bmcl.2009.09.024 | |||
| 168294661 | 192402 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 764 | 19 | 6 | 8 | 2.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5207888 | 192402 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 764 | 19 | 6 | 8 | 2.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304079 | 202626 | 0 | None | -128 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 376 | 9 | 0 | 5 | 3.5 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)CC(C)C)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL61231 | 202626 | 0 | None | -128 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 376 | 9 | 0 | 5 | 3.5 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)CC(C)C)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 44304035 | 203309 | 0 | None | -13 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 410 | 9 | 0 | 5 | 3.7 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)Cc3ccccc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL64799 | 203309 | 0 | None | -13 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 410 | 9 | 0 | 5 | 3.7 | CCOC(=O)N1CCN(CCCOc2ccc(C(=O)Cc3ccccc3)cc2)CC1 | 10.1016/s0960-894x(02)00309-8 | |||
| 168294661 | 192402 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 764 | 19 | 6 | 8 | 2.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5207888 | 192402 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 764 | 19 | 6 | 8 | 2.2 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 44304312 | 162787 | 0 | None | -316 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 453 | 10 | 1 | 5 | 2.9 | N[C@H](Cc1ccc(F)cc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL417215 | 162787 | 0 | None | -316 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 453 | 10 | 1 | 5 | 2.9 | N[C@H](Cc1ccc(F)cc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304349 | 202801 | 0 | None | -173 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 566 | 14 | 1 | 7 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](Cc3ccncc3)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL62266 | 202801 | 0 | None | -173 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 566 | 14 | 1 | 7 | 4.9 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@H](Cc3ccncc3)NC(=O)OC(C)(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 127036979 | 137488 | 0 | None | -1 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 399 | 5 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| CHEMBL3753962 | 137488 | 0 | None | -1 | 2 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 399 | 5 | 1 | 5 | 3.6 | CN1CCN(c2nc(NCCc3ccccc3)nc3c2CCc2ccccc2-3)CC1 | 10.1016/j.bmcl.2015.12.035 | |||
| 127052292 | 140266 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 350 | 7 | 3 | 3 | 2.9 | N#C/N=C(/NCCCc1ccccc1)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| CHEMBL3805663 | 140266 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 350 | 7 | 3 | 3 | 2.9 | N#C/N=C(/NCCCc1ccccc1)NC[C@@H]1CC[C@H](c2c[nH]cn2)C1 | 10.1021/acs.jmedchem.6b00120 | |||
| 50878551 | 90745 | 61 | None | -21 | 18 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2013.03.066 | |||
| CHEMBL2391541 | 90745 | 61 | None | -21 | 18 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 270 | 8 | 1 | 2 | 3.4 | C=CCN(CC=C)CCc1c[nH]c2ccc(OC)cc12 | 10.1016/j.bmcl.2013.03.066 | |||
| 44334396 | 4916 | 0 | None | -3467 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 446 | 10 | 1 | 5 | 3.2 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccccc3F)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| CHEMBL104618 | 4916 | 0 | None | -3467 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 446 | 10 | 1 | 5 | 3.2 | O=C(c1ccc(OCCCN2CC[C@H](NS(=O)(=O)c3ccccc3F)C2)cc1)C1CC1 | 10.1016/s0960-894x(02)00685-6 | |||
| 44582676 | 189779 | 0 | None | -7 | 17 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 403 | 9 | 0 | 4 | 4.3 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| CHEMBL516088 | 189779 | 0 | None | -7 | 17 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 403 | 9 | 0 | 4 | 4.3 | COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1 | 10.1016/j.bmc.2009.03.021 | |||
| 168274424 | 190131 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5173453 | 190131 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168297312 | 192526 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5209546 | 192526 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168274424 | 190131 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5173453 | 190131 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 834 | 21 | 7 | 9 | 2.8 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168297312 | 192526 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| CHEMBL5209546 | 192526 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 785 | 21 | 7 | 9 | 0.7 | CC(C)[C@H](NC(=O)CCN1CCC(Oc2ccccc2Cc2ccccc2)CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(N)=O | 10.1021/acs.jmedchem.2c00125 | |||
| 168278471 | 192848 | 0 | None | -229 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 312 | 8 | 4 | 4 | 1.5 | CCCCCNC(=O)/N=C(\N)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5183205 | 192848 | 0 | None | -229 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 312 | 8 | 4 | 4 | 1.5 | CCCCCNC(=O)/N=C(\N)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| CHEMBL5221757 | 192848 | 0 | None | -229 | 6 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 312 | 8 | 4 | 4 | 1.5 | CCCCCNC(=O)/N=C(\N)NCCCc1cnc(N)s1 | 10.1021/acs.jmedchem.1c00692 | |||
| 164622886 | 185942 | 0 | None | -93 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 374 | 7 | 4 | 4 | 2.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| CHEMBL4869389 | 185942 | 0 | None | -93 | 4 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 374 | 7 | 4 | 4 | 2.4 | Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC[C@@H](C)c1ccccc1 | 10.1016/j.ejmech.2021.113190 | |||
| 44304332 | 201344 | 0 | None | -20417 | 3 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 399 | 9 | 1 | 5 | 2.3 | O=C(c1ccc(OCCCN2CCN(C(=O)C[C@H]3CCCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL60435 | 201344 | 0 | None | -20417 | 3 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 399 | 9 | 1 | 5 | 2.3 | O=C(c1ccc(OCCCN2CCN(C(=O)C[C@H]3CCCN3)CC2)cc1)C1CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304719 | 202722 | 0 | None | -20892 | 3 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 425 | 10 | 2 | 6 | 1.5 | N[C@H](Cc1c[nH]cn1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL61792 | 202722 | 0 | None | -20892 | 3 | Human | 4.0 | pKi | = | 4.0 | Binding | ChEMBL | 425 | 10 | 2 | 6 | 1.5 | N[C@H](Cc1c[nH]cn1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 135559170 | 102060 | 0 | None | -1479 | 7 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 391 | 4 | 1 | 5 | 2.5 | COc1ccccc1N1CCN(CC2CN3C(=O)Nc4ccccc4C3=N2)CC1 | 10.1021/jm970159v | |||
| CHEMBL302021 | 102060 | 0 | None | -1479 | 7 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 391 | 4 | 1 | 5 | 2.5 | COc1ccccc1N1CCN(CC2CN3C(=O)Nc4ccccc4C3=N2)CC1 | 10.1021/jm970159v | |||
| 25218143 | 74933 | 0 | None | -5011 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 431 | 6 | 1 | 3 | 4.1 | O=C(NC1CCCC1)c1ccc(-c2ccc3c(c2)CCN(CCN2CCCC2)C3=O)cc1 | 10.1021/jm300011d | |||
| CHEMBL2031873 | 74933 | 0 | None | -5011 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 431 | 6 | 1 | 3 | 4.1 | O=C(NC1CCCC1)c1ccc(-c2ccc3c(c2)CCN(CCN2CCCC2)C3=O)cc1 | 10.1021/jm300011d | |||
| 46216789 | 200328 | 0 | None | -2 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 341 | 7 | 1 | 1 | 5.3 | c1ccc(CCCCNCC2c3ccccc3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2009.12.064 | |||
| CHEMBL597528 | 200328 | 0 | None | -2 | 2 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 341 | 7 | 1 | 1 | 5.3 | c1ccc(CCCCNCC2c3ccccc3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2009.12.064 | |||
| 44304270 | 201248 | 0 | None | -6 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 442 | 11 | 0 | 5 | 5.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccc(C)s3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL60383 | 201248 | 0 | None | -6 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 442 | 11 | 0 | 5 | 5.0 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)c3ccc(C)s3)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 25147771 | 174238 | 0 | None | -3 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 357 | 4 | 1 | 6 | 3.2 | CN1CCN(c2nc(NCc3ccoc3)c3cc(Cl)ccc3n2)CC1 | 10.1021/jm800876b | |||
| CHEMBL454890 | 174238 | 0 | None | -3 | 3 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 357 | 4 | 1 | 6 | 3.2 | CN1CCN(c2nc(NCc3ccoc3)c3cc(Cl)ccc3n2)CC1 | 10.1021/jm800876b | |||
| 44343936 | 11059 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 369 | 1 | 0 | 3 | 3.5 | CC(=O)N1CCCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| CHEMBL117745 | 11059 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 369 | 1 | 0 | 3 | 3.5 | CC(=O)N1CCCN(C2c3ccc(Cl)cc3CCc3cccnc32)CC1 | 10.1016/s0960-894x(98)00626-x | |||
| 44350664 | 118149 | 0 | None | -9 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 351 | 6 | 0 | 2 | 5.2 | O=C(CCCN1C2CCC1CC(c1ccccc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL340816 | 118149 | 0 | None | -9 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 351 | 6 | 0 | 2 | 5.2 | O=C(CCCN1C2CCC1CC(c1ccccc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| CHEMBL553417 | 118149 | 0 | None | -9 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 351 | 6 | 0 | 2 | 5.2 | O=C(CCCN1C2CCC1CC(c1ccccc1)C2)c1ccc(F)cc1 | 10.1016/j.bmc.2008.06.030 | |||
| 13091359 | 113539 | 0 | None | -1380 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.5 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCSc1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| CHEMBL3321790 | 113539 | 0 | None | -1380 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 405 | 6 | 1 | 3 | 5.5 | OC1(c2ccc(Cl)cc2)CC2CCC(C1)N2CCCSc1ccc(F)cc1 | 10.1016/j.bmcl.2014.07.018 | |||
| 44304036 | 96782 | 0 | None | -17 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 360 | 8 | 0 | 5 | 3.0 | C=C(C)C(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| CHEMBL264761 | 96782 | 0 | None | -17 | 3 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 360 | 8 | 0 | 5 | 3.0 | C=C(C)C(=O)c1ccc(OCCCN2CCN(C(=O)OCC)CC2)cc1 | 10.1016/s0960-894x(02)00309-8 | |||
| 1278 | 2150 | 84 | None | -1778 | 8 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1021/jm8007618 | |||
| 1279 | 2150 | 84 | None | -1778 | 8 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1021/jm8007618 | |||
| 4908365 | 2150 | 84 | None | -1778 | 8 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1021/jm8007618 | |||
| CHEMBL129198 | 2150 | 84 | None | -1778 | 8 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 277 | 1 | 1 | 2 | 2.2 | CN1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl | 10.1021/jm8007618 | |||
| 44304743 | 100609 | 0 | None | -57 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 431 | 13 | 1 | 5 | 3.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](N)CC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL291847 | 100609 | 0 | None | -57 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 431 | 13 | 1 | 5 | 3.7 | CCCCCC(=O)c1ccc(OCCCN2CCN(C(=O)[C@@H](N)CC(C)C)CC2)cc1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304064 | 102810 | 0 | None | -323 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 451 | 10 | 2 | 6 | 2.5 | N[C@H](Cc1ccc(O)cc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL305371 | 102810 | 0 | None | -323 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 451 | 10 | 2 | 6 | 2.5 | N[C@H](Cc1ccc(O)cc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 44304313 | 201585 | 0 | None | -426 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 441 | 10 | 1 | 6 | 2.8 | N[C@H](Cc1ccsc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| CHEMBL60559 | 201585 | 0 | None | -426 | 3 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 441 | 10 | 1 | 6 | 2.8 | N[C@H](Cc1ccsc1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)cc2)CC1 | 10.1016/s0960-894x(02)00310-4 | |||
| 11525848 | 114591 | 31 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 479 | 9 | 3 | 7 | 3.3 | COc1cccc(CNC(=O)c2nc3scc(COCc4ccc(C(=O)O)cc4)c3c(=O)[nH]2)c1 | 10.6019/CHEMBL5212743 | |||
| CHEMBL3337894 | 114591 | 31 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 479 | 9 | 3 | 7 | 3.3 | COc1cccc(CNC(=O)c2nc3scc(COCc4ccc(C(=O)O)cc4)c3c(=O)[nH]2)c1 | 10.6019/CHEMBL5212743 | |||
| 130442572 | 171908 | 0 | None | -208 | 24 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 395 | 3 | 0 | 5 | 6.0 | FC(F)(F)c1cc(Oc2nccc3occc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
| CHEMBL4469848 | 171908 | 0 | None | -208 | 24 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 395 | 3 | 0 | 5 | 6.0 | FC(F)(F)c1cc(Oc2nccc3occc23)ccc1-c1cccc2nccn12 | 10.1021/acs.jmedchem.9b00351 | |||
| 1164 | 1630 | 26 | None | - | 12 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| 1626 | 1630 | 26 | None | - | 12 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| 3345 | 1630 | 26 | None | - | 12 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| CHEMBL596 | 1630 | 26 | None | - | 12 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| DB00813 | 1630 | 26 | None | - | 12 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| 2031 | 120433 | 31 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 311 | 8 | 0 | 3 | 3.7 | CCN(CC)CCOC(=O)C(c1ccccc1)c1ccccc1 | None | |||
| CHEMBL353846 | 120433 | 31 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 311 | 8 | 0 | 3 | 3.7 | CCN(CC)CCOC(=O)C(c1ccccc1)c1ccccc1 | None | |||
| 2142 | 3096 | 58 | None | -7585 | 36 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4920903 | 3096 | 58 | None | -7585 | 36 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 502 | 3096 | 58 | None | -7585 | 36 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 5775 | 3096 | 58 | None | -7585 | 36 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| CHEMBL597 | 3096 | 58 | None | -7585 | 36 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| DB00692 | 3096 | 58 | None | -7585 | 36 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4919 | 206234 | 23 | None | - | 8 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | None | |||
| CHEMBL86715 | 206234 | 23 | None | - | 8 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | Drug Central | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | None | |||
| 2284 | 3182 | 33 | None | -10 | 29 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | None | -10 | 29 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | None | -10 | 29 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | None | -10 | 29 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | None | -10 | 29 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 1613 | 2348 | 53 | None | - | 44 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 205 | 2348 | 53 | None | - | 44 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3964 | 2348 | 53 | None | - | 44 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| CHEMBL831 | 2348 | 53 | None | - | 44 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| DB00408 | 2348 | 53 | None | - | 44 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3689 | 102771 | 55 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | None | |||
| CHEMBL1372983 | 102771 | 55 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | None | |||
| CHEMBL305187 | 102771 | 55 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 325 | 5 | 2 | 3 | 3.8 | CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 | None | |||
| 4601 | 206747 | 35 | None | - | 16 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | None | |||
| CHEMBL1201023 | 206747 | 35 | None | - | 16 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | None | |||
| CHEMBL900 | 206747 | 35 | None | - | 16 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | None | |||
| 2865 | 4143 | 73 | None | -1047 | 53 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | None | -1047 | 53 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | None | -1047 | 53 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | None | -1047 | 53 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | None | -1047 | 53 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 100 | 3805 | 58 | None | -23 | 55 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | None | -23 | 55 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | None | -23 | 55 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | None | -23 | 55 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | None | -23 | 55 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2389 | 3331 | 118 | None | -346 | 67 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | None | -346 | 67 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | None | -346 | 67 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | None | -346 | 67 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | None | -346 | 67 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 3191 | 102858 | 97 | None | - | 25 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL305660 | 102858 | 97 | None | - | 25 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 2337 | 3256 | 77 | None | -1 | 62 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | None | -1 | 62 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | None | -1 | 62 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | None | -1 | 62 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | None | -1 | 62 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 1385580 | 29276 | 76 | None | - | 5 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | None | |||
| 4615 | 29276 | 76 | None | - | 5 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | None | |||
| CHEMBL13828 | 29276 | 76 | None | - | 5 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | None | |||
| 1210 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | None | 9 | 21 | Guinea pig | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1227 | 2489 | 43 | None | -5 | 12 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | None | -5 | 12 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | None | -5 | 12 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | None | -5 | 12 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | None | -5 | 12 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | None | -5 | 12 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 11976 | 920 | 59 | None | - | 24 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| 667467 | 920 | 59 | None | - | 24 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| CHEMBL908 | 920 | 59 | None | - | 24 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| DB01239 | 920 | 59 | None | - | 24 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| 1027 | 1576 | 73 | None | -6 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | Guide to Pharmacology | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 18446005 | |||
| 3241 | 1576 | 73 | None | -6 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | Guide to Pharmacology | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 18446005 | |||
| 7176 | 1576 | 73 | None | -6 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | Guide to Pharmacology | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 18446005 | |||
| CHEMBL1106 | 1576 | 73 | None | -6 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | Guide to Pharmacology | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 18446005 | |||
| DB00751 | 1576 | 73 | None | -6 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | Guide to Pharmacology | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | 18446005 | |||
| 10102 | 2546 | 88 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 7612054 | |||
| 1824 | 2546 | 88 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 7612054 | |||
| 65906 | 2546 | 88 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 7612054 | |||
| CHEMBL94454 | 2546 | 88 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 7612054 | |||
| DB12523 | 2546 | 88 | None | - | 1 | Guinea pig | 7.3 | pIC50 | = | 7.3 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 7612054 | |||
| 2200 | 20203 | 61 | None | 26 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | None | |||
| CHEMBL1256819 | 20203 | 61 | None | 26 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | None | |||
| CHEMBL1305 | 20203 | 61 | None | 26 | 2 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | None | |||
| 1605 | 2342 | 117 | None | 1 | 4 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 3957 | 2342 | 117 | None | 1 | 4 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 7216 | 2342 | 117 | None | 1 | 4 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| CHEMBL998 | 2342 | 117 | None | 1 | 4 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| DB00455 | 2342 | 117 | None | 1 | 4 | Guinea pig | 8.2 | pKd | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 2600 | 3779 | 74 | None | -3 | 13 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 2608 | 3779 | 74 | None | -3 | 13 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 5405 | 3779 | 74 | None | -3 | 13 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| CHEMBL17157 | 3779 | 74 | None | -3 | 13 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| DB00342 | 3779 | 74 | None | -3 | 13 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 1971 | 2866 | 38 | None | -1 | 30 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2404 | 2866 | 38 | None | -1 | 30 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 4543 | 2866 | 38 | None | -1 | 30 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| CHEMBL445 | 2866 | 38 | None | -1 | 30 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| DB00540 | 2866 | 38 | None | -1 | 30 | Human | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 11291 | 98796 | 25 | None | 4 | 2 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | None | |||
| CHEMBL278398 | 98796 | 25 | None | 4 | 2 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | None | |||
| 277 | 1301 | 62 | None | 2 | 50 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 2913 | 1301 | 62 | None | 2 | 50 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 765 | 1301 | 62 | None | 2 | 50 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| CHEMBL516 | 1301 | 62 | None | 2 | 50 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| DB00434 | 1301 | 62 | None | 2 | 50 | Guinea pig | 8.1 | pKd | = | 8.1 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 1227 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | None | 2 | 12 | Guinea pig | 8.0 | pKd | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1228 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.0 | pKd | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.0 | pKd | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.0 | pKd | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.0 | pKd | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | None | 5 | 4 | Guinea pig | 8.0 | pKd | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2762 | 3863 | 31 | None | -9 | 2 | Human | 8.0 | pKd | = | 8 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | |||
| 5587 | 3863 | 31 | None | -9 | 2 | Human | 8.0 | pKd | = | 8 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | |||
| 7318 | 3863 | 31 | None | -9 | 2 | Human | 8.0 | pKd | = | 8 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | |||
| CHEMBL1241 | 3863 | 31 | None | -9 | 2 | Human | 8.0 | pKd | = | 8 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | |||
| DB00792 | 3863 | 31 | None | -9 | 2 | Human | 8.0 | pKd | = | 8 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | 14667234 | |||
| 1225 | 1471 | 26 | None | -1 | 22 | Human | 9.0 | pKd | = | 9 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 15093820 | |||
| 3958 | 1471 | 26 | None | -1 | 22 | Human | 9.0 | pKd | = | 9 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 15093820 | |||
| 667477 | 1471 | 26 | None | -1 | 22 | Human | 9.0 | pKd | = | 9 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 15093820 | |||
| CHEMBL860 | 1471 | 26 | None | -1 | 22 | Human | 9.0 | pKd | = | 9 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 15093820 | |||
| DB01142 | 1471 | 26 | None | -1 | 22 | Human | 9.0 | pKd | = | 9 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 15093820 | |||
| None | 216151 | 0 | 3H-Histamine | 8912 | 2 | Guinea pig | 10.5 | pKi | = | 10.5 | Binding | PDSP KiDatabase | 139 | 3 | 2 | 2 | 0.6 | CC(CC1=CN=CN1)NC | None | |||
| None | 216152 | 0 | 3H-Histamine | 60255 | 2 | Guinea pig | 10.5 | pKi | = | 10.5 | Binding | PDSP KiDatabase | 139 | 2 | 2 | 2 | 0.9 | CC(C1=CN=CN1)C(C)N | None | |||
| 277 | 1301 | 62 | 3H-MEPYRAMINE | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 2913 | 1301 | 62 | 3H-MEPYRAMINE | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 765 | 1301 | 62 | 3H-MEPYRAMINE | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| CHEMBL516 | 1301 | 62 | 3H-MEPYRAMINE | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| DB00434 | 1301 | 62 | 3H-MEPYRAMINE | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 1225 | 1471 | 26 | 3H-trans-H2-PAT,(-) | -1 | 22 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-trans-H2-PAT,(-) | -1 | 22 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-trans-H2-PAT,(-) | -1 | 22 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-trans-H2-PAT,(-) | -1 | 22 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-trans-H2-PAT,(-) | -1 | 22 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 10.1 | pKi | = | 10.1 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 277 | 1301 | 62 | 3H-MEPYRAMINE | 2 | 50 | Guinea pig | 10.0 | pKi | = | 10 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 2913 | 1301 | 62 | 3H-MEPYRAMINE | 2 | 50 | Guinea pig | 10.0 | pKi | = | 10 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 765 | 1301 | 62 | 3H-MEPYRAMINE | 2 | 50 | Guinea pig | 10.0 | pKi | = | 10 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| CHEMBL516 | 1301 | 62 | 3H-MEPYRAMINE | 2 | 50 | Guinea pig | 10.0 | pKi | = | 10 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| DB00434 | 1301 | 62 | 3H-MEPYRAMINE | 2 | 50 | Guinea pig | 10.0 | pKi | = | 10 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 1225 | 1471 | 26 | 3H-trans-H2-PAT,(-) | 1 | 22 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 1225 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-trans-H2-PAT,(-) | 1 | 22 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-trans-H2-PAT,(-) | 1 | 22 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-trans-H2-PAT,(-) | 1 | 22 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-trans-H2-PAT,(-) | 1 | 22 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 46780481 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 9903970 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3187365 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3544974 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 180 | 401 | 56 | 3H-PYRILAMINE | 1 | 40 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-PYRILAMINE | 1 | 40 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-PYRILAMINE | 1 | 40 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-PYRILAMINE | 1 | 40 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-PYRILAMINE | 1 | 40 | Guinea pig | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 1225 | 1471 | 26 | 3H-PYRILAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-PYRILAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-PYRILAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-PYRILAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-PYRILAMINE | -1 | 22 | Human | 9.8 | pKi | = | 9.8 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 2726 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 9.7 | pKi | = | 9.7 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 2286 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 4927 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7282 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL643 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01069 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 1225 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.6 | pKi | = | 9.6 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 135 | 2532 | 43 | 3H-MEPYRAMINE | -1 | 58 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-MEPYRAMINE | -1 | 58 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-MEPYRAMINE | -1 | 58 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-MEPYRAMINE | -1 | 58 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-MEPYRAMINE | -1 | 58 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 16667681 | 216153 | 0 | 3H-MEPYRAMINE | 4 | 3 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 1225 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 1816 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 4205 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 7241 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| CHEMBL654 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| DB00370 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 135398745 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 9.5 | pKi | = | 9.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 135 | 2532 | 43 | 3H-doxepin | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-doxepin | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-doxepin | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-doxepin | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-doxepin | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1225 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-MEPYRAMINE | -1 | 22 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 135 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1210 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | 3H-PYRILAMINE | 9 | 21 | Guinea pig | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 1225 | 1471 | 26 | 3H-doxepin | -1 | 22 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-doxepin | -1 | 22 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-doxepin | -1 | 22 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-doxepin | -1 | 22 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-doxepin | -1 | 22 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 180 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 1210 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | 3H-MEPYRAMINE | 9 | 21 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1225 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-MEPYRAMINE | 1 | 22 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1816 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 1816 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 4205 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 4205 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 7241 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 7241 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| CHEMBL654 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| CHEMBL654 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| DB00370 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| DB00370 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| None | 216141 | 0 | 3H-Histamine | -4 | 6 | Guinea pig | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 125 | 2 | 2 | 2 | 0.3 | CC(CC1=CN=CN1)N | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.3 | pKi | = | 9.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 72287 | 61061 | 38 | 3H-doxepin | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 328 | 5 | 0 | 4 | 4.5 | COc1ccc2c(c1)N(C[C@H](C)CN(C)C)c1ccccc1S2 | None | |||
| CHEMBL1764 | 61061 | 38 | 3H-doxepin | 6 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 328 | 5 | 0 | 4 | 4.5 | COc1ccc2c(c1)N(C[C@H](C)CN(C)C)c1ccccc1S2 | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 103 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 2875 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 5736 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL285802 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB09225 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 1816 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 4205 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 7241 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| CHEMBL654 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| DB00370 | 2540 | 102 | 3H-MEPYRAMINE | 3 | 18 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 180 | 401 | 56 | 3H-doxepin | -1 | 40 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-doxepin | -1 | 40 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-doxepin | -1 | 40 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-doxepin | -1 | 40 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-doxepin | -1 | 40 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 1228 | 3866 | 34 | 3H-trans-H2-PAT,(-) | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-trans-H2-PAT,(-) | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-trans-H2-PAT,(-) | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-trans-H2-PAT,(-) | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-trans-H2-PAT,(-) | 5 | 4 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 90475904 | 216022 | 0 | 3H-trans-H2-PAT,(-) | 6 | 6 | Guinea pig | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 | None | |||
| 1225 | 1471 | 26 | 3H-MEPYRAMINE | -2 | 22 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | 3H-MEPYRAMINE | -2 | 22 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | 3H-MEPYRAMINE | -2 | 22 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | 3H-MEPYRAMINE | -2 | 22 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | 3H-MEPYRAMINE | -2 | 22 | Rat | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3246155 | 215962 | 0 | 3H-MEPYRAMINE | -3 | 16 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 307 | 4 | 0 | 2 | 4.4 | CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| 1227 | 2489 | 43 | 3H-trans-H2-PAT,(-) | 2 | 12 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-trans-H2-PAT,(-) | 2 | 12 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-trans-H2-PAT,(-) | 2 | 12 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-trans-H2-PAT,(-) | 2 | 12 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-trans-H2-PAT,(-) | 2 | 12 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-trans-H2-PAT,(-) | 2 | 12 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4011 | 82408 | 49 | 3H-doxepin | 6 | 24 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | None | |||
| CHEMBL21731 | 82408 | 49 | 3H-doxepin | 6 | 24 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | None | |||
| 2247 | 505 | 81 | 3H-PYRILAMINE | 3 | 42 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 2247 | 505 | 81 | 3H-PYRILAMINE | -4 | 42 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 249 | 505 | 81 | 3H-PYRILAMINE | 3 | 42 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 249 | 505 | 81 | 3H-PYRILAMINE | -4 | 42 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 2603 | 505 | 81 | 3H-PYRILAMINE | 3 | 42 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 2603 | 505 | 81 | 3H-PYRILAMINE | -4 | 42 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| CHEMBL296419 | 505 | 81 | 3H-PYRILAMINE | 3 | 42 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| CHEMBL296419 | 505 | 81 | 3H-PYRILAMINE | -4 | 42 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| DB00637 | 505 | 81 | 3H-PYRILAMINE | 3 | 42 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| DB00637 | 505 | 81 | 3H-PYRILAMINE | -4 | 42 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 565544 | 109743 | 11 | 3H-Histamine | 354 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 125 | 2 | 2 | 2 | 0.5 | CC(CN)c1cnc[nH]1 | None | |||
| CHEMBL322988 | 109743 | 11 | 3H-Histamine | 354 | 2 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 125 | 2 | 2 | 2 | 0.5 | CC(CN)c1cnc[nH]1 | None | |||
| 5281878 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5281881 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 948 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 968 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL42055 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL54661 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00875 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 46780481 | 107531 | 20 | 3H-PYRILAMINE | -5 | 53 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 9903970 | 107531 | 20 | 3H-PYRILAMINE | -5 | 53 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3187365 | 107531 | 20 | 3H-PYRILAMINE | -5 | 53 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3544974 | 107531 | 20 | 3H-PYRILAMINE | -5 | 53 | Guinea pig | 9.1 | pKi | = | 9.1 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 180 | 401 | 56 | 3H-PYRILAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-PYRILAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-PYRILAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-PYRILAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-PYRILAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 1400 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 3658 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 7199 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 91513 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL896 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00557 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 135 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 1227 | 2489 | 43 | 3H-trans-H2-PAT,(-) | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-trans-H2-PAT,(-) | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-trans-H2-PAT,(-) | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-trans-H2-PAT,(-) | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-trans-H2-PAT,(-) | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-trans-H2-PAT,(-) | -2 | 12 | Human | 9.0 | pKi | = | 9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 180 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-MEPYRAMINE | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 3246155 | 215962 | 0 | 3H-doxepin | -3 | 16 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 307 | 4 | 0 | 2 | 4.4 | CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| 1228 | 3866 | 34 | 3H-trans-H2-PAT,(-) | -5 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-trans-H2-PAT,(-) | -5 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-trans-H2-PAT,(-) | -5 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-trans-H2-PAT,(-) | -5 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-trans-H2-PAT,(-) | -5 | 4 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 180 | 401 | 56 | UNDEFINED | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | UNDEFINED | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | UNDEFINED | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | UNDEFINED | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | UNDEFINED | -1 | 40 | Human | 9.0 | pKi | = | 9.0 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | 5 | 4 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 16667681 | 216153 | 0 | 3H-MEPYRAMINE | 4 | 3 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 135398737 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | 2 | 12 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2749 | 344 | 40 | 3H-MEPYRAMINE | -1 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 5574 | 344 | 40 | 3H-MEPYRAMINE | -1 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7237 | 344 | 40 | 3H-MEPYRAMINE | -1 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL829 | 344 | 40 | 3H-MEPYRAMINE | -1 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01246 | 344 | 40 | 3H-MEPYRAMINE | -1 | 2 | Rat | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 3246155 | 215962 | 0 | 3H-MEPYRAMINE | -5 | 16 | Guinea pig | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 307 | 4 | 0 | 2 | 4.4 | CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| 5584 | 203211 | 44 | 3H-doxepin | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 294 | 4 | 0 | 2 | 4.1 | CC(CN(C)C)CN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL644 | 203211 | 44 | 3H-doxepin | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | PDSP KiDatabase | 294 | 4 | 0 | 2 | 4.1 | CC(CN(C)C)CN1c2ccccc2CCc2ccccc21 | None | |||
| None | 216175 | 0 | 3H-MEPYRAMINE | - | 1 | Rat | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 296 | 3 | 0 | 3 | 4.4 | C1CCN(C1)CCN2C3=CC=CC=C3SC4=CC=CC=C42 | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 135398737 | 958 | 93 | 3H-trans-H2-PAT,(-) | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-trans-H2-PAT,(-) | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-trans-H2-PAT,(-) | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-trans-H2-PAT,(-) | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-trans-H2-PAT,(-) | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 180 | 401 | 56 | 3H-MEPYRAMINE | 1 | 40 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-MEPYRAMINE | 1 | 40 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-MEPYRAMINE | 1 | 40 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-MEPYRAMINE | 1 | 40 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-MEPYRAMINE | 1 | 40 | Guinea pig | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 1816 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 4205 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 7241 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| CHEMBL654 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| DB00370 | 2540 | 102 | 3H-PYRILAMINE | -3 | 18 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 135398737 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 4011 | 82408 | 49 | UNDEFINED | 6 | 24 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | None | |||
| CHEMBL21731 | 82408 | 49 | UNDEFINED | 6 | 24 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | None | |||
| 135 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 135 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1524 | 2181 | 96 | 3H-MEPYRAMINE | -2 | 52 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 197 | 2181 | 96 | 3H-MEPYRAMINE | -2 | 52 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 3822 | 2181 | 96 | 3H-MEPYRAMINE | -2 | 52 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 88 | 2181 | 96 | 3H-MEPYRAMINE | -2 | 52 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| CHEMBL51 | 2181 | 96 | 3H-MEPYRAMINE | -2 | 52 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| DB12465 | 2181 | 96 | 3H-MEPYRAMINE | -2 | 52 | Human | 8.8 | pKi | = | 8.8 | Binding | PDSP KiDatabase | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1712 | 2492 | 43 | 3H-doxepin | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 4078 | 2492 | 43 | 3H-doxepin | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 7227 | 2492 | 43 | 3H-doxepin | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| CHEMBL1088 | 2492 | 43 | 3H-doxepin | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| DB00933 | 2492 | 43 | 3H-doxepin | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 1712 | 2492 | 43 | UNDEFINED | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 4078 | 2492 | 43 | UNDEFINED | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 7227 | 2492 | 43 | UNDEFINED | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| CHEMBL1088 | 2492 | 43 | UNDEFINED | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| DB00933 | 2492 | 43 | UNDEFINED | 1 | 22 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-MEPYRAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 90475904 | 216022 | 0 | 3H-MEPYRAMINE | 6 | 6 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 | None | |||
| 1222 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2678 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 581 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1000 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00341 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1170 | 1633 | 75 | 3H-MEPYRAMINE | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 3348 | 1633 | 75 | 3H-MEPYRAMINE | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 4819 | 1633 | 75 | 3H-MEPYRAMINE | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 74685737 | 1633 | 75 | 3H-MEPYRAMINE | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| CHEMBL914 | 1633 | 75 | 3H-MEPYRAMINE | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| DB00950 | 1633 | 75 | 3H-MEPYRAMINE | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 1971 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2404 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 4543 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| CHEMBL445 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| DB00540 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 115237 | 55585 | 119 | 3H-PYRILAMINE | -42 | 54 | Guinea pig | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| CHEMBL1621 | 55585 | 119 | 3H-PYRILAMINE | -42 | 54 | Guinea pig | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| None | 216919 | 0 | UNDEFINED | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 311 | 4 | 1 | 4 | 2.7 | C1COC2=C1C=CC=C2OC(C3CNCCO3)C4=CC=CC=C4 | None | |||
| None | 216920 | 0 | UNDEFINED | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 305 | 4 | 1 | 3 | 3.1 | C1COC(CN1)C(C2=CC=CC=C2)OC3=C(C(=CC=C3)F)F | None | |||
| None | 216921 | 0 | UNDEFINED | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 301 | 4 | 1 | 3 | 3.2 | CC1=C(C=CC(=C1)F)OC(C2CNCCO2)C3=CC=CC=C3 | None | |||
| None | 216922 | 0 | UNDEFINED | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 3.6 | C1COC(CN1)C(C2=CC=CC=C2)OC3=C(C=C(C=C3)F)Cl | None | |||
| None | 216923 | 0 | UNDEFINED | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | PDSP KiDatabase | 317 | 5 | 1 | 4 | 2.9 | COC1=C(C=CC(=C1)F)OC(C2CNCCO2)C3=CC=CC=C3 | None | |||
| 277 | 1301 | 62 | None | -2 | 50 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 2913 | 1301 | 62 | None | -2 | 50 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 765 | 1301 | 62 | None | -2 | 50 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| CHEMBL516 | 1301 | 62 | None | -2 | 50 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| DB00434 | 1301 | 62 | None | -2 | 50 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 3246155 | 215962 | 0 | 3H-MEPYRAMINE | -46 | 16 | Rat | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 307 | 4 | 0 | 2 | 4.4 | CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| 1204 | 1932 | 119 | 3H-Histamine | -46 | 24 | Guinea pig | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-Histamine | -46 | 24 | Guinea pig | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-Histamine | -46 | 24 | Guinea pig | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-Histamine | -46 | 24 | Guinea pig | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-Histamine | -46 | 24 | Guinea pig | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-Histamine | -46 | 24 | Guinea pig | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 21722 | 17992 | 31 | 3H-MEPYRAMINE | -1 | 6 | Rat | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| CHEMBL126224 | 17992 | 31 | 3H-MEPYRAMINE | -1 | 6 | Rat | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| 1353 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 46222048 | 8984 | 0 | UNDEFINED | -4365 | 13 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 260 | 4 | 1 | 2 | 4.0 | CC(C)(C)c1ccc(SCCc2c[nH]cn2)cc1 | None | |||
| CHEMBL1098230 | 8984 | 0 | UNDEFINED | -4365 | 13 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 260 | 4 | 1 | 2 | 4.0 | CC(C)(C)c1ccc(SCCc2c[nH]cn2)cc1 | None | |||
| 18922713 | 98498 | 0 | 3H-PYRILAMINE | -12882 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 298 | 6 | 1 | 2 | 4.0 | CCCN(CCC)C1Cc2c[nH]c3ccc(C(C)=O)c(c23)C1 | None | |||
| CHEMBL276031 | 98498 | 0 | 3H-PYRILAMINE | -12882 | 9 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 298 | 6 | 1 | 2 | 4.0 | CCCN(CCC)C1Cc2c[nH]c3ccc(C(C)=O)c(c23)C1 | None | |||
| 54841 | 203127 | 52 | 3H-PYRILAMINE | -2 | 27 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
| CHEMBL641 | 203127 | 52 | 3H-PYRILAMINE | -2 | 27 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
| 3947 | 206395 | 53 | 3H-MEPYRAMINE | -147 | 16 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | None | |||
| CHEMBL87708 | 206395 | 53 | 3H-MEPYRAMINE | -147 | 16 | Rat | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | None | |||
| 12057539 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 3661 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| CHEMBL9751 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 6.0 | pKi | = | 6 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 179 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| 179 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| 2159 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| 2159 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| 963 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| 963 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| CHEMBL243712 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| CHEMBL243712 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| DB06288 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| DB06288 | 400 | 115 | 3H-PYRILAMINE | -4365 | 49 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 369 | 7 | 2 | 6 | 1.3 | CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC | None | |||
| 2247 | 505 | 81 | 3H-Histamine | -4 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 249 | 505 | 81 | 3H-Histamine | -4 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 2603 | 505 | 81 | 3H-Histamine | -4 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| CHEMBL296419 | 505 | 81 | 3H-Histamine | -4 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| DB00637 | 505 | 81 | 3H-Histamine | -4 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | None | |||
| 1001 | 620 | 95 | 3H-Histamine | -3 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| 2144 | 620 | 95 | 3H-Histamine | -3 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| CHEMBL610 | 620 | 95 | 3H-Histamine | -3 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| DB04325 | 620 | 95 | 3H-Histamine | -3 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| 31101 | 729 | 40 | 3H-PYRILAMINE | -14454 | 36 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 653 | 5 | 3 | 6 | 3.2 | CC(C[C@H]1C(=O)N2CCC[C@H]2[C@]2(N1C(=O)[C@@](O2)(NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)C(C)C)O)C | None | |||
| 35 | 729 | 40 | 3H-PYRILAMINE | -14454 | 36 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 653 | 5 | 3 | 6 | 3.2 | CC(C[C@H]1C(=O)N2CCC[C@H]2[C@]2(N1C(=O)[C@@](O2)(NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)C(C)C)O)C | None | |||
| 403 | 729 | 40 | 3H-PYRILAMINE | -14454 | 36 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 653 | 5 | 3 | 6 | 3.2 | CC(C[C@H]1C(=O)N2CCC[C@H]2[C@]2(N1C(=O)[C@@](O2)(NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)C(C)C)O)C | None | |||
| CHEMBL493 | 729 | 40 | 3H-PYRILAMINE | -14454 | 36 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 653 | 5 | 3 | 6 | 3.2 | CC(C[C@H]1C(=O)N2CCC[C@H]2[C@]2(N1C(=O)[C@@](O2)(NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)C(C)C)O)C | None | |||
| DB01200 | 729 | 40 | 3H-PYRILAMINE | -14454 | 36 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 653 | 5 | 3 | 6 | 3.2 | CC(C[C@H]1C(=O)N2CCC[C@H]2[C@]2(N1C(=O)[C@@](O2)(NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)C(C)C)O)C | None | |||
| 2554 | 796 | 119 | 3H-doxepin | 1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| 489 | 796 | 119 | 3H-doxepin | 1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| 5339 | 796 | 119 | 3H-doxepin | 1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| CHEMBL108 | 796 | 119 | 3H-doxepin | 1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| DB00564 | 796 | 119 | 3H-doxepin | 1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| 1222 | 881 | 0 | 3H-Histamine | -1 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2678 | 881 | 0 | 3H-Histamine | -1 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 581 | 881 | 0 | 3H-Histamine | -1 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1000 | 881 | 0 | 3H-Histamine | -1 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00341 | 881 | 0 | 3H-Histamine | -1 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1210 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | 3H-Histamine | -20 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1231 | 937 | 116 | 3H-doxepin | -81 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 252 | 5 | 3 | 4 | 0.6 | N#CNC(=NC)NCCSCc1nc[nH]c1C | None | |||
| 2756 | 937 | 116 | 3H-doxepin | -81 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 252 | 5 | 3 | 4 | 0.6 | N#CNC(=NC)NCCSCc1nc[nH]c1C | None | |||
| 645 | 937 | 116 | 3H-doxepin | -81 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 252 | 5 | 3 | 4 | 0.6 | N#CNC(=NC)NCCSCc1nc[nH]c1C | None | |||
| CHEMBL30 | 937 | 116 | 3H-doxepin | -81 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 252 | 5 | 3 | 4 | 0.6 | N#CNC(=NC)NCCSCc1nc[nH]c1C | None | |||
| DB00501 | 937 | 116 | 3H-doxepin | -81 | 7 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 252 | 5 | 3 | 4 | 0.6 | N#CNC(=NC)NCCSCc1nc[nH]c1C | None | |||
| 1248 | 1424 | 28 | 3H-MEPYRAMINE | -208 | 6 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 161 | 4 | 2 | 3 | 0.6 | CN(CCCSC(=N)N)C | None | |||
| 3077 | 1424 | 28 | 3H-MEPYRAMINE | -208 | 6 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 161 | 4 | 2 | 3 | 0.6 | CN(CCCSC(=N)N)C | None | |||
| 90045 | 1424 | 28 | 3H-MEPYRAMINE | -208 | 6 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 161 | 4 | 2 | 3 | 0.6 | CN(CCCSC(=N)N)C | None | |||
| CHEMBL12344 | 1424 | 28 | 3H-MEPYRAMINE | -208 | 6 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 161 | 4 | 2 | 3 | 0.6 | CN(CCCSC(=N)N)C | None | |||
| 1224 | 1432 | 83 | 3H-Histamine | -2 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-Histamine | -2 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-Histamine | -2 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-Histamine | -2 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-Histamine | -2 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-Histamine | -2 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 1170 | 1633 | 75 | 3H-Histamine | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 3348 | 1633 | 75 | 3H-Histamine | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 4819 | 1633 | 75 | 3H-Histamine | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 74685737 | 1633 | 75 | 3H-Histamine | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| CHEMBL914 | 1633 | 75 | 3H-Histamine | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| DB00950 | 1633 | 75 | 3H-Histamine | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 1209 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 203 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 3386 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL41 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| DB00472 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 119376 | 1841 | 48 | 3H-MEPYRAMINE | -43651 | 26 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 393 | 7 | 1 | 6 | 1.6 | O=C(c1cn(c2c1cccc2)C)OCC1CCN(CC1)CCNS(=O)(=O)C | None | |||
| 247 | 1841 | 48 | 3H-MEPYRAMINE | -43651 | 26 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 393 | 7 | 1 | 6 | 1.6 | O=C(c1cn(c2c1cccc2)C)OCC1CCN(CC1)CCNS(=O)(=O)C | None | |||
| CHEMBL33884 | 1841 | 48 | 3H-MEPYRAMINE | -43651 | 26 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 393 | 7 | 1 | 6 | 1.6 | O=C(c1cn(c2c1cccc2)C)OCC1CCN(CC1)CCNS(=O)(=O)C | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1204 | 1932 | 119 | 3H-doxepin | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1204 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-doxepin | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-doxepin | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-doxepin | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-doxepin | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-doxepin | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -501 | 24 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1400 | 1957 | 70 | 3H-Histamine | 2 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 3658 | 1957 | 70 | 3H-Histamine | 2 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 7199 | 1957 | 70 | 3H-Histamine | 2 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 91513 | 1957 | 70 | 3H-Histamine | 2 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL896 | 1957 | 70 | 3H-Histamine | 2 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00557 | 1957 | 70 | 3H-Histamine | 2 | 3 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1427 | 2013 | 54 | 3H-Histamine | -5 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-Histamine | -5 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-Histamine | -5 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-Histamine | -5 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-Histamine | -5 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 1530 | 2182 | 50 | 3H-Histamine | -5 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 3827 | 2182 | 50 | 3H-Histamine | -5 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 7206 | 2182 | 50 | 3H-Histamine | -5 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| CHEMBL534 | 2182 | 50 | 3H-Histamine | -5 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| DB00920 | 2182 | 50 | 3H-Histamine | -5 | 21 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 18971832 | 2418 | 0 | 3H-PYRILAMINE | -1621 | 13 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 3 | 2 | 2 | 4.0 | CN(C1CCc2c(C1)c1cc(ccc1[nH]2)NC(=O)c1ccc(cc1)F)C | None | |||
| 21 | 2418 | 0 | 3H-PYRILAMINE | -1621 | 13 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 3 | 2 | 2 | 4.0 | CN(C1CCc2c(C1)c1cc(ccc1[nH]2)NC(=O)c1ccc(cc1)F)C | None | |||
| CHEMBL3186179 | 2418 | 0 | 3H-PYRILAMINE | -1621 | 13 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 3 | 2 | 2 | 4.0 | CN(C1CCc2c(C1)c1cc(ccc1[nH]2)NC(=O)c1ccc(cc1)F)C | None | |||
| 1227 | 2489 | 43 | 3H-Histamine | -2 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-Histamine | -2 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-Histamine | -2 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-Histamine | -2 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-Histamine | -2 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-Histamine | -2 | 12 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 134 | 2514 | 24 | 3H-PYRILAMINE | -933 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 134 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1775 | 2514 | 24 | 3H-PYRILAMINE | -933 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1775 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 9681 | 2514 | 24 | 3H-PYRILAMINE | -933 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 9681 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| CHEMBL1065 | 2514 | 24 | 3H-PYRILAMINE | -933 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| CHEMBL1065 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| DB00247 | 2514 | 24 | 3H-PYRILAMINE | -933 | 67 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| DB00247 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1233 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| 1548992 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| CHEMBL275446 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| DB08805 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| 1782 | 2518 | 84 | 3H-MEPYRAMINE | -676 | 22 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 299 | 7 | 2 | 4 | 2.0 | CCN(CCNC(=O)c1cc(Cl)c(cc1OC)N)CC | None | |||
| 241 | 2518 | 84 | 3H-MEPYRAMINE | -676 | 22 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 299 | 7 | 2 | 4 | 2.0 | CCN(CCNC(=O)c1cc(Cl)c(cc1OC)N)CC | None | |||
| 4168 | 2518 | 84 | 3H-MEPYRAMINE | -676 | 22 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 299 | 7 | 2 | 4 | 2.0 | CCN(CCNC(=O)c1cc(Cl)c(cc1OC)N)CC | None | |||
| CHEMBL86 | 2518 | 84 | 3H-MEPYRAMINE | -676 | 22 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 299 | 7 | 2 | 4 | 2.0 | CCN(CCNC(=O)c1cc(Cl)c(cc1OC)N)CC | None | |||
| DB01233 | 2518 | 84 | 3H-MEPYRAMINE | -676 | 22 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 299 | 7 | 2 | 4 | 2.0 | CCN(CCNC(=O)c1cc(Cl)c(cc1OC)N)CC | None | |||
| 135 | 2532 | 43 | 3H-Histamine | -1 | 58 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-Histamine | -1 | 58 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-Histamine | -1 | 58 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-Histamine | -1 | 58 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-Histamine | -1 | 58 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1830 | 2590 | 44 | 3H-doxepin | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 1830 | 2590 | 44 | UNDEFINED | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 207 | 2590 | 44 | 3H-doxepin | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 207 | 2590 | 44 | UNDEFINED | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 23897 | 2590 | 44 | 3H-doxepin | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 23897 | 2590 | 44 | UNDEFINED | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| CHEMBL460 | 2590 | 44 | 3H-doxepin | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| CHEMBL460 | 2590 | 44 | UNDEFINED | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| DB01618 | 2590 | 44 | 3H-doxepin | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| DB01618 | 2590 | 44 | UNDEFINED | -125 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 1890 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 4449 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 7247 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| CHEMBL623 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| DB01149 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 15897 | 2862 | 0 | 3H-PYRILAMINE | -354 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 203 | 2 | 1 | 1 | 2.6 | CC(Cc1cccc(c1)C(F)(F)F)N | None | |||
| 215 | 2862 | 0 | 3H-PYRILAMINE | -354 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 203 | 2 | 1 | 1 | 2.6 | CC(Cc1cccc(c1)C(F)(F)F)N | None | |||
| CHEMBL1979333 | 2862 | 0 | 3H-PYRILAMINE | -354 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 203 | 2 | 1 | 1 | 2.6 | CC(Cc1cccc(c1)C(F)(F)F)N | None | |||
| 208 | 2863 | 0 | 3H-PYRILAMINE | -109 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 5 | 1 | 2 | 4.2 | NCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 4541 | 2863 | 0 | 3H-PYRILAMINE | -109 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 5 | 1 | 2 | 4.2 | NCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL1494 | 2863 | 0 | 3H-PYRILAMINE | -109 | 13 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 295 | 5 | 1 | 2 | 4.2 | NCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 2142 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4920903 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 502 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 5775 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| CHEMBL597 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| DB00692 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 2202 | 3132 | 96 | 3H-PYRILAMINE | -316 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 0 | 6 | 1.5 | c1cnc(nc1)N1CCN(CC1)Cc1ccc2c(c1)OCO2 | None | |||
| 4850 | 3132 | 96 | 3H-PYRILAMINE | -316 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 0 | 6 | 1.5 | c1cnc(nc1)N1CCN(CC1)Cc1ccc2c(c1)OCO2 | None | |||
| 49 | 3132 | 96 | 3H-PYRILAMINE | -316 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 0 | 6 | 1.5 | c1cnc(nc1)N1CCN(CC1)Cc1ccc2c(c1)OCO2 | None | |||
| CHEMBL1371770 | 3132 | 96 | 3H-PYRILAMINE | -316 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 0 | 6 | 1.5 | c1cnc(nc1)N1CCN(CC1)Cc1ccc2c(c1)OCO2 | None | |||
| DB12478 | 3132 | 96 | 3H-PYRILAMINE | -316 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 298 | 3 | 0 | 6 | 1.5 | c1cnc(nc1)N1CCN(CC1)Cc1ccc2c(c1)OCO2 | None | |||
| 119570 | 3159 | 96 | 3H-PYRILAMINE | -7585 | 40 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| 119570 | 3159 | 96 | 3H-PYRILAMINE | -162 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| 2233 | 3159 | 96 | 3H-PYRILAMINE | -7585 | 40 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| 2233 | 3159 | 96 | 3H-PYRILAMINE | -162 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| 953 | 3159 | 96 | 3H-PYRILAMINE | -7585 | 40 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| 953 | 3159 | 96 | 3H-PYRILAMINE | -162 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| CHEMBL301265 | 3159 | 96 | 3H-PYRILAMINE | -7585 | 40 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| CHEMBL301265 | 3159 | 96 | 3H-PYRILAMINE | -162 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| DB00413 | 3159 | 96 | 3H-PYRILAMINE | -7585 | 40 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| DB00413 | 3159 | 96 | 3H-PYRILAMINE | -162 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 211 | 3 | 2 | 4 | 1.6 | CCCN[C@H]1CCc2c(C1)sc(n2)N | None | |||
| 2286 | 3183 | 51 | 3H-Histamine | -2 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 4927 | 3183 | 51 | 3H-Histamine | -2 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7282 | 3183 | 51 | 3H-Histamine | -2 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL643 | 3183 | 51 | 3H-Histamine | -2 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01069 | 3183 | 51 | 3H-Histamine | -2 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 243 | 3202 | 91 | 3H-PYRILAMINE | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
| 3052762 | 3202 | 91 | 3H-PYRILAMINE | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
| 3502 | 3202 | 91 | 3H-PYRILAMINE | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
| CHEMBL117287 | 3202 | 91 | 3H-PYRILAMINE | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
| DB06480 | 3202 | 91 | 3H-PYRILAMINE | -1096 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 6 | 2 | 5 | 2.1 | COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(c2c1OCC2)N | None | |||
| 1234 | 3291 | 68 | 3H-MEPYRAMINE | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| 1234 | 3291 | 68 | 3H-doxepin | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| 3001055 | 3291 | 68 | 3H-MEPYRAMINE | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| 3001055 | 3291 | 68 | 3H-doxepin | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| CHEMBL512 | 3291 | 68 | 3H-MEPYRAMINE | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| CHEMBL512 | 3291 | 68 | 3H-doxepin | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| DB00863 | 3291 | 68 | 3H-MEPYRAMINE | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| DB00863 | 3291 | 68 | 3H-doxepin | -162 | 6 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 10 | 2 | 7 | 1.5 | CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C | None | |||
| 128563 | 3464 | 33 | 3H-PYRILAMINE | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
| 1666 | 3464 | 33 | 3H-PYRILAMINE | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
| CHEMBL445332 | 3464 | 33 | 3H-PYRILAMINE | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
| DB12327 | 3464 | 33 | 3H-PYRILAMINE | -2398 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 432 | 3 | 0 | 8 | 3.0 | COC(=O)[C@@H]1C[C@H](OC(=O)C)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1cocc1 | None | |||
| 221 | 3491 | 71 | UNDEFINED | -478 | 14 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 286 | 2 | 2 | 4 | 3.6 | O=C(Nc1snc(c1)C)Nc1ccc2c(c1)ccn2C | None | |||
| 3277600 | 3491 | 71 | UNDEFINED | -478 | 14 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 286 | 2 | 2 | 4 | 3.6 | O=C(Nc1snc(c1)C)Nc1ccc2c(c1)ccn2C | None | |||
| CHEMBL323356 | 3491 | 71 | UNDEFINED | -478 | 14 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 286 | 2 | 2 | 4 | 3.6 | O=C(Nc1snc(c1)C)Nc1ccc2c(c1)ccn2C | None | |||
| 189 | 3492 | 39 | 3H-MEPYRAMINE | -4168 | 17 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 1 | 1 | 3 | 3.2 | O=C(N1CCc2c1cc1ccn(c1c2)C)Nc1cccnc1 | None | |||
| 5163 | 3492 | 39 | 3H-MEPYRAMINE | -4168 | 17 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 1 | 1 | 3 | 3.2 | O=C(N1CCc2c1cc1ccn(c1c2)C)Nc1cccnc1 | None | |||
| CHEMBL297784 | 3492 | 39 | 3H-MEPYRAMINE | -4168 | 17 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 1 | 1 | 3 | 3.2 | O=C(N1CCc2c1cc1ccn(c1c2)C)Nc1cccnc1 | None | |||
| 6917970 | 3691 | 61 | 3H-PYRILAMINE | -2290 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 327 | 2 | 2 | 5 | 2.8 | COc1cc2CCN3[C@H](c2cc1O)Cc1c(C3)c(OC)c(cc1)O | None | |||
| 8370 | 3691 | 61 | 3H-PYRILAMINE | -2290 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 327 | 2 | 2 | 5 | 2.8 | COc1cc2CCN3[C@H](c2cc1O)Cc1c(C3)c(OC)c(cc1)O | None | |||
| CHEMBL487387 | 3691 | 61 | 3H-PYRILAMINE | -2290 | 34 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 327 | 2 | 2 | 5 | 2.8 | COc1cc2CCN3[C@H](c2cc1O)Cc1c(C3)c(OC)c(cc1)O | None | |||
| 1577 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 2537 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 5355 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 5501 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 643497 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 688272 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 958 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 960 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| CHEMBL196677 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| CHEMBL26 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| CHEMBL267044 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| DB00391 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| DB16021 | 3703 | 110 | 3H-MEPYRAMINE | -549 | 21 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 341 | 6 | 2 | 5 | 0.6 | CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N | None | |||
| 1267 | 3804 | 49 | 3H-MEPYRAMINE | -4168 | 26 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 2 | 2 | 2 | 2.8 | S=C(N1CCC(CC1)c1cnc[nH]1)NC1CCCCC1 | None | |||
| 1267 | 3804 | 49 | 3H-MEPYRAMINE | -4168 | 26 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 2 | 2 | 2 | 2.8 | S=C(N1CCC(CC1)c1cnc[nH]1)NC1CCCCC1 | None | |||
| 3035905 | 3804 | 49 | 3H-MEPYRAMINE | -4168 | 26 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 2 | 2 | 2 | 2.8 | S=C(N1CCC(CC1)c1cnc[nH]1)NC1CCCCC1 | None | |||
| 3035905 | 3804 | 49 | 3H-MEPYRAMINE | -4168 | 26 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 2 | 2 | 2 | 2.8 | S=C(N1CCC(CC1)c1cnc[nH]1)NC1CCCCC1 | None | |||
| CHEMBL260374 | 3804 | 49 | 3H-MEPYRAMINE | -4168 | 26 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 2 | 2 | 2 | 2.8 | S=C(N1CCC(CC1)c1cnc[nH]1)NC1CCCCC1 | None | |||
| CHEMBL260374 | 3804 | 49 | 3H-MEPYRAMINE | -4168 | 26 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 292 | 2 | 2 | 2 | 2.8 | S=C(N1CCC(CC1)c1cnc[nH]1)NC1CCCCC1 | None | |||
| 1235 | 3823 | 36 | 3H-doxepin | -316 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 312 | 6 | 4 | 6 | -0.1 | N#CNC(=NC)NCCSCc1csc(n1)N=C(N)N | None | |||
| 3959 | 3823 | 36 | 3H-doxepin | -316 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 312 | 6 | 4 | 6 | -0.1 | N#CNC(=NC)NCCSCc1csc(n1)N=C(N)N | None | |||
| 50287 | 3823 | 36 | 3H-doxepin | -316 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 312 | 6 | 4 | 6 | -0.1 | N#CNC(=NC)NCCSCc1csc(n1)N=C(N)N | None | |||
| CHEMBL269646 | 3823 | 36 | 3H-doxepin | -316 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 312 | 6 | 4 | 6 | -0.1 | N#CNC(=NC)NCCSCc1csc(n1)N=C(N)N | None | |||
| 2762 | 3863 | 31 | 3H-Histamine | -9 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| 5587 | 3863 | 31 | 3H-Histamine | -9 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| 7318 | 3863 | 31 | 3H-Histamine | -9 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| CHEMBL1241 | 3863 | 31 | 3H-Histamine | -9 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| DB00792 | 3863 | 31 | 3H-Histamine | -9 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| 1228 | 3866 | 34 | 3H-Histamine | -5 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-Histamine | -5 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-Histamine | -5 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-Histamine | -5 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-Histamine | -5 | 4 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 46882224 | 6348 | 0 | UNDEFINED | -354 | 5 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 543 | 10 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)CC)ccc4o3)CC2)cc(OC2CCOCC2)c1 | None | |||
| CHEMBL1082036 | 6348 | 0 | UNDEFINED | -354 | 5 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 543 | 10 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)CC)ccc4o3)CC2)cc(OC2CCOCC2)c1 | None | |||
| 2662 | 11384 | 131 | 3H-PYRILAMINE | -41 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 381 | 3 | 1 | 4 | 3.5 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1 | None | |||
| CHEMBL118 | 11384 | 131 | 3H-PYRILAMINE | -41 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 381 | 3 | 1 | 4 | 3.5 | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1 | None | |||
| 3032915 | 15495 | 24 | 3H-MEPYRAMINE | -169 | 6 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 212 | 5 | 3 | 2 | 1.2 | C/N=C(\S)NCCCCc1c[nH]cn1 | None | |||
| CHEMBL12160 | 15495 | 24 | 3H-MEPYRAMINE | -169 | 6 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 212 | 5 | 3 | 2 | 1.2 | C/N=C(\S)NCCCCc1c[nH]cn1 | None | |||
| 3380 | 22790 | 34 | 3H-MEPYRAMINE | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 313 | 2 | 0 | 4 | 2.5 | CN1C(=O)CN=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc21 | None | |||
| CHEMBL13280 | 22790 | 34 | 3H-MEPYRAMINE | - | 1 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 313 | 2 | 0 | 4 | 2.5 | CN1C(=O)CN=C(c2ccccc2F)c2cc([N+](=O)[O-])ccc21 | None | |||
| 10297 | 27112 | 30 | 3H-PYRILAMINE | -38 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | C[C@H](N)[C@H](O)c1ccccc1 | None | |||
| CHEMBL136560 | 27112 | 30 | 3H-PYRILAMINE | -38 | 42 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | C[C@H](N)[C@H](O)c1ccccc1 | None | |||
| 156391 | 46800 | 99 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 230 | 3 | 1 | 2 | 3.0 | COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 | None | |||
| CHEMBL1200806 | 46800 | 99 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 230 | 3 | 1 | 2 | 3.0 | COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 | None | |||
| CHEMBL154 | 46800 | 99 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 230 | 3 | 1 | 2 | 3.0 | COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 | None | |||
| 10624 | 70300 | 19 | 3H-PYRILAMINE | -776 | 33 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 5 | 3 | 3 | 1.7 | CN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12 | None | |||
| 10624 | 70300 | 19 | 3H-MEPYRAMINE | -776 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 5 | 3 | 3 | 1.7 | CN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12 | None | |||
| 138543650 | 70300 | 19 | 3H-PYRILAMINE | -776 | 33 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 5 | 3 | 3 | 1.7 | CN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12 | None | |||
| 138543650 | 70300 | 19 | 3H-MEPYRAMINE | -776 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 5 | 3 | 3 | 1.7 | CN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12 | None | |||
| CHEMBL194378 | 70300 | 19 | 3H-PYRILAMINE | -776 | 33 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 5 | 3 | 3 | 1.7 | CN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12 | None | |||
| CHEMBL194378 | 70300 | 19 | 3H-MEPYRAMINE | -776 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 284 | 5 | 3 | 3 | 1.7 | CN(C)CCc1c[nH]c2cccc(OP(=O)(O)O)c12 | None | |||
| 54477 | 84653 | 36 | 3H-MEPYRAMINE | -70 | 23 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 370 | 6 | 1 | 4 | 2.7 | CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC | None | |||
| 54477 | 84653 | 36 | 3H-PYRILAMINE | -70 | 23 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 370 | 6 | 1 | 4 | 2.7 | CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC | None | |||
| CHEMBL22242 | 84653 | 36 | 3H-MEPYRAMINE | -70 | 23 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 370 | 6 | 1 | 4 | 2.7 | CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC | None | |||
| CHEMBL22242 | 84653 | 36 | 3H-PYRILAMINE | -70 | 23 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 370 | 6 | 1 | 4 | 2.7 | CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC | None | |||
| 2244 | 94233 | 100 | 3H-PYRILAMINE | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 180 | 2 | 1 | 3 | 1.3 | CC(=O)Oc1ccccc1C(=O)O | None | |||
| CHEMBL25 | 94233 | 100 | 3H-PYRILAMINE | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 180 | 2 | 1 | 3 | 1.3 | CC(=O)Oc1ccccc1C(=O)O | None | |||
| 4528 | 98126 | 80 | 3H-Histamine | -7 | 10 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| CHEMBL273575 | 98126 | 80 | 3H-Histamine | -7 | 10 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| 104870 | 98880 | 47 | 3H-PYRILAMINE | -549 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 209 | 2 | 1 | 4 | 1.3 | C=CCN1CCc2nc(N)sc2CC1 | None | |||
| 5374 | 98880 | 47 | 3H-PYRILAMINE | -549 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 209 | 2 | 1 | 4 | 1.3 | C=CCN1CCc2nc(N)sc2CC1 | None | |||
| CHEMBL279085 | 98880 | 47 | 3H-PYRILAMINE | -549 | 21 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 209 | 2 | 1 | 4 | 1.3 | C=CCN1CCc2nc(N)sc2CC1 | None | |||
| 3663 | 99967 | 83 | 3H-PYRILAMINE | -288 | 29 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | None | |||
| CHEMBL286494 | 99967 | 83 | 3H-PYRILAMINE | -288 | 29 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | None | |||
| 37632 | 111592 | 28 | 3H-PYRILAMINE | -1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 3 | 0 | 5 | 3.3 | CN(C)Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | None | |||
| CHEMBL328250 | 111592 | 28 | 3H-PYRILAMINE | -1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 3 | 0 | 5 | 3.3 | CN(C)Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | None | |||
| 3452843 | 119525 | 15 | 3H-PYRILAMINE | -1 | 10 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | None | |||
| CHEMBL345686 | 119525 | 15 | 3H-PYRILAMINE | -1 | 10 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 516 | 6 | 2 | 4 | 5.5 | Cc1cccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 | None | |||
| 44208932 | 140707 | 7 | UNDEFINED | -89125 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | |||
| CHEMBL381689 | 140707 | 7 | UNDEFINED | -89125 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 475 | 5 | 1 | 3 | 6.8 | Cc1ccc(Cn2nc(C(=O)NC3C4(C)CCC(C4)C3(C)C)cc2-c2ccc(Cl)c(C)c2)cc1 | None | |||
| 4737 | 172454 | 27 | 3H-doxepin | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 226 | 4 | 2 | 3 | 1.2 | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | None | |||
| CHEMBL448 | 172454 | 27 | 3H-doxepin | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 226 | 4 | 2 | 3 | 1.2 | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | None | |||
| 4595 | 176715 | 106 | 3H-MEPYRAMINE | -186 | 15 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 293 | 2 | 0 | 4 | 3.1 | Cc1nccn1CC1CCc2c(c3ccccc3n2C)C1=O | None | |||
| CHEMBL46 | 176715 | 106 | 3H-MEPYRAMINE | -186 | 15 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 293 | 2 | 0 | 4 | 3.1 | Cc1nccn1CC1CCc2c(c3ccccc3n2C)C1=O | None | |||
| 43815 | 186920 | 64 | 3H-PYRILAMINE | -1995 | 25 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| 43815 | 186920 | 64 | 3H-PYRILAMINE | -1995 | 25 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| 43815 | 186920 | 64 | 3H-MEPYRAMINE | -1995 | 25 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| CHEMBL1708 | 186920 | 64 | 3H-PYRILAMINE | -1995 | 25 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| CHEMBL1708 | 186920 | 64 | 3H-PYRILAMINE | -1995 | 25 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| CHEMBL1708 | 186920 | 64 | 3H-MEPYRAMINE | -1995 | 25 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| CHEMBL490 | 186920 | 64 | 3H-PYRILAMINE | -1995 | 25 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| CHEMBL490 | 186920 | 64 | 3H-PYRILAMINE | -1995 | 25 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| CHEMBL490 | 186920 | 64 | 3H-MEPYRAMINE | -1995 | 25 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | None | |||
| 5280343 | 188275 | 124 | 3H-PYRILAMINE | -147 | 32 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
| CHEMBL1520590 | 188275 | 124 | 3H-PYRILAMINE | -147 | 32 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
| CHEMBL50 | 188275 | 124 | 3H-PYRILAMINE | -147 | 32 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
| 12016890 | 190776 | 6 | 3H-PYRILAMINE | -16982 | 11 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 4 | 1 | 3 | 2.6 | NC(=O)c1ccc(F)c2c1CC(N(C1CCC1)C1CCC1)CO2 | None | |||
| CHEMBL5183389 | 190776 | 6 | 3H-PYRILAMINE | -16982 | 11 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 4 | 1 | 3 | 2.6 | NC(=O)c1ccc(F)c2c1CC(N(C1CCC1)C1CCC1)CO2 | None | |||
| 3672 | 192533 | 136 | 3H-PYRILAMINE | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 206 | 4 | 1 | 1 | 3.1 | CC(C)Cc1ccc(C(C)C(=O)O)cc1 | None | |||
| CHEMBL521 | 192533 | 136 | 3H-PYRILAMINE | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 206 | 4 | 1 | 1 | 3.1 | CC(C)Cc1ccc(C(C)C(=O)O)cc1 | None | |||
| 54676228 | 193615 | 112 | 3H-PYRILAMINE | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 331 | 2 | 2 | 5 | 1.6 | CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O | None | |||
| CHEMBL527 | 193615 | 112 | 3H-PYRILAMINE | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 331 | 2 | 2 | 5 | 1.6 | CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O | None | |||
| 4495 | 196535 | 92 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 308 | 5 | 1 | 5 | 2.8 | CS(=O)(=O)Nc1ccc([N+](=O)[O-])cc1Oc1ccccc1 | None | |||
| CHEMBL56367 | 196535 | 92 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 308 | 5 | 1 | 5 | 2.8 | CS(=O)(=O)Nc1ccc([N+](=O)[O-])cc1Oc1ccccc1 | None | |||
| 54677470 | 200551 | 115 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 2 | 2 | 6 | 2.0 | Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1 | None | |||
| CHEMBL1256873 | 200551 | 115 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 2 | 2 | 6 | 2.0 | Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1 | None | |||
| CHEMBL599 | 200551 | 115 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 351 | 2 | 2 | 6 | 2.0 | Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1 | None | |||
| 162265 | 202274 | 22 | 3H-PYRILAMINE | -239 | 43 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | CC(N)C(O)c1ccccc1 | None | |||
| 4786 | 202274 | 22 | 3H-PYRILAMINE | -239 | 43 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | CC(N)C(O)c1ccccc1 | None | |||
| CHEMBL61006 | 202274 | 22 | 3H-PYRILAMINE | -239 | 43 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 151 | 2 | 2 | 2 | 1.1 | CC(N)C(O)c1ccccc1 | None | |||
| 5281600 | 203025 | 92 | 3H-PYRILAMINE | -275 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 538 | 3 | 6 | 10 | 5.1 | O=c1cc(-c2ccc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c2)oc2cc(O)cc(O)c12 | None | |||
| CHEMBL63354 | 203025 | 92 | 3H-PYRILAMINE | -275 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 538 | 3 | 6 | 10 | 5.1 | O=c1cc(-c2ccc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c2)oc2cc(O)cc(O)c12 | None | |||
| 5656 | 203066 | 87 | 3H-PYRILAMINE | -79 | 40 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
| 5656 | 203066 | 87 | 3H-PYRILAMINE | -79 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
| 5656 | 203066 | 87 | 3H-MEPYRAMINE | -79 | 40 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
| CHEMBL637 | 203066 | 87 | 3H-PYRILAMINE | -79 | 40 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
| CHEMBL637 | 203066 | 87 | 3H-PYRILAMINE | -79 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
| CHEMBL637 | 203066 | 87 | 3H-MEPYRAMINE | -79 | 40 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 277 | 5 | 1 | 3 | 3.0 | COc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1 | None | |||
| 1238 | 203174 | 24 | 3H-Histamine | -38 | 16 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 344 | 1 | 0 | 3 | 4.3 | CN1CCN(C2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | None | |||
| CHEMBL64249 | 203174 | 24 | 3H-Histamine | -38 | 16 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 344 | 1 | 0 | 3 | 4.3 | CN1CCN(C2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | None | |||
| 1973 | 203483 | 15 | 3H-PYRILAMINE | -3 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | |||
| CHEMBL1394464 | 203483 | 15 | 3H-PYRILAMINE | -3 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | |||
| CHEMBL66089 | 203483 | 15 | 3H-PYRILAMINE | -3 | 36 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 462 | 3 | 1 | 7 | 3.9 | Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(-c3cccc(Br)c3)c12 | None | |||
| 2118 | 203485 | 36 | 3H-doxepin | -24 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 308 | 1 | 0 | 4 | 3.6 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | None | |||
| CHEMBL661 | 203485 | 36 | 3H-doxepin | -24 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 308 | 1 | 0 | 4 | 3.6 | Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2 | None | |||
| 3291 | 204000 | 77 | 3H-doxepin | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 141 | 1 | 1 | 2 | 0.4 | CCC1(C)CC(=O)NC1=O | None | |||
| CHEMBL696 | 204000 | 77 | 3H-doxepin | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 141 | 1 | 1 | 2 | 0.4 | CCC1(C)CC(=O)NC1=O | None | |||
| 2995 | 204405 | 53 | 3H-Histamine | -14 | 23 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-Histamine | -14 | 23 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-Histamine | -14 | 23 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 3821 | 204718 | 17 | 3H-PYRILAMINE | -1 | 18 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 237 | 2 | 1 | 2 | 2.9 | CNC1(c2ccccc2Cl)CCCCC1=O | None | |||
| CHEMBL742 | 204718 | 17 | 3H-PYRILAMINE | -1 | 18 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 237 | 2 | 1 | 2 | 2.9 | CNC1(c2ccccc2Cl)CCCCC1=O | None | |||
| 4054 | 205501 | 72 | 3H-PYRILAMINE | -1 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 179 | 0 | 1 | 1 | 2.7 | CC12CC3CC(C)(C1)CC(N)(C3)C2 | None | |||
| CHEMBL1699 | 205501 | 72 | 3H-PYRILAMINE | -1 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 179 | 0 | 1 | 1 | 2.7 | CC12CC3CC(C)(C1)CC(N)(C3)C2 | None | |||
| CHEMBL807 | 205501 | 72 | 3H-PYRILAMINE | -1 | 36 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 179 | 0 | 1 | 1 | 2.7 | CC12CC3CC(C)(C1)CC(N)(C3)C2 | None | |||
| 68617 | 205527 | 62 | 3H-PYRILAMINE | -1023 | 26 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| 68617 | 205527 | 62 | 3H-MEPYRAMINE | -1445 | 26 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL1709 | 205527 | 62 | 3H-PYRILAMINE | -1023 | 26 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL1709 | 205527 | 62 | 3H-MEPYRAMINE | -1445 | 26 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL809 | 205527 | 62 | 3H-PYRILAMINE | -1023 | 26 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL809 | 205527 | 62 | 3H-MEPYRAMINE | -1445 | 26 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| 5324346 | 205582 | 59 | 3H-PYRILAMINE | -1 | 10 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 9 | 1 | 4 | 3.2 | COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1 | None | |||
| 5324346 | 205582 | 59 | 3H-MEPYRAMINE | -1 | 10 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 9 | 1 | 4 | 3.2 | COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1 | None | |||
| CHEMBL1409 | 205582 | 59 | 3H-PYRILAMINE | -1 | 10 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 9 | 1 | 4 | 3.2 | COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1 | None | |||
| CHEMBL1409 | 205582 | 59 | 3H-MEPYRAMINE | -1 | 10 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 9 | 1 | 4 | 3.2 | COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1 | None | |||
| CHEMBL814 | 205582 | 59 | 3H-PYRILAMINE | -1 | 10 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 9 | 1 | 4 | 3.2 | COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1 | None | |||
| CHEMBL814 | 205582 | 59 | 3H-MEPYRAMINE | -1 | 10 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 318 | 9 | 1 | 4 | 3.2 | COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1 | None | |||
| 119607 | 206203 | 113 | 3H-PYRILAMINE | -97 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 3 | 1 | 4 | 3.0 | Cc1onc(-c2ccccc2)c1-c1ccc(S(N)(=O)=O)cc1 | None | |||
| CHEMBL865 | 206203 | 113 | 3H-PYRILAMINE | -97 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 3 | 1 | 4 | 3.0 | Cc1onc(-c2ccccc2)c1-c1ccc(S(N)(=O)=O)cc1 | None | |||
| 3337 | 206367 | 27 | 3H-PYRILAMINE | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
| 65801 | 206367 | 27 | 3H-PYRILAMINE | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
| 66264 | 206367 | 27 | 3H-PYRILAMINE | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
| 91452 | 206367 | 27 | 3H-PYRILAMINE | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
| CHEMBL87493 | 206367 | 27 | 3H-PYRILAMINE | -1513 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 231 | 4 | 1 | 1 | 3.2 | CCNC(C)Cc1cccc(C(F)(F)F)c1 | None | |||
| 444 | 206666 | 53 | 3H-PYRILAMINE | -2089 | 18 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 239 | 3 | 1 | 2 | 3.3 | CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1 | None | |||
| CHEMBL894 | 206666 | 53 | 3H-PYRILAMINE | -2089 | 18 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 239 | 3 | 1 | 2 | 3.3 | CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1 | None | |||
| 16231 | 207509 | 57 | 3H-MEPYRAMINE | -7 | 17 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 229 | 1 | 5 | 6 | -1.1 | N=C(N)NC(=O)c1nc(Cl)c(N)nc1N | None | |||
| CHEMBL945 | 207509 | 57 | 3H-MEPYRAMINE | -7 | 17 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 229 | 1 | 5 | 6 | -1.1 | N=C(N)NC(=O)c1nc(Cl)c(N)nc1N | None | |||
| 165193 | 215945 | 0 | 3H-doxepin | -42657 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O | None | |||
| 62882 | 215945 | 0 | 3H-doxepin | -42657 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O | None | |||
| 66366 | 215945 | 0 | 3H-doxepin | -42657 | 30 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O | None | |||
| 11954224 | 215953 | 0 | 3H-PYRILAMINE | -141253 | 58 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 581 | 4 | 3 | 6 | 2.0 | CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C | None | |||
| None | 215958 | 0 | 3H-MEPYRAMINE | -63095 | 19 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 421 | 9 | 1 | 6 | 4.3 | COC1=C(C(=CC=C1)OC)OCCNCC2C(OC3=CC=CC=C3O2)C4=CC=CC=C4 | None | |||
| 25058166 | 215960 | 0 | 3H-PYRILAMINE | -5011 | 27 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 267 | 0 | 2 | 3 | 2.9 | CN1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)O)O | None | |||
| 6852389 | 215960 | 0 | 3H-PYRILAMINE | -5011 | 27 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 267 | 0 | 2 | 3 | 2.9 | CN1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)O)O | None | |||
| 44134711 | 215991 | 0 | 3H-MEPYRAMINE | -112201 | 14 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 340 | 6 | 2 | 4 | 2.8 | CCC1=CC(=C(C(=C1O)C(=O)NCC2CCCN2CC)OC)Cl | None | |||
| None | 215993 | 0 | 3H-PYRILAMINE | -1 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 2 | 0 | 4 | 3.6 | CC1=NC=CN1CC2CCC3=C(C2=O)C4=CC=CC=C4N3C.Cl | None | |||
| 104911 | 216019 | 0 | 3H-PYRILAMINE | -41686 | 37 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 530 | 7 | 0 | 5 | 5.1 | COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=N3)C(=O)C4CCCCC4.Cl.Cl.Cl | None | |||
| 104911 | 216019 | 0 | 3H-PYRILAMINE | -41686 | 37 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 530 | 7 | 0 | 5 | 5.1 | COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=N3)C(=O)C4CCCCC4.Cl.Cl.Cl | None | |||
| 131632304 | 216037 | 0 | 3H-MEPYRAMINE | -70794 | 12 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 303 | 4 | 1 | 5 | 0.9 | CN1C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4 | None | |||
| 119380 | 216129 | 0 | 3H-PYRILAMINE | -1 | 8 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 166 | 1 | 0 | 3 | 1.8 | CC1=NOC(=C1)C2CCCN2C | None | |||
| None | 216154 | 0 | 3H-doxepin | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 281 | 2 | 1 | 4 | 2.4 | C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3 | None | |||
| None | 216155 | 0 | 3H-doxepin | 1 | 2 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 367 | 1 | 0 | 7 | 2.6 | CN1CCC2=CC3=C(C=C2C1C4C5=C(C6=C(C=C5)OCO6)C(=O)O4)OCO3 | None | |||
| 25137849 | 216179 | 0 | 3H-PYRILAMINE | -4 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 165 | 3 | 2 | 2 | 1.3 | CC(C(C1=CC=CC=C1)O)NC | None | |||
| 71290 | 216179 | 0 | 3H-PYRILAMINE | -4 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 165 | 3 | 2 | 2 | 1.3 | CC(C(C1=CC=CC=C1)O)NC | None | |||
| None | 216249 | 0 | 3H-MEPYRAMINE | -501 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 468 | 12 | 0 | 9 | -0.1 | C1COCCN1CCCN2CN(CN(C2)CCCN3CCOCC3)CCCN4CCOCC4 | None | |||
| None | 216250 | 0 | 3H-MEPYRAMINE | -1258 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 434 | 6 | 4 | 8 | 2.2 | CC(C)O.COC1=C(C=CC(=C1)CC2COC(=O)C2(CC3=CC(=C(C=C3)O)OC)O)O | None | |||
| None | 216251 | 0 | 3H-MEPYRAMINE | -3981 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 234 | 2 | 1 | 3 | 2.0 | CC(=O)NC1=C(C(=C(C=C1F)F)F)[N+](=O)[O-] | None | |||
| None | 216252 | 0 | 3H-MEPYRAMINE | -4677 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 314 | 0 | 1 | 2 | 4.0 | CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)(C#C)O | None | |||
| None | 216253 | 0 | 3H-MEPYRAMINE | -6025 | 3 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 329 | 5 | 1 | 3 | 4.5 | CCCC1=CC2=C(C=C1NC(=O)C3C(C3(C)C)C=C(C)C)OCO2 | None | |||
| None | 216311 | 0 | 3H-PYRILAMINE | -1 | 33 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 240 | 7 | 4 | 6 | -0.8 | C(C(C(=O)O)N)SSCC(C(=O)O)N | None | |||
| None | 216311 | 0 | 3H-PYRILAMINE | -1 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 240 | 7 | 4 | 6 | -0.8 | C(C(C(=O)O)N)SSCC(C(=O)O)N | None | |||
| None | 216312 | 0 | 3H-PYRILAMINE | -1 | 33 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 149 | 4 | 2 | 3 | 0.2 | CSCCC(C(=O)O)N | None | |||
| None | 216312 | 0 | 3H-PYRILAMINE | -1 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 149 | 4 | 2 | 3 | 0.2 | CSCCC(C(=O)O)N | None | |||
| None | 216313 | 0 | 3H-PYRILAMINE | -1 | 33 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 135 | 3 | 3 | 3 | -0.3 | C(CS)C(C(=O)O)N | None | |||
| None | 216313 | 0 | 3H-PYRILAMINE | -1 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 135 | 3 | 3 | 3 | -0.3 | C(CS)C(C(=O)O)N | None | |||
| None | 216314 | 0 | 3H-PYRILAMINE | -1 | 33 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 121 | 2 | 3 | 3 | -0.7 | C(C(C(=O)O)N)S | None | |||
| None | 216314 | 0 | 3H-PYRILAMINE | -1 | 33 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 121 | 2 | 3 | 3 | -0.7 | C(C(C(=O)O)N)S | None | |||
| None | 216315 | 0 | 3H-PYRILAMINE | -1 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 117 | 0 | 1 | 3 | -0.0 | C1CSC(=O)C1N | None | |||
| None | 216316 | 0 | 3H-PYRILAMINE | -1 | 39 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 3 | 3 | 3 | -1.4 | C(C(C(=O)O)N)S(=O)O | None | |||
| None | 216316 | 0 | 3H-PYRILAMINE | -1 | 39 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 153 | 3 | 3 | 3 | -1.4 | C(C(C(=O)O)N)S(=O)O | None | |||
| None | 216317 | 0 | 3H-PYRILAMINE | -1 | 38 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 3 | 3 | 4 | -1.7 | C(C(C(=O)O)N)S(=O)(=O)O | None | |||
| None | 216317 | 0 | 3H-PYRILAMINE | -1 | 38 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 169 | 3 | 3 | 4 | -1.7 | C(C(C(=O)O)N)S(=O)(=O)O | None | |||
| None | 216318 | 0 | 3H-PYRILAMINE | -1 | 30 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 183 | 4 | 3 | 4 | -1.3 | C(CS(=O)(=O)O)C(C(=O)O)N | None | |||
| None | 216325 | 0 | 3H-PYRILAMINE | -13 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 149 | 2 | 1 | 2 | 1.2 | CC(C(=O)C1=CC=CC=C1)N | None | |||
| 1576 | 216326 | 0 | 3H-PYRILAMINE | -16 | 40 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 163 | 3 | 1 | 2 | 1.5 | CC(C(=O)C1=CC=CC=C1)NC | None | |||
| None | 216327 | 0 | 3H-PYRILAMINE | -16 | 28 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 536 | 11 | 1 | 4 | 9.0 | CC(C)C(=O)C12C(=O)C(=C(C(C1=O)(CC(C2(C)CCC=C(C)C)CC=C(C)C)CC=C(C)C)O)CC=C(C)C | None | |||
| 4978 | 216328 | 0 | 3H-PYRILAMINE | -16 | 28 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 520 | 1 | 7 | 9 | 4.3 | CC1=CC(=C2C3=C1C4=C5C(=C(C=C4CO)O)C(=O)C6=C(C=C(C7=C6C5=C3C8=C7C(=CC(=C8C2=O)O)O)O)O)O | None | |||
| None | 216329 | 0 | 3H-PYRILAMINE | -3 | 28 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 464 | 4 | 8 | 12 | -0.6 | C1=CC(=C(C=C1C2=C(C(=C3C(=CC(=O)C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | None | |||
| None | 216330 | 0 | 3H-PYRILAMINE | -281 | 28 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 610 | 6 | 10 | 16 | -1.7 | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O | None | |||
| None | 216331 | 0 | 3H-PYRILAMINE | -1 | 28 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 448 | 3 | 7 | 11 | 0.4 | CC1C(C(C(C(O1)OC2=C(OC3=CC(=O)C=C(C3=C2O)O)C4=CC(=C(C=C4)O)O)O)O)O | None | |||
| None | 216388 | 0 | 3H-PYRILAMINE | 1 | 2 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 313 | 5 | 1 | 3 | 3.5 | CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O.Cl | None | |||
| 135269 | 216389 | 0 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 222 | 5 | 1 | 3 | 2.5 | CCCCC(=O)OC1=CC=CC=C1C(=O)O | None | |||
| 5018304 | 216391 | 0 | 3H-PYRILAMINE | -1 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 317 | 4 | 1 | 3 | 0.0 | C1=CC=C(C(=C1)CC(=O)[O-])NC2=C(C=CC=C2Cl)Cl.[Na+] | None | |||
| 84003 | 216392 | 0 | 3H-PYRILAMINE | -1 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 376 | 6 | 5 | 7 | -0.0 | C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)O.C(C(CO)(CO)N)O | None | |||
| 119828 | 216394 | 0 | 3H-PYRILAMINE | -1 | 29 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 370 | 5 | 1 | 5 | 3.5 | CCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)C | None | |||
| None | 216395 | 0 | 3H-PYRILAMINE | -7 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 517 | 8 | 2 | 5 | 5.2 | CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCC4=CC=C(C=C4)NC(=O)C | None | |||
| None | 216450 | 0 | UNDEFINED | -660 | 28 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 322 | 5 | 2 | 3 | 4.1 | CC(CC1=CNC2=C1C=C(C=C2)OCC3=CC=CS3)N.Cl | None | |||
| None | 216450 | 0 | Functional | -660 | 28 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 322 | 5 | 2 | 3 | 4.1 | CC(CC1=CNC2=C1C=C(C=C2)OCC3=CC=CS3)N.Cl | None | |||
| None | 216489 | 0 | 3H-PYRILAMINE | -4570 | 27 | Human | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 347 | 6 | 0 | 3 | 5.0 | CC(=O)N(CC1=CC=CC=C1OC)C2=CC=CC=C2OC3=CC=CC=C3 | None | |||
| None | 216493 | 0 | 3H-PYRILAMINE | -10471285 | 17 | Rat | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 372 | 2 | 1 | 3 | 4.4 | CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=C(C=CC=N3)Cl | None | |||
| None | 216494 | 0 | 3H-Strychnine | -1 | 13 | Bovine | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 399 | 7 | 4 | 5 | 1.8 | CN(C)CC(C1=CC=C(C=C1)O)C2(CCCCC2)O.C(CC(=O)O)C(=O)O.O | None | |||
| 1233 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 4.0 | pKi | = | 4 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| 1548992 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 4.0 | pKi | = | 4 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| CHEMBL275446 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 4.0 | pKi | = | 4 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| DB08805 | 2515 | 0 | 3H-MEPYRAMINE | -19 | 3 | Rat | 4.0 | pKi | = | 4 | Binding | PDSP KiDatabase | 244 | 5 | 3 | 3 | 1.0 | CNC(=S)NCCSCc1nc[nH]c1C | None | |||
| 3036864 | 202754 | 19 | 3H-MEPYRAMINE | -416 | 28 | Human | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | None | |||
| CHEMBL1256645 | 202754 | 19 | 3H-MEPYRAMINE | -416 | 28 | Human | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | None | |||
| CHEMBL1814790 | 202754 | 19 | 3H-MEPYRAMINE | -416 | 28 | Human | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | None | |||
| CHEMBL62 | 202754 | 19 | 3H-MEPYRAMINE | -416 | 28 | Human | 7.0 | pKi | = | 7 | Binding | PDSP KiDatabase | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | None | |||
| 46882664 | 5717 | 0 | UNDEFINED | -2 | 5 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 494 | 8 | 2 | 8 | 3.6 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1OC | None | |||
| CHEMBL1078240 | 5717 | 0 | UNDEFINED | -2 | 5 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 494 | 8 | 2 | 8 | 3.6 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1OC | None | |||
| 11545813 | 181194 | 0 | UNDEFINED | -24 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 400 | 6 | 0 | 3 | 5.2 | O=C(CCCN1C2CCC1CN(c1ccc(Cl)cc1)CC2)c1ccc(F)cc1 | None | |||
| CHEMBL476109 | 181194 | 0 | UNDEFINED | -24 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 400 | 6 | 0 | 3 | 5.2 | O=C(CCCN1C2CCC1CN(c1ccc(Cl)cc1)CC2)c1ccc(F)cc1 | None | |||
| 21830793 | 91835 | 10 | 3H-8-OH-DPAT | -6760 | 45 | Bovine | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 373 | 7 | 0 | 8 | 0.6 | COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1 | None | |||
| CHEMBL2413154 | 91835 | 10 | 3H-8-OH-DPAT | -6760 | 45 | Bovine | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 373 | 7 | 0 | 8 | 0.6 | COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1 | None | |||
| 2 | 3261 | 23 | 3H-PYRILAMINE | -218 | 29 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 219 | 2 | 1 | 2 | 2.0 | CCCN1CCC[C@H]2[C@H]1Cc1cn[nH]c1C2 | None | |||
| 54562 | 3261 | 23 | 3H-PYRILAMINE | -218 | 29 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 219 | 2 | 1 | 2 | 2.0 | CCCN1CCC[C@H]2[C@H]1Cc1cn[nH]c1C2 | None | |||
| CHEMBL240773 | 3261 | 23 | 3H-PYRILAMINE | -218 | 29 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 219 | 2 | 1 | 2 | 2.0 | CCCN1CCC[C@H]2[C@H]1Cc1cn[nH]c1C2 | None | |||
| None | 216342 | 0 | 3H-PYRILAMINE | -194 | 19 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 246 | 2 | 1 | 4 | 1.6 | CCCN1CCCC2C1CC3=CN=C(N=C3C2)N | None | |||
| 1427 | 2013 | 54 | 3H-MEPYRAMINE | -5 | 27 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-MEPYRAMINE | -5 | 27 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-MEPYRAMINE | -5 | 27 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-MEPYRAMINE | -5 | 27 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-MEPYRAMINE | -5 | 27 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 2337 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 2337 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Rat | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Rat | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Rat | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Rat | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Rat | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 1224 | 1432 | 83 | 3H-trans-H2-PAT,(-) | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-trans-H2-PAT,(-) | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-trans-H2-PAT,(-) | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-trans-H2-PAT,(-) | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-trans-H2-PAT,(-) | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-trans-H2-PAT,(-) | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 1209 | 1658 | 75 | 3H-doxepin | -144 | 32 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 203 | 1658 | 75 | 3H-doxepin | -144 | 32 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 3386 | 1658 | 75 | 3H-doxepin | -144 | 32 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL41 | 1658 | 75 | 3H-doxepin | -144 | 32 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| DB00472 | 1658 | 75 | 3H-doxepin | -144 | 32 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 213 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 2717 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 5533 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| CHEMBL621 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| DB00656 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1222 | 1664 | 49 | 3H-PYRILAMINE | -17 | 33 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3396 | 1664 | 49 | 3H-PYRILAMINE | -17 | 33 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 85 | 1664 | 49 | 3H-PYRILAMINE | -17 | 33 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL46516 | 1664 | 49 | 3H-PYRILAMINE | -17 | 33 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| DB04842 | 1664 | 49 | 3H-PYRILAMINE | -17 | 33 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 11954259 | 215979 | 0 | 3H-PYRILAMINE | -19 | 43 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C | None | |||
| 3294 | 2006 | 111 | 3H-PYRILAMINE | -14 | 45 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 71360 | 2006 | 111 | 3H-PYRILAMINE | -14 | 45 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 87 | 2006 | 111 | 3H-PYRILAMINE | -14 | 45 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| CHEMBL14376 | 2006 | 111 | 3H-PYRILAMINE | -14 | 45 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| DB04946 | 2006 | 111 | 3H-PYRILAMINE | -14 | 45 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 1222 | 881 | 0 | 3H-MEPYRAMINE | 1 | 2 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2678 | 881 | 0 | 3H-MEPYRAMINE | 1 | 2 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 581 | 881 | 0 | 3H-MEPYRAMINE | 1 | 2 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1000 | 881 | 0 | 3H-MEPYRAMINE | 1 | 2 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00341 | 881 | 0 | 3H-MEPYRAMINE | 1 | 2 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 100 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 21722 | 17992 | 31 | 3H-doxepin | 1 | 6 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| CHEMBL126224 | 17992 | 31 | 3H-doxepin | 1 | 6 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| 2995 | 204405 | 53 | 3H-doxepin | -14 | 23 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-doxepin | -14 | 23 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-doxepin | -14 | 23 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 16667681 | 216153 | 0 | 3H-doxepin | 4 | 3 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 45485525 | 197799 | 0 | UNDEFINED | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 337 | 7 | 1 | 2 | 4.8 | Cc1ccc(CCCCN2CCC(C(O)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL572034 | 197799 | 0 | UNDEFINED | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 337 | 7 | 1 | 2 | 4.8 | Cc1ccc(CCCCN2CCC(C(O)c3ccccc3)CC2)cc1 | None | |||
| 2995 | 204405 | 53 | 3H-PYRILAMINE | -42 | 23 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-PYRILAMINE | -42 | 23 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-PYRILAMINE | -42 | 23 | Rat | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 12057539 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 3661 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| CHEMBL9751 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 219050 | 3373 | 25 | 3H-PYRILAMINE | -794 | 21 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 346 | 6 | 2 | 2 | 5.0 | Oc1ccc2c(c1)c(CCCCN1CCC(=CC1)c1ccccc1)c[nH]2 | None | |||
| 52 | 3373 | 25 | 3H-PYRILAMINE | -794 | 21 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 346 | 6 | 2 | 2 | 5.0 | Oc1ccc2c(c1)c(CCCCN1CCC(=CC1)c1ccccc1)c[nH]2 | None | |||
| CHEMBL431367 | 3373 | 25 | 3H-PYRILAMINE | -794 | 21 | Guinea pig | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 346 | 6 | 2 | 2 | 5.0 | Oc1ccc2c(c1)c(CCCCN1CCC(=CC1)c1ccccc1)c[nH]2 | None | |||
| 2444 | 14478 | 26 | 3H-MEPYRAMINE | -1 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 333 | 6 | 0 | 2 | 4.1 | CN(C)CCOC(c1ccccc1)c1ccc(Br)cc1 | None | |||
| CHEMBL1201245 | 14478 | 26 | 3H-MEPYRAMINE | -1 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 333 | 6 | 0 | 2 | 4.1 | CN(C)CCOC(c1ccccc1)c1ccc(Br)cc1 | None | |||
| 1224 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 1224 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 2435 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 60149 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 98 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| CHEMBL12713 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| DB06144 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 2865 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 6.9 | pKi | = | 6.9 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 37459 | 746 | 13 | 3H-MEPYRAMINE | -3019 | 25 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 62 | 746 | 13 | 3H-MEPYRAMINE | -3019 | 25 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| CHEMBL8514 | 746 | 13 | 3H-MEPYRAMINE | -3019 | 25 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 1621 | 2429 | 17 | 3H-MEPYRAMINE | -4570 | 45 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 17 | 2429 | 17 | 3H-MEPYRAMINE | -4570 | 45 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 5761 | 2429 | 17 | 3H-MEPYRAMINE | -4570 | 45 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| CHEMBL263881 | 2429 | 17 | 3H-MEPYRAMINE | -4570 | 45 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| DB04829 | 2429 | 17 | 3H-MEPYRAMINE | -4570 | 45 | Rat | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 46882180 | 5841 | 0 | UNDEFINED | -5 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 482 | 7 | 2 | 7 | 3.7 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1F | None | |||
| CHEMBL1079180 | 5841 | 0 | UNDEFINED | -5 | 6 | Human | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 482 | 7 | 2 | 7 | 3.7 | CCOc1cc(CN2CCC(Nc3nc4cc(Cl)c(S(N)(=O)=O)cc4o3)CC2)ccc1F | None | |||
| None | 216341 | 0 | 3H-PYRILAMINE | -1819 | 19 | Guinea pig | 5.9 | pKi | = | 5.9 | Binding | PDSP KiDatabase | 451 | 8 | 2 | 4 | 3.2 | CCNC(=O)N(CCCN(C)C)C(=O)C1CC2C(CC3=CNC4=CC=CC2=C34)N(C1)CC=C | None | |||
| 135398737 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 100 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 1224 | 1432 | 83 | UNDEFINED | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | UNDEFINED | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | UNDEFINED | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | UNDEFINED | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | UNDEFINED | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | UNDEFINED | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 9906978 | 42711 | 2 | UNDEFINED | -28 | 12 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | None | |||
| CHEMBL150161 | 42711 | 2 | UNDEFINED | -28 | 12 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | None | |||
| 37459 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 62 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| CHEMBL8514 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 1224 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 2865 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 90475904 | 216022 | 0 | 3H-doxepin | -7 | 6 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 | None | |||
| 1971 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2404 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 4543 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| CHEMBL445 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| DB00540 | 2866 | 38 | 3H-MEPYRAMINE | -1 | 30 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 1204 | 1932 | 119 | 3H-Histamine | -501 | 24 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-Histamine | -501 | 24 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-Histamine | -501 | 24 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-Histamine | -501 | 24 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-Histamine | -501 | 24 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-Histamine | -501 | 24 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 11957566 | 184 | 25 | 3H-MEPYRAMINE | -812 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)cc(cc2)O)CCC | None | |||
| 1219 | 184 | 25 | 3H-MEPYRAMINE | -812 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)cc(cc2)O)CCC | None | |||
| 3296 | 184 | 25 | 3H-MEPYRAMINE | -812 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)cc(cc2)O)CCC | None | |||
| 950 | 184 | 25 | 3H-MEPYRAMINE | -812 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)cc(cc2)O)CCC | None | |||
| CHEMBL285755 | 184 | 25 | 3H-MEPYRAMINE | -812 | 9 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 247 | 5 | 1 | 2 | 3.4 | CCCN(C1CCc2c(C1)cc(cc2)O)CCC | None | |||
| 2142 | 3096 | 58 | 3H-MEPYRAMINE | -263 | 36 | Human | 4.8 | pKi | = | 4.8 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4920903 | 3096 | 58 | 3H-MEPYRAMINE | -263 | 36 | Human | 4.8 | pKi | = | 4.8 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 502 | 3096 | 58 | 3H-MEPYRAMINE | -263 | 36 | Human | 4.8 | pKi | = | 4.8 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 5775 | 3096 | 58 | 3H-MEPYRAMINE | -263 | 36 | Human | 4.8 | pKi | = | 4.8 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| CHEMBL597 | 3096 | 58 | 3H-MEPYRAMINE | -263 | 36 | Human | 4.8 | pKi | = | 4.8 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| DB00692 | 3096 | 58 | 3H-MEPYRAMINE | -263 | 36 | Human | 4.8 | pKi | = | 4.8 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 1621 | 2429 | 17 | 3H-PYRILAMINE | -4570 | 45 | Rat | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 17 | 2429 | 17 | 3H-PYRILAMINE | -4570 | 45 | Rat | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 5761 | 2429 | 17 | 3H-PYRILAMINE | -4570 | 45 | Rat | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| CHEMBL263881 | 2429 | 17 | 3H-PYRILAMINE | -4570 | 45 | Rat | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| DB04829 | 2429 | 17 | 3H-PYRILAMINE | -4570 | 45 | Rat | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 1209 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 203 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 3386 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL41 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| DB00472 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 45485535 | 197621 | 0 | UNDEFINED | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 399 | 7 | 1 | 2 | 5.6 | Cc1ccc(CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL570695 | 197621 | 0 | UNDEFINED | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 399 | 7 | 1 | 2 | 5.6 | Cc1ccc(CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 44395741 | 181581 | 0 | UNDEFINED | -10 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 360 | 6 | 0 | 3 | 4.3 | O=C(CCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | None | |||
| CHEMBL476935 | 181581 | 0 | UNDEFINED | -10 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 360 | 6 | 0 | 3 | 4.3 | O=C(CCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | None | |||
| CHEMBL558392 | 181581 | 0 | UNDEFINED | -10 | 10 | Human | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 360 | 6 | 0 | 3 | 4.3 | O=C(CCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | None | |||
| 1001 | 620 | 95 | 3H-MEPYRAMINE | -3 | 2 | Human | 3.8 | pKi | = | 3.8 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| 2144 | 620 | 95 | 3H-MEPYRAMINE | -3 | 2 | Human | 3.8 | pKi | = | 3.8 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| CHEMBL610 | 620 | 95 | 3H-MEPYRAMINE | -3 | 2 | Human | 3.8 | pKi | = | 3.8 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| DB04325 | 620 | 95 | 3H-MEPYRAMINE | -3 | 2 | Human | 3.8 | pKi | = | 3.8 | Binding | PDSP KiDatabase | 121 | 2 | 1 | 1 | 1.2 | NCCc1ccccc1 | None | |||
| 1427 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 1427 | 2013 | 54 | 3H-doxepin | -5 | 27 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-doxepin | -5 | 27 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-doxepin | -5 | 27 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-doxepin | -5 | 27 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Guinea pig | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-doxepin | -5 | 27 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 100 | 3805 | 58 | 3H-doxepin | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | 3H-doxepin | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | 3H-doxepin | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | 3H-doxepin | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | 3H-doxepin | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 44622869 | 197717 | 0 | UNDEFINED | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 371 | 5 | 1 | 2 | 5.1 | Cc1ccc(CN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL571390 | 197717 | 0 | UNDEFINED | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 371 | 5 | 1 | 2 | 5.1 | Cc1ccc(CN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 100 | 3805 | 58 | UNDEFINED | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | UNDEFINED | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | UNDEFINED | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | UNDEFINED | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | UNDEFINED | -7 | 55 | Human | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -346 | 67 | Rat | 6.8 | pKi | = | 6.8 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 12057539 | 208041 | 42 | 3H-doxepin | -676 | 20 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 3661 | 208041 | 42 | 3H-doxepin | -676 | 20 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| CHEMBL9751 | 208041 | 42 | 3H-doxepin | -676 | 20 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 186 | 1807 | 52 | 3H-PYRILAMINE | -269 | 17 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 295 | 5 | 1 | 2 | 3.7 | OC(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| 71781 | 1807 | 52 | 3H-PYRILAMINE | -269 | 17 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 295 | 5 | 1 | 2 | 3.7 | OC(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| CHEMBL18972 | 1807 | 52 | 3H-PYRILAMINE | -269 | 17 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 295 | 5 | 1 | 2 | 3.7 | OC(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | None | |||
| 2105 | 3054 | 37 | 3H-PYRILAMINE | -2754 | 33 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | None | |||
| 47811 | 3054 | 37 | 3H-PYRILAMINE | -2754 | 33 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | None | |||
| 48 | 3054 | 37 | 3H-PYRILAMINE | -2754 | 33 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | None | |||
| CHEMBL531 | 3054 | 37 | 3H-PYRILAMINE | -2754 | 33 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | None | |||
| DB01186 | 3054 | 37 | 3H-PYRILAMINE | -2754 | 33 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 314 | 4 | 1 | 2 | 4.3 | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3c1c2ccc3 | None | |||
| 135398737 | 958 | 93 | UNDEFINED | -4 | 89 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | UNDEFINED | -4 | 89 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | UNDEFINED | -4 | 89 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | UNDEFINED | -4 | 89 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | UNDEFINED | -4 | 89 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1224 | 1432 | 83 | 3H-MEPYRAMINE | -1 | 13 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-MEPYRAMINE | -1 | 13 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-MEPYRAMINE | -1 | 13 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-MEPYRAMINE | -1 | 13 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-MEPYRAMINE | -1 | 13 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-MEPYRAMINE | -1 | 13 | Rat | 7.8 | pKi | = | 7.8 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 1353 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| None | 216254 | 0 | 3H-MEPYRAMINE | -1412 | 19 | Guinea pig | 5.8 | pKi | = | 5.8 | Binding | PDSP KiDatabase | 416 | 9 | 3 | 4 | 2.8 | C1=CC(=CC=C1CCNC(N)SCCCC2=CN=CN2)I | None | |||
| None | 215992 | 0 | 3H-PYRILAMINE | -1 | 11 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 522 | 10 | 0 | 3 | 6.2 | C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 2274 | 3173 | 58 | UNDEFINED | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 4917 | 3173 | 58 | UNDEFINED | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 7279 | 3173 | 58 | UNDEFINED | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| CHEMBL728 | 3173 | 58 | UNDEFINED | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| DB00433 | 3173 | 58 | UNDEFINED | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 12057539 | 208041 | 42 | 3H-MEPYRAMINE | -3388 | 20 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 3661 | 208041 | 42 | 3H-MEPYRAMINE | -3388 | 20 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| CHEMBL9751 | 208041 | 42 | 3H-MEPYRAMINE | -3388 | 20 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 214 | 3860 | 58 | 3H-MEPYRAMINE | -218 | 30 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2740 | 3860 | 58 | 3H-MEPYRAMINE | -218 | 30 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5566 | 3860 | 58 | 3H-MEPYRAMINE | -218 | 30 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 66064 | 3860 | 58 | 3H-MEPYRAMINE | -218 | 30 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL422 | 3860 | 58 | 3H-MEPYRAMINE | -218 | 30 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00831 | 3860 | 58 | 3H-MEPYRAMINE | -218 | 30 | Rat | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 11653679 | 181191 | 1 | UNDEFINED | -28 | 11 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 374 | 6 | 0 | 3 | 4.7 | O=C(CCCN1CCCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | None | |||
| CHEMBL476108 | 181191 | 1 | UNDEFINED | -28 | 11 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 374 | 6 | 0 | 3 | 4.7 | O=C(CCCN1CCCN(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 | None | |||
| 1353 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1212 | 1662 | 50 | 3H-MEPYRAMINE | -38 | 65 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | 3H-MEPYRAMINE | -38 | 65 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | 3H-MEPYRAMINE | -38 | 65 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | 3H-MEPYRAMINE | -38 | 65 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | 3H-MEPYRAMINE | -38 | 65 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2274 | 3173 | 58 | 3H-doxepin | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 4917 | 3173 | 58 | 3H-doxepin | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 7279 | 3173 | 58 | 3H-doxepin | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| CHEMBL728 | 3173 | 58 | 3H-doxepin | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| DB00433 | 3173 | 58 | 3H-doxepin | -3 | 31 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 2337 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 2337 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | 3H-PYRILAMINE | -1 | 62 | Guinea pig | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 2389 | 3331 | 118 | UNDEFINED | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | UNDEFINED | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | UNDEFINED | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | UNDEFINED | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | UNDEFINED | -46 | 67 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 100 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | 3H-PYRILAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 1204 | 1932 | 119 | Functional | -501 | 24 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | Functional | -501 | 24 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | Functional | -501 | 24 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | Functional | -501 | 24 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | Functional | -501 | 24 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | Functional | -501 | 24 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| None | 217133 | 0 | UNDEFINED | -58 | 11 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 116 | 4 | 0 | 2 | 1.4 | CCCCN(C)N=O | None | |||
| 1353 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-doxepin | -489 | 83 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 2771 | 195017 | 74 | 3H-PYRILAMINE | -2 | 27 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1200781 | 195017 | 74 | 3H-PYRILAMINE | -2 | 27 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL549 | 195017 | 74 | 3H-PYRILAMINE | -2 | 27 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| 2771 | 195017 | 74 | 3H-PYRILAMINE | -9 | 27 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1200781 | 195017 | 74 | 3H-PYRILAMINE | -9 | 27 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL549 | 195017 | 74 | 3H-PYRILAMINE | -9 | 27 | Guinea pig | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| 46882181 | 5681 | 0 | UNDEFINED | 1 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 536 | 10 | 2 | 8 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NS(=O)(=O)c5ccccc5)ccc4o3)CC2)ccc1OC | None | |||
| CHEMBL1077908 | 5681 | 0 | UNDEFINED | 1 | 5 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 536 | 10 | 2 | 8 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NS(=O)(=O)c5ccccc5)ccc4o3)CC2)ccc1OC | None | |||
| 135398737 | 958 | 93 | 3H-Histamine | 2 | 89 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-Histamine | 2 | 89 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-Histamine | 2 | 89 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-Histamine | 2 | 89 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-Histamine | 2 | 89 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1400 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 3658 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 7199 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 91513 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL896 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00557 | 1957 | 70 | 3H-MEPYRAMINE | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1427 | 2013 | 54 | 3H-PYRILAMINE | -1 | 27 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-PYRILAMINE | -1 | 27 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-PYRILAMINE | -1 | 27 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-PYRILAMINE | -1 | 27 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-PYRILAMINE | -1 | 27 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 2284 | 3182 | 33 | 3H-doxepin | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 2284 | 3182 | 33 | UNDEFINED | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | 3H-doxepin | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | UNDEFINED | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | 3H-doxepin | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | UNDEFINED | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | 3H-doxepin | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | UNDEFINED | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | 3H-doxepin | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | UNDEFINED | 1 | 29 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 2600 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 2608 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 5405 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| CHEMBL17157 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| DB00342 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 46780481 | 107531 | 20 | 3H-PYRILAMINE | -11 | 53 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 9903970 | 107531 | 20 | 3H-PYRILAMINE | -11 | 53 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3187365 | 107531 | 20 | 3H-PYRILAMINE | -11 | 53 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3544974 | 107531 | 20 | 3H-PYRILAMINE | -11 | 53 | Rat | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 135398737 | 958 | 93 | 3H-trans-H2-PAT,(-) | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-trans-H2-PAT,(-) | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-trans-H2-PAT,(-) | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-trans-H2-PAT,(-) | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-trans-H2-PAT,(-) | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 2337 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 2564 | 206184 | 51 | 3H-MEPYRAMINE | 2 | 3 | Rat | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | None | |||
| CHEMBL864 | 206184 | 51 | 3H-MEPYRAMINE | 2 | 3 | Rat | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | None | |||
| None | 216176 | 0 | 3H-MEPYRAMINE | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 296 | 2 | 0 | 3 | 4.2 | CN1CCC(C1)CN2C3=CC=CC=C3SC4=CC=CC=C42 | None | |||
| 135398737 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 2284 | 3182 | 33 | 3H-MEPYRAMINE | -1 | 29 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | 3H-MEPYRAMINE | -1 | 29 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | 3H-MEPYRAMINE | -1 | 29 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | 3H-MEPYRAMINE | -1 | 29 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | 3H-MEPYRAMINE | -1 | 29 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 1227 | 2489 | 43 | 3H-PYRILAMINE | -2 | 12 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-PYRILAMINE | -2 | 12 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-PYRILAMINE | -2 | 12 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-PYRILAMINE | -2 | 12 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-PYRILAMINE | -2 | 12 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-PYRILAMINE | -2 | 12 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1210 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 16667681 | 216153 | 0 | 3H-MEPYRAMINE | 4 | 3 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 2286 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 4927 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7282 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL643 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01069 | 3183 | 51 | 3H-MEPYRAMINE | -2 | 30 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -52 | 67 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -52 | 67 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -52 | 67 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -52 | 67 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -52 | 67 | Guinea pig | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 90475904 | 216022 | 0 | 3H-trans-H2-PAT,(-) | -7 | 6 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 135398737 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | UNDEFINED | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-doxepin | 2 | 89 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1613 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 205 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3964 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| CHEMBL831 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| DB00408 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 135398745 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.6 | pKi | = | 8.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 135398737 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-pirilamine | -4 | 89 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 2286 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 4927 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7282 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL643 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01069 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 100 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | 3H-MEPYRAMINE | -23 | 55 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 11291 | 98796 | 25 | 3H-MEPYRAMINE | -4 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | None | |||
| CHEMBL278398 | 98796 | 25 | 3H-MEPYRAMINE | -4 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 261 | 1 | 0 | 1 | 3.9 | CN1CCC2=C(C1)C(c1ccccc1)c1ccccc12 | None | |||
| 45485473 | 197335 | 0 | UNDEFINED | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 457 | 9 | 1 | 4 | 5.4 | COC(=O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL568892 | 197335 | 0 | UNDEFINED | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 457 | 9 | 1 | 4 | 5.4 | COC(=O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 1212 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2995 | 204405 | 53 | 3H-MEPYRAMINE | -14 | 23 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-MEPYRAMINE | -14 | 23 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-MEPYRAMINE | -14 | 23 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1599 | 2341 | 50 | 3H-MEPYRAMINE | -2398 | 16 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | |||
| 3955 | 2341 | 50 | 3H-MEPYRAMINE | -2398 | 16 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | |||
| 7215 | 2341 | 50 | 3H-MEPYRAMINE | -2398 | 16 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | |||
| CHEMBL841 | 2341 | 50 | 3H-MEPYRAMINE | -2398 | 16 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | |||
| DB00836 | 2341 | 50 | 3H-MEPYRAMINE | -2398 | 16 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 476 | 7 | 1 | 3 | 5.1 | Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1 | None | |||
| 12057539 | 208041 | 42 | 3H-MEPYRAMINE | -3715 | 20 | Rat | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 3661 | 208041 | 42 | 3H-MEPYRAMINE | -3715 | 20 | Rat | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| CHEMBL9751 | 208041 | 42 | 3H-MEPYRAMINE | -3715 | 20 | Rat | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 10456093 | 197509 | 0 | UNDEFINED | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 443 | 9 | 2 | 3 | 5.4 | O=C(O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL570033 | 197509 | 0 | UNDEFINED | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 443 | 9 | 2 | 3 | 5.4 | O=C(O)c1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 44591134 | 176200 | 0 | UNDEFINED | -169 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 535 | 11 | 0 | 5 | 7.7 | CN(CCCN1c2ccccc2Sc2ccc(Cl)cc21)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| CHEMBL459373 | 176200 | 0 | UNDEFINED | -169 | 6 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 535 | 11 | 0 | 5 | 7.7 | CN(CCCN1c2ccccc2Sc2ccc(Cl)cc21)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1212 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 1212 | 1662 | 50 | 3H-doxepin | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | 3H-doxepin | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | 3H-doxepin | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | 3H-doxepin | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | 3H-doxepin | -41 | 65 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2337 | 3256 | 77 | UNDEFINED | -1 | 62 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | UNDEFINED | -1 | 62 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | UNDEFINED | -1 | 62 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | UNDEFINED | -1 | 62 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | UNDEFINED | -1 | 62 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 37459 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 62 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| CHEMBL8514 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 16667681 | 216153 | 0 | 3H-trans-H2-PAT,(-) | 4 | 3 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 1830 | 2590 | 44 | 3H-PYRILAMINE | -125 | 28 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 207 | 2590 | 44 | 3H-PYRILAMINE | -125 | 28 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 23897 | 2590 | 44 | 3H-PYRILAMINE | -125 | 28 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| CHEMBL460 | 2590 | 44 | 3H-PYRILAMINE | -125 | 28 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| DB01618 | 2590 | 44 | 3H-PYRILAMINE | -125 | 28 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 446220 | 133521 | 14 | 3H-PYRILAMINE | -19 | 45 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 303 | 3 | 0 | 5 | 1.9 | COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1N2C | None | |||
| CHEMBL370805 | 133521 | 14 | 3H-PYRILAMINE | -19 | 45 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 303 | 3 | 0 | 5 | 1.9 | COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1N2C | None | |||
| 1615 | 167791 | 24 | 3H-PYRILAMINE | -5 | 44 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 193 | 3 | 1 | 3 | 1.6 | CNC(C)Cc1ccc2c(c1)OCO2 | None | |||
| CHEMBL43048 | 167791 | 24 | 3H-PYRILAMINE | -5 | 44 | Human | 5.7 | pKi | = | 5.7 | Binding | PDSP KiDatabase | 193 | 3 | 1 | 3 | 1.6 | CNC(C)Cc1ccc2c(c1)OCO2 | None | |||
| 1353 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 2284 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 100 | 3805 | 58 | 3H-MEPYRAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | 3H-MEPYRAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | 3H-MEPYRAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | 3H-MEPYRAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | 3H-MEPYRAMINE | -7 | 55 | Human | 7.7 | pKi | = | 7.7 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 213 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 2717 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 5533 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| CHEMBL621 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| DB00656 | 3853 | 55 | 3H-PYRILAMINE | -8 | 44 | Human | 6.7 | pKi | = | 6.7 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.7 | pKi | = | 4.7 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | -2 | 89 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 202 | 1508 | 77 | 3H-PYRILAMINE | -1 | 30 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| 60835 | 1508 | 77 | 3H-PYRILAMINE | -1 | 30 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| 972 | 1508 | 77 | 3H-PYRILAMINE | -1 | 30 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| CHEMBL1175 | 1508 | 77 | 3H-PYRILAMINE | -1 | 30 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| DB00476 | 1508 | 77 | 3H-PYRILAMINE | -1 | 30 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 2181 | 3128 | 46 | 3H-PYRILAMINE | -269 | 35 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 4830 | 3128 | 46 | 3H-PYRILAMINE | -269 | 35 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 92 | 3128 | 46 | 3H-PYRILAMINE | -269 | 35 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| CHEMBL440294 | 3128 | 46 | 3H-PYRILAMINE | -269 | 35 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| DB09286 | 3128 | 46 | 3H-PYRILAMINE | -269 | 35 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 16362 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 2172 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 90 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| CHEMBL1423 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| DB01100 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 242 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 34 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 60795 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| CHEMBL1112 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| DB01238 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 4034 | 55822 | 55 | 3H-MEPYRAMINE | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 390 | 5 | 0 | 2 | 5.6 | Cc1cccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)c1 | None | |||
| CHEMBL1623 | 55822 | 55 | 3H-MEPYRAMINE | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 390 | 5 | 0 | 2 | 5.6 | Cc1cccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)c1 | None | |||
| 2995 | 204405 | 53 | 3H-MEPYRAMINE | -12 | 23 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 2995 | 204405 | 53 | 3H-MEPYRAMINE | -42 | 23 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-MEPYRAMINE | -12 | 23 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-MEPYRAMINE | -42 | 23 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-MEPYRAMINE | -12 | 23 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-MEPYRAMINE | -42 | 23 | Rat | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 1353 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-MEPYRAMINE | -489 | 83 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1242 | 3613 | 27 | 3H-MEPYRAMINE | -147 | 18 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 255 | 1 | 3 | 3 | 2.4 | Oc1cc2CCNCC(c2cc1O)c1ccccc1 | None | |||
| 935 | 3613 | 27 | 3H-MEPYRAMINE | -147 | 18 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 255 | 1 | 3 | 3 | 2.4 | Oc1cc2CCNCC(c2cc1O)c1ccccc1 | None | |||
| CHEMBL286080 | 3613 | 27 | 3H-MEPYRAMINE | -147 | 18 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 255 | 1 | 3 | 3 | 2.4 | Oc1cc2CCNCC(c2cc1O)c1ccccc1 | None | |||
| 9906978 | 42711 | 2 | UNDEFINED | -28 | 12 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | None | |||
| CHEMBL150161 | 42711 | 2 | UNDEFINED | -28 | 12 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 361 | 6 | 1 | 3 | 4.0 | O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)C1)c1ccc(F)cc1 | None | |||
| 2726 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 1427 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-MEPYRAMINE | -1 | 27 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| None | 216924 | 0 | UNDEFINED | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 333 | 5 | 1 | 4 | 3.5 | COC1=C(C=CC(=C1)Cl)OC(C2CNCCO2)C3=CC=CC=C3 | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 54477 | 84653 | 36 | UNDEFINED | -70 | 23 | Rat | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 370 | 6 | 1 | 4 | 2.7 | CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC | None | |||
| CHEMBL22242 | 84653 | 36 | UNDEFINED | -70 | 23 | Rat | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 370 | 6 | 1 | 4 | 2.7 | CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC | None | |||
| 11848679 | 89244 | 0 | UNDEFINED | -204 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 489 | 9 | 3 | 9 | 2.9 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)cc(OCC)c1N | None | |||
| CHEMBL236788 | 89244 | 0 | UNDEFINED | -204 | 6 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 489 | 9 | 3 | 9 | 2.9 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)cc(OCC)c1N | None | |||
| 24740863 | 89158 | 0 | UNDEFINED | -3 | 6 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 385 | 6 | 1 | 5 | 5.0 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1Cl | None | |||
| CHEMBL236610 | 89158 | 0 | UNDEFINED | -3 | 6 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 385 | 6 | 1 | 5 | 5.0 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1Cl | None | |||
| 1170 | 1633 | 75 | UNDEFINED | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 3348 | 1633 | 75 | UNDEFINED | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 4819 | 1633 | 75 | UNDEFINED | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 74685737 | 1633 | 75 | UNDEFINED | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| CHEMBL914 | 1633 | 75 | UNDEFINED | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| DB00950 | 1633 | 75 | UNDEFINED | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 11954259 | 215979 | 0 | 3H-MEPYRAMINE | -89 | 43 | Rat | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C | None | |||
| 2470 | 3653 | 50 | 3H-MEPYRAMINE | -81283 | 59 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3300 | 3653 | 50 | 3H-MEPYRAMINE | -81283 | 59 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 5265 | 3653 | 50 | 3H-MEPYRAMINE | -81283 | 59 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 99 | 3653 | 50 | 3H-MEPYRAMINE | -81283 | 59 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL267930 | 3653 | 50 | 3H-MEPYRAMINE | -81283 | 59 | Guinea pig | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 4528 | 98126 | 80 | 3H-doxepin | -1 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| CHEMBL273575 | 98126 | 80 | 3H-doxepin | -1 | 10 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 4.6 | pKi | = | 4.6 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 2470 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3300 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 5265 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 99 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL267930 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 1223 | 953 | 41 | 3H-MEPYRAMINE | -14125 | 11 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 308 | 6 | 2 | 3 | 3.2 | Clc1ccc(cc1)CN=C(SCCCc1cnc[nH]1)N | None | |||
| 2790 | 953 | 41 | 3H-MEPYRAMINE | -14125 | 11 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 308 | 6 | 2 | 3 | 3.2 | Clc1ccc(cc1)CN=C(SCCCc1cnc[nH]1)N | None | |||
| CHEMBL14690 | 953 | 41 | 3H-MEPYRAMINE | -14125 | 11 | Human | 5.6 | pKi | = | 5.6 | Binding | PDSP KiDatabase | 308 | 6 | 2 | 3 | 3.2 | Clc1ccc(cc1)CN=C(SCCCc1cnc[nH]1)N | None | |||
| None | 216100 | 0 | 3H-PYRILAMINE | -3 | 3 | Guinea pig | 7.6 | pKi | = | 7.6 | Binding | PDSP KiDatabase | 485 | 10 | 1 | 8 | 3.0 | CC(C1=NN(C(=O)N1CCOC2=CC=CC=C2)CCCN3CCN(CC3)C4=CC=C(C=C4)Cl)O | None | |||
| 2771 | 195017 | 74 | 3H-PYRILAMINE | -9 | 27 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| 2771 | 195017 | 74 | 3H-PYRILAMINE | -2 | 27 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1200781 | 195017 | 74 | 3H-PYRILAMINE | -9 | 27 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1200781 | 195017 | 74 | 3H-PYRILAMINE | -2 | 27 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL549 | 195017 | 74 | 3H-PYRILAMINE | -9 | 27 | Guinea pig | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL549 | 195017 | 74 | 3H-PYRILAMINE | -2 | 27 | Human | 6.6 | pKi | = | 6.6 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| 242 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 34 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 60795 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| CHEMBL1112 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| DB01238 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 213 | 3853 | 55 | 3H-PYRILAMINE | -2 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 2717 | 3853 | 55 | 3H-PYRILAMINE | -2 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 5533 | 3853 | 55 | 3H-PYRILAMINE | -2 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| CHEMBL621 | 3853 | 55 | 3H-PYRILAMINE | -2 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| DB00656 | 3853 | 55 | 3H-PYRILAMINE | -2 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 444 | 206666 | 53 | 3H-PYRILAMINE | -6 | 18 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 239 | 3 | 1 | 2 | 3.3 | CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1 | None | |||
| CHEMBL894 | 206666 | 53 | 3H-PYRILAMINE | -6 | 18 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 239 | 3 | 1 | 2 | 3.3 | CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1 | None | |||
| 242 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 34 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 60795 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| CHEMBL1112 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| DB01238 | 470 | 124 | 3H-PYRILAMINE | -22 | 51 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| None | 217161 | 0 | UNDEFINED | -190 | 6 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 532 | 10 | 0 | 4 | 8.0 | CN(CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)CC4=CC=C(C=C4)OCCCN5CCCCC5 | None | |||
| 2402 | 3370 | 62 | 3H-PYRILAMINE | -194 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
| 5095 | 3370 | 62 | 3H-PYRILAMINE | -194 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
| 7295 | 3370 | 62 | 3H-PYRILAMINE | -194 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
| CHEMBL589 | 3370 | 62 | 3H-PYRILAMINE | -194 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
| DB00268 | 3370 | 62 | 3H-PYRILAMINE | -194 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 260 | 7 | 1 | 2 | 3.5 | CCCN(CCC)CCc1cccc2c1CC(=N2)O | None | |||
| 1210 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | 3H-MEPYRAMINE | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2726 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | 2 | 89 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 277 | 1301 | 62 | 3H-MEPYRAMINE | -3 | 50 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 2913 | 1301 | 62 | 3H-MEPYRAMINE | -3 | 50 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 765 | 1301 | 62 | 3H-MEPYRAMINE | -3 | 50 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| CHEMBL516 | 1301 | 62 | 3H-MEPYRAMINE | -3 | 50 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| DB00434 | 1301 | 62 | 3H-MEPYRAMINE | -3 | 50 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | None | |||
| 3103 | 41658 | 49 | 3H-MEPYRAMINE | 1 | 4 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| CHEMBL1492 | 41658 | 49 | 3H-MEPYRAMINE | 1 | 4 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| 1222 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2678 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 581 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1000 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00341 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2600 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 2608 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 5405 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| CHEMBL17157 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| DB00342 | 3779 | 74 | 3H-MEPYRAMINE | 1 | 13 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -3 | 12 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -3 | 12 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -3 | 12 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -3 | 12 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -3 | 12 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -3 | 12 | Mouse | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2286 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 4927 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7282 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL643 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01069 | 3183 | 51 | 3H-MEPYRAMINE | -1 | 30 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 3103 | 41658 | 49 | 3H-MEPYRAMINE | -1 | 4 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| CHEMBL1492 | 41658 | 49 | 3H-MEPYRAMINE | -1 | 4 | Rat | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| 55482 | 216150 | 0 | 3H-MEPYRAMINE | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 441 | 8 | 2 | 5 | 4.0 | CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCCC3=NC=C(C=C3C)Br | None | |||
| 103 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 2875 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 5736 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL285802 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB09225 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 135409468 | 2035 | 69 | 3H-PYRILAMINE | -1 | 39 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 312 | 1 | 2 | 4 | 1.7 | Clc1ccc2c(c1)NC(=c1c(=N2)cccc1)N1CCNCC1 | None | |||
| 333 | 2035 | 69 | 3H-PYRILAMINE | -1 | 39 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 312 | 1 | 2 | 4 | 1.7 | Clc1ccc2c(c1)NC(=c1c(=N2)cccc1)N1CCNCC1 | None | |||
| CHEMBL845 | 2035 | 69 | 3H-PYRILAMINE | -1 | 39 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 312 | 1 | 2 | 4 | 1.7 | Clc1ccc2c(c1)NC(=c1c(=N2)cccc1)N1CCNCC1 | None | |||
| 103 | 4153 | 61 | 3H-PYRILAMINE | -2 | 53 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 2875 | 4153 | 61 | 3H-PYRILAMINE | -2 | 53 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 5736 | 4153 | 61 | 3H-PYRILAMINE | -2 | 53 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL285802 | 4153 | 61 | 3H-PYRILAMINE | -2 | 53 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB09225 | 4153 | 61 | 3H-PYRILAMINE | -2 | 53 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 115237 | 55585 | 119 | 3H-PYRILAMINE | -36 | 54 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| CHEMBL1621 | 55585 | 119 | 3H-PYRILAMINE | -36 | 54 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | -2 | 65 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | -2 | 65 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | -2 | 65 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | -2 | 65 | Guinea pig | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -5 | 4 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 11976 | 920 | 59 | UNDEFINED | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| 667467 | 920 | 59 | UNDEFINED | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| CHEMBL908 | 920 | 59 | UNDEFINED | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| DB01239 | 920 | 59 | UNDEFINED | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1890 | 2759 | 49 | 3H-PYRILAMINE | -4 | 16 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 4449 | 2759 | 49 | 3H-PYRILAMINE | -4 | 16 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 7247 | 2759 | 49 | 3H-PYRILAMINE | -4 | 16 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| CHEMBL623 | 2759 | 49 | 3H-PYRILAMINE | -4 | 16 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| DB01149 | 2759 | 49 | 3H-PYRILAMINE | -4 | 16 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 1971 | 2866 | 38 | 3H-MEPYRAMINE | -6 | 30 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2404 | 2866 | 38 | 3H-MEPYRAMINE | -6 | 30 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 4543 | 2866 | 38 | 3H-MEPYRAMINE | -6 | 30 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| CHEMBL445 | 2866 | 38 | 3H-MEPYRAMINE | -6 | 30 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| DB00540 | 2866 | 38 | 3H-MEPYRAMINE | -6 | 30 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2284 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | 3H-MEPYRAMINE | -10 | 29 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 90475904 | 216022 | 0 | 3H-doxepin | -7 | 6 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 | None | |||
| 134 | 2514 | 24 | 3H-MEPYRAMINE | -2570 | 67 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 134 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1775 | 2514 | 24 | 3H-MEPYRAMINE | -2570 | 67 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1775 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 9681 | 2514 | 24 | 3H-MEPYRAMINE | -2570 | 67 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 9681 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| CHEMBL1065 | 2514 | 24 | 3H-MEPYRAMINE | -2570 | 67 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| CHEMBL1065 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| DB00247 | 2514 | 24 | 3H-MEPYRAMINE | -2570 | 67 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| DB00247 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 125564 | 666 | 97 | 3H-PYRILAMINE | -5248 | 7 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 367 | 3 | 0 | 3 | 4.7 | CCN1CCN(CC1)c1nc2CCCCCCc2c(c1)c1ccc(cc1)F | None | |||
| 388 | 666 | 97 | 3H-PYRILAMINE | -5248 | 7 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 367 | 3 | 0 | 3 | 4.7 | CCN1CCN(CC1)c1nc2CCCCCCc2c(c1)c1ccc(cc1)F | None | |||
| 7670 | 666 | 97 | 3H-PYRILAMINE | -5248 | 7 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 367 | 3 | 0 | 3 | 4.7 | CCN1CCN(CC1)c1nc2CCCCCCc2c(c1)c1ccc(cc1)F | None | |||
| CHEMBL178803 | 666 | 97 | 3H-PYRILAMINE | -5248 | 7 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 367 | 3 | 0 | 3 | 4.7 | CCN1CCN(CC1)c1nc2CCCCCCc2c(c1)c1ccc(cc1)F | None | |||
| DB09223 | 666 | 97 | 3H-PYRILAMINE | -5248 | 7 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 367 | 3 | 0 | 3 | 4.7 | CCN1CCN(CC1)c1nc2CCCCCCc2c(c1)c1ccc(cc1)F | None | |||
| 1427 | 2013 | 54 | 3H-Histamine | -1 | 27 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-Histamine | -1 | 27 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-Histamine | -1 | 27 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-Histamine | -1 | 27 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-Histamine | -1 | 27 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 2995 | 204405 | 53 | 3H-PYRILAMINE | -12 | 23 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 2995 | 204405 | 53 | 3H-PYRILAMINE | -14 | 23 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-PYRILAMINE | -12 | 23 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-PYRILAMINE | -14 | 23 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-PYRILAMINE | -12 | 23 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-PYRILAMINE | -14 | 23 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 37459 | 746 | 13 | 3H-MEPYRAMINE | -7244 | 25 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 62 | 746 | 13 | 3H-MEPYRAMINE | -7244 | 25 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| CHEMBL8514 | 746 | 13 | 3H-MEPYRAMINE | -7244 | 25 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 40589 | 216144 | 0 | 3H-PYRILAMINE | -5 | 8 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 377 | 7 | 0 | 6 | 2.5 | CCC1=NN(C(=O)N1CC)CCCN2CCN(CC2)C3=CC(=CC=C3)Cl | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 115237 | 55585 | 119 | 3H-PYRILAMINE | -36 | 54 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| CHEMBL1621 | 55585 | 119 | 3H-PYRILAMINE | -36 | 54 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| 2435 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 60149 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 98 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| CHEMBL12713 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| DB06144 | 3590 | 83 | 3H-PYRILAMINE | -95 | 48 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 1209 | 1658 | 75 | 3H-MEPYRAMINE | -602 | 32 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 203 | 1658 | 75 | 3H-MEPYRAMINE | -602 | 32 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 3386 | 1658 | 75 | 3H-MEPYRAMINE | -602 | 32 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL41 | 1658 | 75 | 3H-MEPYRAMINE | -602 | 32 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| DB00472 | 1658 | 75 | 3H-MEPYRAMINE | -602 | 32 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 108107 | 79944 | 38 | 3H-MEPYRAMINE | -5 | 16 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 319 | 3 | 4 | 5 | 0.5 | N/C(=N\C(=O)c1nc(Cl)c(N)nc1N)NCc1ccccc1 | None | |||
| 156592250 | 79944 | 38 | 3H-MEPYRAMINE | -5 | 16 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 319 | 3 | 4 | 5 | 0.5 | N/C(=N\C(=O)c1nc(Cl)c(N)nc1N)NCc1ccccc1 | None | |||
| CHEMBL1256878 | 79944 | 38 | 3H-MEPYRAMINE | -5 | 16 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 319 | 3 | 4 | 5 | 0.5 | N/C(=N\C(=O)c1nc(Cl)c(N)nc1N)NCc1ccccc1 | None | |||
| CHEMBL212579 | 79944 | 38 | 3H-MEPYRAMINE | -5 | 16 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 319 | 3 | 4 | 5 | 0.5 | N/C(=N\C(=O)c1nc(Cl)c(N)nc1N)NCc1ccccc1 | None | |||
| 45485498 | 197671 | 0 | UNDEFINED | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 231 | 5 | 0 | 1 | 3.8 | Cc1ccc(CCCCN2CCCCC2)cc1 | None | |||
| CHEMBL571073 | 197671 | 0 | UNDEFINED | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 231 | 5 | 0 | 1 | 3.8 | Cc1ccc(CCCCN2CCCCC2)cc1 | None | |||
| 7153 | 98020 | 77 | 3H-PYRILAMINE | -16 | 34 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 214 | 3 | 1 | 2 | 2.5 | Cc1cc(Cl)ccc1OC(C)C(=O)O | None | |||
| CHEMBL272942 | 98020 | 77 | 3H-PYRILAMINE | -16 | 34 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 214 | 3 | 1 | 2 | 2.5 | Cc1cc(Cl)ccc1OC(C)C(=O)O | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 1221 | 475 | 9 | 3H-MEPYRAMINE | 2 | 3 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | None | |||
| 65895 | 475 | 9 | 3H-MEPYRAMINE | 2 | 3 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | None | |||
| CHEMBL293802 | 475 | 9 | 3H-MEPYRAMINE | 2 | 3 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | None | |||
| 1353 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 2142 | 3096 | 58 | 3H-MEPYRAMINE | -1258 | 36 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4920903 | 3096 | 58 | 3H-MEPYRAMINE | -1258 | 36 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 502 | 3096 | 58 | 3H-MEPYRAMINE | -1258 | 36 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 5775 | 3096 | 58 | 3H-MEPYRAMINE | -1258 | 36 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| CHEMBL597 | 3096 | 58 | 3H-MEPYRAMINE | -1258 | 36 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| DB00692 | 3096 | 58 | 3H-MEPYRAMINE | -1258 | 36 | Guinea pig | 5.5 | pKi | = | 5.5 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 134 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 4.5 | pKi | = | 4.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1775 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 4.5 | pKi | = | 4.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 9681 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 4.5 | pKi | = | 4.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| CHEMBL1065 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 4.5 | pKi | = | 4.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| DB00247 | 2514 | 24 | 3H-MEPYRAMINE | -15488 | 67 | Rat | 4.5 | pKi | = | 4.5 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 2601 | 3780 | 33 | 3H-PYRILAMINE | -389 | 21 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 443951 | 3780 | 33 | 3H-PYRILAMINE | -389 | 21 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 56 | 3780 | 33 | 3H-PYRILAMINE | -389 | 21 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| CHEMBL73151 | 3780 | 33 | 3H-PYRILAMINE | -389 | 21 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| DB13399 | 3780 | 33 | 3H-PYRILAMINE | -389 | 21 | Guinea pig | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 340 | 3 | 2 | 2 | 2.9 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 100 | 3805 | 58 | 3H-MEPYRAMINE | -16 | 55 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | 3H-MEPYRAMINE | -16 | 55 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | 3H-MEPYRAMINE | -16 | 55 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | 3H-MEPYRAMINE | -16 | 55 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | 3H-MEPYRAMINE | -16 | 55 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 1588 | 2325 | 27 | 3H-PYRILAMINE | -100 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 28864 | 2325 | 27 | 3H-PYRILAMINE | -100 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 43 | 2325 | 27 | 3H-PYRILAMINE | -100 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| CHEMBL157138 | 2325 | 27 | 3H-PYRILAMINE | -100 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| DB00589 | 2325 | 27 | 3H-PYRILAMINE | -100 | 44 | Guinea pig | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 2762 | 3863 | 31 | 3H-MEPYRAMINE | 9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| 5587 | 3863 | 31 | 3H-MEPYRAMINE | 9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| 7318 | 3863 | 31 | 3H-MEPYRAMINE | 9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| CHEMBL1241 | 3863 | 31 | 3H-MEPYRAMINE | 9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| DB00792 | 3863 | 31 | 3H-MEPYRAMINE | 9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 3 | 2.7 | CN(CCN(c1ccccn1)Cc1ccccc1)C | None | |||
| 4528 | 98126 | 80 | 3H-PYRILAMINE | -7 | 10 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| CHEMBL273575 | 98126 | 80 | 3H-PYRILAMINE | -7 | 10 | Rat | 7.5 | pKi | = | 7.5 | Binding | PDSP KiDatabase | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| 2771 | 195017 | 74 | 3H-MEPYRAMINE | -6 | 27 | Rat | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1200781 | 195017 | 74 | 3H-MEPYRAMINE | -6 | 27 | Rat | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL549 | 195017 | 74 | 3H-MEPYRAMINE | -6 | 27 | Rat | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| 1221 | 475 | 9 | 3H-MEPYRAMINE | -12 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | None | |||
| 65895 | 475 | 9 | 3H-MEPYRAMINE | -12 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | None | |||
| CHEMBL293802 | 475 | 9 | 3H-MEPYRAMINE | -12 | 3 | Human | 6.5 | pKi | = | 6.5 | Binding | PDSP KiDatabase | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | None | |||
| 2726 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-MEPYRAMINE | -17 | 72 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 135398737 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 3947 | 206395 | 53 | 3H-PYRILAMINE | -7 | 16 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | None | |||
| CHEMBL87708 | 206395 | 53 | 3H-PYRILAMINE | -7 | 16 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | None | |||
| 11848625 | 5792 | 0 | UNDEFINED | -38 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 451 | 8 | 1 | 7 | 4.9 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)cc(OC2CCOCC2)c1 | None | |||
| CHEMBL1078745 | 5792 | 0 | UNDEFINED | -38 | 6 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 451 | 8 | 1 | 7 | 4.9 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)cc(OC2CCOCC2)c1 | None | |||
| 16667681 | 216153 | 0 | 3H-MEPYRAMINE | 4 | 3 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -602 | 83 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1427 | 2013 | 54 | 3H-PYRILAMINE | -5 | 27 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 357 | 2013 | 54 | 3H-PYRILAMINE | -5 | 27 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 3696 | 2013 | 54 | 3H-PYRILAMINE | -5 | 27 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL11 | 2013 | 54 | 3H-PYRILAMINE | -5 | 27 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00458 | 2013 | 54 | 3H-PYRILAMINE | -5 | 27 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | None | |||
| 1890 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 1890 | 2759 | 49 | 3H-MEPYRAMINE | -57 | 16 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 4449 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 4449 | 2759 | 49 | 3H-MEPYRAMINE | -57 | 16 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 7247 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 7247 | 2759 | 49 | 3H-MEPYRAMINE | -57 | 16 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| CHEMBL623 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| CHEMBL623 | 2759 | 49 | 3H-MEPYRAMINE | -57 | 16 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| DB01149 | 2759 | 49 | 3H-PYRILAMINE | -44 | 16 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| DB01149 | 2759 | 49 | 3H-MEPYRAMINE | -57 | 16 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 1353 | 1911 | 93 | 3H-pirilamine | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-pirilamine | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-pirilamine | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-pirilamine | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-pirilamine | -602 | 83 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 6852400 | 215937 | 0 | UNDEFINED | -977 | 22 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | CC(C)(C)C1(CCN2CC3C4=CC=CC=C4CCC5=C3C(=CC=C5)C2C1)O | None | |||
| 73759726 | 215937 | 0 | UNDEFINED | -977 | 22 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | CC(C)(C)C1(CCN2CC3C4=CC=CC=C4CCC5=C3C(=CC=C5)C2C1)O | None | |||
| 44622872 | 197716 | 0 | UNDEFINED | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 413 | 8 | 1 | 2 | 6.0 | Cc1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL571389 | 197716 | 0 | UNDEFINED | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 413 | 8 | 1 | 2 | 6.0 | Cc1ccc(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 25212275 | 174421 | 0 | UNDEFINED | -9332 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 682 | 13 | 0 | 8 | 7.4 | O=C(OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1)c1ccc(OCCCN2CCCCC2)cc1 | None | |||
| CHEMBL455288 | 174421 | 0 | UNDEFINED | -9332 | 6 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 682 | 13 | 0 | 8 | 7.4 | O=C(OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1)c1ccc(OCCCN2CCCCC2)cc1 | None | |||
| 6852400 | 215937 | 0 | 3H-doxepin | -977 | 22 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | CC(C)(C)C1(CCN2CC3C4=CC=CC=C4CCC5=C3C(=CC=C5)C2C1)O | None | |||
| 73759726 | 215937 | 0 | 3H-doxepin | -977 | 22 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | CC(C)(C)C1(CCN2CC3C4=CC=CC=C4CCC5=C3C(=CC=C5)C2C1)O | None | |||
| 3025067 | 99382 | 64 | 3H-MEPYRAMINE | -199 | 15 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 220 | 1 | 1 | 4 | 0.9 | c1cc2c(c(N3CCNCC3)c1)OCCO2 | None | |||
| 65853 | 99382 | 64 | 3H-MEPYRAMINE | -199 | 15 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 220 | 1 | 1 | 4 | 0.9 | c1cc2c(c(N3CCNCC3)c1)OCCO2 | None | |||
| CHEMBL282614 | 99382 | 64 | 3H-MEPYRAMINE | -199 | 15 | Rat | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 220 | 1 | 1 | 4 | 0.9 | c1cc2c(c(N3CCNCC3)c1)OCCO2 | None | |||
| 1613 | 2348 | 53 | 3H-Histamine | -3 | 44 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 205 | 2348 | 53 | 3H-Histamine | -3 | 44 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3964 | 2348 | 53 | 3H-Histamine | -3 | 44 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| CHEMBL831 | 2348 | 53 | 3H-Histamine | -3 | 44 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| DB00408 | 2348 | 53 | 3H-Histamine | -3 | 44 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 135398737 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-MEPYRAMINE | -2 | 89 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1227 | 2489 | 43 | 3H-doxepin | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-doxepin | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-doxepin | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-doxepin | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-doxepin | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-doxepin | -2 | 12 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2286 | 3183 | 51 | 3H-PYRILAMINE | -1 | 30 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 4927 | 3183 | 51 | 3H-PYRILAMINE | -1 | 30 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7282 | 3183 | 51 | 3H-PYRILAMINE | -1 | 30 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL643 | 3183 | 51 | 3H-PYRILAMINE | -1 | 30 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01069 | 3183 | 51 | 3H-PYRILAMINE | -1 | 30 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 11954259 | 215979 | 0 | 3H-PYRILAMINE | -19 | 43 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C | None | |||
| 20980871 | 216430 | 0 | 3H-MEPYRAMINE | 4 | 8 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 295 | 3 | 0 | 2 | 4.7 | CN(C)CCC=C1C2=CC=CC=C2CSC3=CC=CC=C31 | None | |||
| 135 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-MEPYRAMINE | 1 | 58 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 180 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2554 | 796 | 119 | None | 1 | 8 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| 489 | 796 | 119 | None | 1 | 8 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| 5339 | 796 | 119 | None | 1 | 8 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| CHEMBL108 | 796 | 119 | None | 1 | 8 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| DB00564 | 796 | 119 | None | 1 | 8 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 236 | 0 | 1 | 1 | 3.4 | NC(=O)N1c2ccccc2C=Cc2c1cccc2 | None | |||
| 135 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | 3H-PYRILAMINE | -1 | 58 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 2284 | 3182 | 33 | 3H-MEPYRAMINE | 1 | 29 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | 3H-MEPYRAMINE | 1 | 29 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | 3H-MEPYRAMINE | 1 | 29 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | 3H-MEPYRAMINE | 1 | 29 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | 3H-MEPYRAMINE | 1 | 29 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 2726 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 135398745 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-pirilamine | -1 | 65 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 11954259 | 215979 | 0 | 3H-doxepin | -19 | 43 | Human | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C | None | |||
| 2726 | 919 | 68 | 3H-MEPYRAMINE | -6 | 72 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-MEPYRAMINE | -6 | 72 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-MEPYRAMINE | -6 | 72 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-MEPYRAMINE | -6 | 72 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-MEPYRAMINE | -6 | 72 | Guinea pig | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -5 | 12 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -5 | 12 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -5 | 12 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -5 | 12 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -5 | 12 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -5 | 12 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4098 | 32505 | 30 | 3H-MEPYRAMINE | -1 | 11 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | None | |||
| CHEMBL1255739 | 32505 | 30 | 3H-MEPYRAMINE | -1 | 11 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | None | |||
| CHEMBL1411979 | 32505 | 30 | 3H-MEPYRAMINE | -1 | 11 | Rat | 8.4 | pKi | = | 8.4 | Binding | PDSP KiDatabase | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | None | |||
| 2865 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 2303 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 4946 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 564 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 63 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 91536 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| CHEMBL27 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| CHEMBL452861 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| DB00571 | 3187 | 68 | None | -363 | 26 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 1227 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | 3H-MEPYRAMINE | -2 | 12 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 6834 | 205552 | 45 | 3H-MEPYRAMINE | 1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | None | |||
| CHEMBL811 | 205552 | 45 | 3H-MEPYRAMINE | 1 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | None | |||
| 3103 | 41658 | 49 | 3H-MEPYRAMINE | -1 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| CHEMBL1492 | 41658 | 49 | 3H-MEPYRAMINE | -1 | 4 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| 90475904 | 216022 | 0 | 3H-MEPYRAMINE | -7 | 6 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 | None | |||
| 1613 | 2348 | 53 | 3H-doxepin | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 205 | 2348 | 53 | 3H-doxepin | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3964 | 2348 | 53 | 3H-doxepin | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| CHEMBL831 | 2348 | 53 | 3H-doxepin | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| DB00408 | 2348 | 53 | 3H-doxepin | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | 1 | 65 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 2564 | 206184 | 51 | 3H-MEPYRAMINE | -2 | 3 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | None | |||
| CHEMBL864 | 206184 | 51 | 3H-MEPYRAMINE | -2 | 3 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | None | |||
| 1212 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | UNDEFINED | -41 | 65 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2600 | 3779 | 74 | UNDEFINED | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 2608 | 3779 | 74 | UNDEFINED | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 5405 | 3779 | 74 | UNDEFINED | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| CHEMBL17157 | 3779 | 74 | UNDEFINED | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| DB00342 | 3779 | 74 | UNDEFINED | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 25212276 | 190066 | 0 | UNDEFINED | -112 | 6 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 508 | 11 | 0 | 3 | 7.4 | CN(CCCC12CCC(c3ccccc31)c1ccccc12)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| CHEMBL517244 | 190066 | 0 | UNDEFINED | -112 | 6 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 508 | 11 | 0 | 3 | 7.4 | CN(CCCC12CCC(c3ccccc31)c1ccccc12)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| 2142 | 3096 | 58 | 3H-doxepin | -263 | 36 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4920903 | 3096 | 58 | 3H-doxepin | -263 | 36 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 502 | 3096 | 58 | 3H-doxepin | -263 | 36 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 5775 | 3096 | 58 | 3H-doxepin | -263 | 36 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| CHEMBL597 | 3096 | 58 | 3H-doxepin | -263 | 36 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| DB00692 | 3096 | 58 | 3H-doxepin | -263 | 36 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -309 | 24 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 2142 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4920903 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 502 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 5775 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| CHEMBL597 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| DB00692 | 3096 | 58 | 3H-MEPYRAMINE | -7585 | 36 | Rat | 4.4 | pKi | = | 4.4 | Binding | PDSP KiDatabase | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 37459 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 62 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| CHEMBL8514 | 746 | 13 | 3H-MEPYRAMINE | -1174 | 25 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 361 | 0 | 1 | 2 | 4.8 | O[C@]1(CCN2[C@@H](C1)c1cccc3c1[C@@H](C2)c1ccccc1CC3)C(C)(C)C | None | |||
| 135398737 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-MEPYRAMINE | -4 | 89 | Rat | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3012003 | 216145 | 0 | 3H-PYRILAMINE | -6 | 12 | Human | 5.4 | pKi | = | 5.4 | Binding | PDSP KiDatabase | 311 | 5 | 0 | 3 | 3.8 | CN1CCC(C(C1)COC2=CC=C(C=C2)OC)C3=CC=CC=C3 | None | |||
| 2865 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.4 | pKi | = | 7.4 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 3294 | 2006 | 111 | 3H-PYRILAMINE | -630 | 45 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 71360 | 2006 | 111 | 3H-PYRILAMINE | -630 | 45 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 87 | 2006 | 111 | 3H-PYRILAMINE | -630 | 45 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| CHEMBL14376 | 2006 | 111 | 3H-PYRILAMINE | -630 | 45 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| DB04946 | 2006 | 111 | 3H-PYRILAMINE | -630 | 45 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1353 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | UNDEFINED | -489 | 83 | Human | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 2435 | 3590 | 83 | UNDEFINED | -851 | 48 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 60149 | 3590 | 83 | UNDEFINED | -851 | 48 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 98 | 3590 | 83 | UNDEFINED | -851 | 48 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| CHEMBL12713 | 3590 | 83 | UNDEFINED | -851 | 48 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| DB06144 | 3590 | 83 | UNDEFINED | -851 | 48 | Rat | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 7153 | 98020 | 77 | 3H-PYRILAMINE | -23 | 34 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 214 | 3 | 1 | 2 | 2.5 | Cc1cc(Cl)ccc1OC(C)C(=O)O | None | |||
| CHEMBL272942 | 98020 | 77 | 3H-PYRILAMINE | -23 | 34 | Guinea pig | 6.4 | pKi | = | 6.4 | Binding | PDSP KiDatabase | 214 | 3 | 1 | 2 | 2.5 | Cc1cc(Cl)ccc1OC(C)C(=O)O | None | |||
| 2995 | 204405 | 53 | 3H-MEPYRAMINE | -14 | 23 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-MEPYRAMINE | -14 | 23 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-MEPYRAMINE | -14 | 23 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 1971 | 2866 | 38 | 3H-MEPYRAMINE | -9 | 30 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2404 | 2866 | 38 | 3H-MEPYRAMINE | -9 | 30 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 4543 | 2866 | 38 | 3H-MEPYRAMINE | -9 | 30 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| CHEMBL445 | 2866 | 38 | 3H-MEPYRAMINE | -9 | 30 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| DB00540 | 2866 | 38 | 3H-MEPYRAMINE | -9 | 30 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2865 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | 3H-PYRILAMINE | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 21722 | 17992 | 31 | 3H-MEPYRAMINE | -5 | 6 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| CHEMBL126224 | 17992 | 31 | 3H-MEPYRAMINE | -5 | 6 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -46 | 24 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 2865 | 4143 | 73 | UNDEFINED | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | UNDEFINED | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | UNDEFINED | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | UNDEFINED | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | UNDEFINED | -58 | 53 | Human | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 2470 | 3653 | 50 | UNDEFINED | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3300 | 3653 | 50 | UNDEFINED | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 5265 | 3653 | 50 | UNDEFINED | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 99 | 3653 | 50 | UNDEFINED | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL267930 | 3653 | 50 | UNDEFINED | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 2470 | 3653 | 50 | 3H-doxepin | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3300 | 3653 | 50 | 3H-doxepin | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 5265 | 3653 | 50 | 3H-doxepin | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 99 | 3653 | 50 | 3H-doxepin | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL267930 | 3653 | 50 | 3H-doxepin | -4570 | 59 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 1613 | 2348 | 53 | UNDEFINED | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 205 | 2348 | 53 | UNDEFINED | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3964 | 2348 | 53 | UNDEFINED | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| CHEMBL831 | 2348 | 53 | UNDEFINED | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| DB00408 | 2348 | 53 | UNDEFINED | -3 | 44 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 1816 | 2540 | 102 | 3H-PYRILAMINE | -10 | 18 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 4205 | 2540 | 102 | 3H-PYRILAMINE | -10 | 18 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 7241 | 2540 | 102 | 3H-PYRILAMINE | -10 | 18 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| CHEMBL654 | 2540 | 102 | 3H-PYRILAMINE | -10 | 18 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| DB00370 | 2540 | 102 | 3H-PYRILAMINE | -10 | 18 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 1548955 | 88581 | 20 | None | 1 | 18 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 405 | 9 | 0 | 2 | 6.6 | CCN(CC)CCOc1ccc(C(=C(Cl)c2ccccc2)c2ccccc2)cc1 | None | |||
| 2800 | 88581 | 20 | None | 1 | 18 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 405 | 9 | 0 | 2 | 6.6 | CCN(CC)CCOc1ccc(C(=C(Cl)c2ccccc2)c2ccccc2)cc1 | None | |||
| CHEMBL2355051 | 88581 | 20 | None | 1 | 18 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 405 | 9 | 0 | 2 | 6.6 | CCN(CC)CCOc1ccc(C(=C(Cl)c2ccccc2)c2ccccc2)cc1 | None | |||
| 2389 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | 3H-PYRILAMINE | -46 | 67 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 2865 | 4143 | 73 | 3H-PYRILAMINE | -17 | 53 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | 3H-PYRILAMINE | -17 | 53 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | 3H-PYRILAMINE | -17 | 53 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | 3H-PYRILAMINE | -17 | 53 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | 3H-PYRILAMINE | -17 | 53 | Guinea pig | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 2142 | 3096 | 58 | None | -263 | 36 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 4920903 | 3096 | 58 | None | -263 | 36 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 502 | 3096 | 58 | None | -263 | 36 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 5775 | 3096 | 58 | None | -263 | 36 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| CHEMBL597 | 3096 | 58 | None | -263 | 36 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| DB00692 | 3096 | 58 | None | -263 | 36 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 281 | 4 | 2 | 4 | 2.8 | Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1 | None | |||
| 2812 | 4779 | 101 | None | -28 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | |||
| CHEMBL104 | 4779 | 101 | None | -28 | 34 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | |||
| 40589 | 216144 | 0 | None | -5 | 8 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 377 | 7 | 0 | 6 | 2.5 | CCC1=NN(C(=O)N1CC)CCCN2CCN(CC2)C3=CC(=CC=C3)Cl | None | |||
| 4528 | 98126 | 80 | None | -1 | 10 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| CHEMBL273575 | 98126 | 80 | None | -1 | 10 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 238 | 1 | 1 | 2 | 2.8 | CN1Cc2c(N)cccc2C(c2ccccc2)C1 | None | |||
| 3114 | 189927 | 71 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 339 | 8 | 1 | 3 | 3.4 | CC(C)N(CCC(C(N)=O)(c1ccccc1)c1ccccn1)C(C)C | None | |||
| CHEMBL517 | 189927 | 71 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 339 | 8 | 1 | 3 | 3.4 | CC(C)N(CCC(C(N)=O)(c1ccccc1)c1ccccn1)C(C)C | None | |||
| 2181 | 3128 | 46 | None | -269 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 4830 | 3128 | 46 | None | -269 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 92 | 3128 | 46 | None | -269 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| CHEMBL440294 | 3128 | 46 | None | -269 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| DB09286 | 3128 | 46 | None | -269 | 35 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 135398745 | 2914 | 112 | UNDEFINED | -1 | 65 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | UNDEFINED | -1 | 65 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | UNDEFINED | -1 | 65 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | UNDEFINED | -1 | 65 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -6 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -6 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -6 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -6 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -6 | 4 | Rat | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 657255 | 199084 | 34 | None | -18 | 15 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 337 | 12 | 2 | 3 | 5.6 | CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1 | None | |||
| CHEMBL588119 | 199084 | 34 | None | -18 | 15 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 337 | 12 | 2 | 3 | 5.6 | CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1 | None | |||
| 115237 | 55585 | 119 | 3H-PYRILAMINE | -36 | 54 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| CHEMBL1621 | 55585 | 119 | 3H-PYRILAMINE | -36 | 54 | Human | 8.3 | pKi | = | 8.3 | Binding | PDSP KiDatabase | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| 446220 | 133521 | 14 | None | -19 | 45 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 303 | 3 | 0 | 5 | 1.9 | COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1N2C | None | |||
| CHEMBL370805 | 133521 | 14 | None | -19 | 45 | Human | 8.3 | pKi | = | 8.3 | Binding | Drug Central | 303 | 3 | 0 | 5 | 1.9 | COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1N2C | None | |||
| 1830 | 2590 | 44 | None | -125 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 207 | 2590 | 44 | None | -125 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 23897 | 2590 | 44 | None | -125 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| CHEMBL460 | 2590 | 44 | None | -125 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| DB01618 | 2590 | 44 | None | -125 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | None | |||
| 5281878 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5281881 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 948 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 968 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL42055 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL54661 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00875 | 1660 | 35 | 3H-MEPYRAMINE | -1 | 17 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 103 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 2875 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 5736 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL285802 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB09225 | 4153 | 61 | 3H-PYRILAMINE | -1 | 53 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 4066 | 204626 | 78 | 3H-doxepin | -1 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | None | |||
| CHEMBL73451 | 204626 | 78 | 3H-doxepin | -1 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | None | |||
| 1621 | 2429 | 17 | None | -301 | 45 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 17 | 2429 | 17 | None | -301 | 45 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 5761 | 2429 | 17 | None | -301 | 45 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| CHEMBL263881 | 2429 | 17 | None | -301 | 45 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| DB04829 | 2429 | 17 | None | -301 | 45 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 323 | 3 | 1 | 2 | 2.9 | CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 11954259 | 215979 | 0 | UNDEFINED | -19 | 43 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C | None | |||
| 107782 | 14468 | 18 | None | 1 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | None | |||
| 67151996 | 14468 | 18 | None | 1 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | None | |||
| CHEMBL1201207 | 14468 | 18 | None | 1 | 5 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 472 | 4 | 4 | 6 | 2.0 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O | None | |||
| 5048 | 3133 | 64 | None | -109 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | None | |||
| 8924 | 3133 | 64 | None | -109 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | None | |||
| 9948102 | 3133 | 64 | None | -109 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | None | |||
| CHEMBL462605 | 3133 | 64 | None | -109 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | None | |||
| DB11642 | 3133 | 64 | None | -109 | 7 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | None | |||
| 1209 | 1658 | 75 | None | -144 | 32 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 203 | 1658 | 75 | None | -144 | 32 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 3386 | 1658 | 75 | None | -144 | 32 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL41 | 1658 | 75 | None | -144 | 32 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| DB00472 | 1658 | 75 | None | -144 | 32 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 2181 | 3128 | 46 | 3H-PYRILAMINE | -4168 | 35 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 4830 | 3128 | 46 | 3H-PYRILAMINE | -4168 | 35 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 92 | 3128 | 46 | 3H-PYRILAMINE | -4168 | 35 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| CHEMBL440294 | 3128 | 46 | 3H-PYRILAMINE | -4168 | 35 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| DB09286 | 3128 | 46 | 3H-PYRILAMINE | -4168 | 35 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | None | |||
| 46882182 | 5921 | 0 | UNDEFINED | -95 | 5 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 567 | 11 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)N(C)C)ccc4o3)CC2)cc(OCC)c1-n1cccc1 | None | |||
| CHEMBL1079686 | 5921 | 0 | UNDEFINED | -95 | 5 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 567 | 11 | 1 | 9 | 4.7 | CCOc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)N(C)C)ccc4o3)CC2)cc(OCC)c1-n1cccc1 | None | |||
| 53389 | 98447 | 23 | 3H-MEPYRAMINE | 1 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 3.9 | C[C@H]1CN(CCCn2c3ccccc3c3ccccc32)C[C@@H](C)N1 | None | |||
| CHEMBL275707 | 98447 | 23 | 3H-MEPYRAMINE | 1 | 6 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 321 | 4 | 1 | 3 | 3.9 | C[C@H]1CN(CCCn2c3ccccc3c3ccccc32)C[C@@H](C)N1 | None | |||
| 68617 | 205527 | 62 | 3H-PYRILAMINE | -1023 | 26 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL1709 | 205527 | 62 | 3H-PYRILAMINE | -1023 | 26 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL809 | 205527 | 62 | 3H-PYRILAMINE | -1023 | 26 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| None | 216135 | 0 | 3H-KETANSERIN | -5248 | 24 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 772 | 16 | 4 | 10 | 5.5 | CN(C)CCONC(=CC=C1C=CC(=O)C=C1)C2=CC=CC=C2F.CN(C)CCONC(=CC=C1C=CC(=O)C=C1)C2=CC=CC=C2F.C(=CC(=O)O)C(=O)O | None | |||
| 191 | 403 | 98 | 3H-Histamine | -56 | 29 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| 201 | 403 | 98 | 3H-Histamine | -56 | 29 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| 2170 | 403 | 98 | 3H-Histamine | -56 | 29 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| CHEMBL1113 | 403 | 98 | 3H-Histamine | -56 | 29 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| DB00543 | 403 | 98 | 3H-Histamine | -56 | 29 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| 1353 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-MEPYRAMINE | -602 | 83 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 68617 | 205527 | 62 | 3H-PYRILAMINE | -831 | 26 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL1709 | 205527 | 62 | 3H-PYRILAMINE | -831 | 26 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL809 | 205527 | 62 | 3H-PYRILAMINE | -831 | 26 | Guinea pig | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| 2865 | 4143 | 73 | UNDEFINED | -1047 | 53 | Rat | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | UNDEFINED | -1047 | 53 | Rat | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | UNDEFINED | -1047 | 53 | Rat | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | UNDEFINED | -1047 | 53 | Rat | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | UNDEFINED | -1047 | 53 | Rat | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 5568 | 197500 | 29 | 3H-MEPYRAMINE | -25 | 5 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 4 | 0 | 3 | 5.3 | CN(C)CCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21 | None | |||
| 66069 | 197500 | 29 | 3H-MEPYRAMINE | -25 | 5 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 4 | 0 | 3 | 5.3 | CN(C)CCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21 | None | |||
| CHEMBL1201102 | 197500 | 29 | 3H-MEPYRAMINE | -25 | 5 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 4 | 0 | 3 | 5.3 | CN(C)CCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21 | None | |||
| CHEMBL570 | 197500 | 29 | 3H-MEPYRAMINE | -25 | 5 | Rat | 7.3 | pKi | = | 7.3 | Binding | PDSP KiDatabase | 352 | 4 | 0 | 3 | 5.3 | CN(C)CCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21 | None | |||
| 11848677 | 148352 | 0 | UNDEFINED | -1 | 5 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 460 | 8 | 2 | 8 | 3.0 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)ccc1OC | None | |||
| CHEMBL393718 | 148352 | 0 | UNDEFINED | -1 | 5 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 460 | 8 | 2 | 8 | 3.0 | CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)ccc1OC | None | |||
| 1222 | 1664 | 49 | 3H-PYRILAMINE | -891 | 33 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3396 | 1664 | 49 | 3H-PYRILAMINE | -891 | 33 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 85 | 1664 | 49 | 3H-PYRILAMINE | -891 | 33 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL46516 | 1664 | 49 | 3H-PYRILAMINE | -891 | 33 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| DB04842 | 1664 | 49 | 3H-PYRILAMINE | -891 | 33 | Guinea pig | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 1209 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 203 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 3386 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL41 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| DB00472 | 1658 | 75 | 3H-PYRILAMINE | -144 | 32 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 54841 | 203127 | 52 | 3H-PYRILAMINE | -2 | 27 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
| CHEMBL641 | 203127 | 52 | 3H-PYRILAMINE | -2 | 27 | Human | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
| 44591012 | 175580 | 0 | UNDEFINED | -114 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 522 | 10 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| CHEMBL457957 | 175580 | 0 | UNDEFINED | -114 | 6 | Human | 6.3 | pKi | = | 6.3 | Binding | PDSP KiDatabase | 522 | 10 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| 1192 | 147 | 47 | 3H-MEPYRAMINE | -91 | 17 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 311 | 2 | 3 | 5 | 0.5 | NC(=NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1)N | None | |||
| 1794 | 147 | 47 | 3H-MEPYRAMINE | -91 | 17 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 311 | 2 | 3 | 5 | 0.5 | NC(=NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1)N | None | |||
| CHEMBL501701 | 147 | 47 | 3H-MEPYRAMINE | -91 | 17 | Rat | 5.3 | pKi | = | 5.3 | Binding | PDSP KiDatabase | 311 | 2 | 3 | 5 | 0.5 | NC(=NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1)N | None | |||
| 2435 | 3590 | 83 | 3H-PYRILAMINE | -1122 | 48 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 60149 | 3590 | 83 | 3H-PYRILAMINE | -1122 | 48 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 98 | 3590 | 83 | 3H-PYRILAMINE | -1122 | 48 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| CHEMBL12713 | 3590 | 83 | 3H-PYRILAMINE | -1122 | 48 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| DB06144 | 3590 | 83 | 3H-PYRILAMINE | -1122 | 48 | Guinea pig | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 15387 | 45822 | 55 | 3H-PYRILAMINE | -8 | 24 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 263 | 5 | 0 | 2 | 3.5 | CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1 | None | |||
| CHEMBL1531134 | 45822 | 55 | 3H-PYRILAMINE | -8 | 24 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 263 | 5 | 0 | 2 | 3.5 | CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1 | None | |||
| 12057539 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 3661 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| CHEMBL9751 | 208041 | 42 | 3H-MEPYRAMINE | -676 | 20 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 33630 | 178957 | 99 | None | -13 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | None | |||
| CHEMBL47050 | 178957 | 99 | None | -13 | 28 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 523 | 7 | 1 | 2 | 7.5 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | None | |||
| 2726 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-PYRILAMINE | -2 | 72 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 135398737 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | 3H-PYRILAMINE | -4 | 89 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 11954259 | 215979 | 0 | 3H-doxepin | -19 | 43 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C | None | |||
| None | 216149 | 0 | 3H-MEPYRAMINE | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 411 | 6 | 0 | 1 | 0.8 | CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCC[N+](C)(C)C.[I-] | None | |||
| 6834 | 205552 | 45 | 3H-PYRILAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | None | |||
| CHEMBL811 | 205552 | 45 | 3H-PYRILAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | None | |||
| 1224 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 2448 | 99323 | 70 | None | -4 | 18 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 419 | 6 | 1 | 3 | 4.5 | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 | None | |||
| CHEMBL28218 | 99323 | 70 | None | -4 | 18 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 419 | 6 | 1 | 3 | 4.5 | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 | None | |||
| 15723 | 18539 | 111 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 267 | 3 | 2 | 2 | 2.9 | OC(c1ccccc1)(c1ccccc1)C1CCNCC1 | None | |||
| CHEMBL127508 | 18539 | 111 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 267 | 3 | 2 | 2 | 2.9 | OC(c1ccccc1)(c1ccccc1)C1CCNCC1 | None | |||
| 213 | 3853 | 55 | None | -8 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 2717 | 3853 | 55 | None | -8 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 5533 | 3853 | 55 | None | -8 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| CHEMBL621 | 3853 | 55 | None | -8 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| DB00656 | 3853 | 55 | None | -8 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 371 | 5 | 0 | 6 | 2.4 | Clc1cccc(c1)N1CCN(CC1)CCCn1nc2n(c1=O)cccc2 | None | |||
| 4020 | 205150 | 39 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 284 | 1 | 1 | 3 | 2.6 | OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCN21 | None | |||
| CHEMBL781 | 205150 | 39 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 284 | 1 | 1 | 3 | 2.6 | OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCN21 | None | |||
| 15387 | 45822 | 55 | None | -8 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 263 | 5 | 0 | 2 | 3.5 | CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1 | None | |||
| CHEMBL1531134 | 45822 | 55 | None | -8 | 24 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 263 | 5 | 0 | 2 | 3.5 | CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1 | None | |||
| 3168 | 9262 | 92 | None | -87 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 379 | 6 | 1 | 4 | 3.7 | O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1 | None | |||
| CHEMBL1108 | 9262 | 92 | None | -87 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 379 | 6 | 1 | 4 | 3.7 | O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1 | None | |||
| 1222 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2678 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 581 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1000 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00341 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1971 | 2866 | 38 | 3H-PYRILAMINE | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2404 | 2866 | 38 | 3H-PYRILAMINE | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 4543 | 2866 | 38 | 3H-PYRILAMINE | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| CHEMBL445 | 2866 | 38 | 3H-PYRILAMINE | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| DB00540 | 2866 | 38 | 3H-PYRILAMINE | -1 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 1222 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2678 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 581 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1000 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00341 | 881 | 0 | 3H-MEPYRAMINE | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 133 | 2496 | 52 | None | -102 | 42 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
| 1723 | 2496 | 52 | None | -102 | 42 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
| 28693 | 2496 | 52 | None | -102 | 42 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
| CHEMBL19215 | 2496 | 52 | None | -102 | 42 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
| DB13520 | 2496 | 52 | None | -102 | 42 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 403 | 4 | 1 | 4 | 4.1 | O=C(OCc1ccccc1)NC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C | None | |||
| 2470 | 3653 | 50 | None | -4570 | 59 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3300 | 3653 | 50 | None | -4570 | 59 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 5265 | 3653 | 50 | None | -4570 | 59 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 99 | 3653 | 50 | None | -4570 | 59 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL267930 | 3653 | 50 | None | -4570 | 59 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1353 | 1911 | 93 | None | -213 | 83 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | None | -213 | 83 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | None | -213 | 83 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | None | -213 | 83 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | None | -213 | 83 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 2710 | 84308 | 31 | 3H-MEPYRAMINE | 1 | 3 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 300 | 3 | 0 | 2 | 3.7 | CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1 | None | |||
| CHEMBL22150 | 84308 | 31 | 3H-MEPYRAMINE | 1 | 3 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 300 | 3 | 0 | 2 | 3.7 | CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1 | None | |||
| 1353 | 1911 | 93 | None | -602 | 83 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | None | -602 | 83 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | None | -602 | 83 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | None | -602 | 83 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | None | -602 | 83 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1890 | 2759 | 49 | None | -44 | 16 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 4449 | 2759 | 49 | None | -44 | 16 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 7247 | 2759 | 49 | None | -44 | 16 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| CHEMBL623 | 2759 | 49 | None | -44 | 16 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| DB01149 | 2759 | 49 | None | -44 | 16 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 469 | 10 | 0 | 7 | 3.6 | CCc1nn(c(=O)n1CCOc1ccccc1)CCCN1CCN(CC1)c1cccc(c1)Cl | None | |||
| 3947 | 206395 | 53 | None | -7 | 16 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | None | |||
| CHEMBL87708 | 206395 | 53 | None | -7 | 16 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | None | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Rat | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 2771 | 195017 | 74 | None | -2 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1200781 | 195017 | 74 | None | -2 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL549 | 195017 | 74 | None | -2 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| 2712 | 916 | 34 | None | -5 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | None | |||
| 3370 | 916 | 34 | None | -5 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | None | |||
| 594 | 916 | 34 | None | -5 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | None | |||
| CHEMBL451 | 916 | 34 | None | -5 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | None | |||
| DB00475 | 916 | 34 | None | -5 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 299 | 1 | 1 | 3 | 3.0 | CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl | None | |||
| 2710 | 84308 | 31 | 3H-MEPYRAMINE | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 300 | 3 | 0 | 2 | 3.7 | CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1 | None | |||
| CHEMBL22150 | 84308 | 31 | 3H-MEPYRAMINE | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 300 | 3 | 0 | 2 | 3.7 | CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1 | None | |||
| 2564 | 206184 | 51 | 3H-MEPYRAMINE | -2 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | None | |||
| CHEMBL864 | 206184 | 51 | 3H-MEPYRAMINE | -2 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 290 | 6 | 0 | 3 | 3.4 | CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1 | None | |||
| 16362 | 3125 | 71 | None | -489 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 2172 | 3125 | 71 | None | -489 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 90 | 3125 | 71 | None | -489 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| CHEMBL1423 | 3125 | 71 | None | -489 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| DB01100 | 3125 | 71 | None | -489 | 30 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 4806 | 4008 | 88 | None | -5 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
| 7351 | 4008 | 88 | None | -5 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
| 9966051 | 4008 | 88 | None | -5 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
| CHEMBL2104993 | 4008 | 88 | None | -5 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
| DB09068 | 4008 | 88 | None | -5 | 13 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 298 | 3 | 1 | 3 | 3.9 | Cc1ccc(c(c1)C)Sc1ccccc1N1CCNCC1 | None | |||
| 3151 | 1462 | 97 | None | -41 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | None | |||
| 945 | 1462 | 97 | None | -41 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | None | |||
| 965 | 1462 | 97 | None | -41 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | None | |||
| CHEMBL219916 | 1462 | 97 | None | -41 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | None | |||
| DB01184 | 1462 | 97 | None | -41 | 27 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 425 | 5 | 2 | 5 | 3.4 | Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 | None | |||
| 21722 | 17992 | 31 | None | 1 | 6 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| CHEMBL126224 | 17992 | 31 | None | 1 | 6 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | None | |||
| 4976 | 203579 | 29 | 3H-MEPYRAMINE | -9 | 12 | Rat | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | None | |||
| CHEMBL668 | 203579 | 29 | 3H-MEPYRAMINE | -9 | 12 | Rat | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | None | |||
| 2995 | 204405 | 53 | 3H-PYRILAMINE | -14 | 23 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-PYRILAMINE | -14 | 23 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-PYRILAMINE | -14 | 23 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 4020 | 205150 | 39 | 3H-MEPYRAMINE | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 284 | 1 | 1 | 3 | 2.6 | OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCN21 | None | |||
| CHEMBL781 | 205150 | 39 | 3H-MEPYRAMINE | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 284 | 1 | 1 | 3 | 2.6 | OC1(c2ccc(Cl)cc2)c2ccccc2C2=NCCN21 | None | |||
| 2303 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 4946 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 564 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 63 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 91536 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| CHEMBL27 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| CHEMBL452861 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| DB00571 | 3187 | 68 | 3H-MEPYRAMINE | -363 | 26 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 259 | 6 | 2 | 3 | 2.6 | O[C@H](COc1cccc2c1cccc2)CNC(C)C | None | |||
| 45485462 | 197686 | 0 | UNDEFINED | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 419 | 8 | 1 | 2 | 6.6 | CC1CCC(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)CC1 | None | |||
| CHEMBL571174 | 197686 | 0 | UNDEFINED | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 419 | 8 | 1 | 2 | 6.6 | CC1CCC(CCCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)CC1 | None | |||
| 2200 | 20203 | 61 | 3H-MEPYRAMINE | -26 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | None | |||
| CHEMBL1256819 | 20203 | 61 | 3H-MEPYRAMINE | -26 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | None | |||
| CHEMBL1305 | 20203 | 61 | 3H-MEPYRAMINE | -26 | 2 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 265 | 5 | 1 | 3 | 2.7 | c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1 | None | |||
| 1224 | 1432 | 83 | 3H-doxepin | -2 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-doxepin | -2 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-doxepin | -2 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-doxepin | -2 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-doxepin | -2 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-doxepin | -2 | 13 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 214 | 3860 | 58 | 3H-doxepin | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2740 | 3860 | 58 | 3H-doxepin | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5566 | 3860 | 58 | 3H-doxepin | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 66064 | 3860 | 58 | 3H-doxepin | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL422 | 3860 | 58 | 3H-doxepin | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00831 | 3860 | 58 | 3H-doxepin | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 214 | 3860 | 58 | UNDEFINED | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2740 | 3860 | 58 | UNDEFINED | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5566 | 3860 | 58 | UNDEFINED | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 66064 | 3860 | 58 | UNDEFINED | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL422 | 3860 | 58 | UNDEFINED | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00831 | 3860 | 58 | UNDEFINED | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 11848624 | 89146 | 0 | UNDEFINED | -15 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 381 | 7 | 1 | 6 | 4.3 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1OC | None | |||
| CHEMBL236587 | 89146 | 0 | UNDEFINED | -15 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 381 | 7 | 1 | 6 | 4.3 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1OC | None | |||
| 214 | 3860 | 58 | 3H-PYRILAMINE | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2740 | 3860 | 58 | 3H-PYRILAMINE | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5566 | 3860 | 58 | 3H-PYRILAMINE | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 66064 | 3860 | 58 | 3H-PYRILAMINE | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL422 | 3860 | 58 | 3H-PYRILAMINE | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00831 | 3860 | 58 | 3H-PYRILAMINE | -43 | 30 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 4.2 | pKi | = | 4.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 13091273 | 182438 | 0 | UNDEFINED | -275 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 367 | 6 | 1 | 3 | 4.3 | O=C(CCCN1C2CCC1CC(O)(c1ccccc1)C2)c1ccc(F)cc1 | None | |||
| CHEMBL478617 | 182438 | 0 | UNDEFINED | -275 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 367 | 6 | 1 | 3 | 4.3 | O=C(CCCN1C2CCC1CC(O)(c1ccccc1)C2)c1ccc(F)cc1 | None | |||
| CHEMBL553327 | 182438 | 0 | UNDEFINED | -275 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 367 | 6 | 1 | 3 | 4.3 | O=C(CCCN1C2CCC1CC(O)(c1ccccc1)C2)c1ccc(F)cc1 | None | |||
| 45485529 | 197718 | 0 | UNDEFINED | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 385 | 6 | 1 | 2 | 5.2 | Cc1ccc(CCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL571391 | 197718 | 0 | UNDEFINED | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 385 | 6 | 1 | 2 | 5.2 | Cc1ccc(CCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 54841 | 203127 | 52 | 3H-Histamine | -6 | 27 | Rat | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
| CHEMBL641 | 203127 | 52 | 3H-Histamine | -6 | 27 | Rat | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 255 | 6 | 1 | 2 | 3.7 | CNCC[C@@H](Oc1ccccc1C)c1ccccc1 | None | |||
| 68617 | 205527 | 62 | 3H-PYRILAMINE | -831 | 26 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL1709 | 205527 | 62 | 3H-PYRILAMINE | -831 | 26 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| CHEMBL809 | 205527 | 62 | 3H-PYRILAMINE | -831 | 26 | Guinea pig | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 305 | 2 | 1 | 1 | 5.2 | CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 | None | |||
| 15723 | 18539 | 111 | UNDEFINED | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 267 | 3 | 2 | 2 | 2.9 | OC(c1ccccc1)(c1ccccc1)C1CCNCC1 | None | |||
| CHEMBL127508 | 18539 | 111 | UNDEFINED | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 267 | 3 | 2 | 2 | 2.9 | OC(c1ccccc1)(c1ccccc1)C1CCNCC1 | None | |||
| 185 | 4006 | 60 | 3H-PYRILAMINE | -794 | 37 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
| 5311271 | 4006 | 60 | 3H-PYRILAMINE | -794 | 37 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
| CHEMBL74355 | 4006 | 60 | 3H-PYRILAMINE | -794 | 37 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
| DB16351 | 4006 | 60 | 3H-PYRILAMINE | -794 | 37 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 373 | 7 | 1 | 4 | 3.8 | COc1cccc(c1OC)[C@@H](C1CCN(CC1)CCc1ccc(cc1)F)O | None | |||
| 2470 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3300 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 5265 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 99 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL267930 | 3653 | 50 | 3H-MEPYRAMINE | -4570 | 59 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 1212 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 1212 | 1662 | 50 | 3H-MEPYRAMINE | -134 | 65 | Rat | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | 3H-MEPYRAMINE | -134 | 65 | Rat | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | 3H-MEPYRAMINE | -134 | 65 | Rat | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | 3H-MEPYRAMINE | -134 | 65 | Rat | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | 3H-MEPYRAMINE | -134 | 65 | Rat | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2470 | 3653 | 50 | 3H-MEPYRAMINE | -20417 | 59 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3300 | 3653 | 50 | 3H-MEPYRAMINE | -20417 | 59 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 5265 | 3653 | 50 | 3H-MEPYRAMINE | -20417 | 59 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 99 | 3653 | 50 | 3H-MEPYRAMINE | -20417 | 59 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL267930 | 3653 | 50 | 3H-MEPYRAMINE | -20417 | 59 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 395 | 6 | 1 | 4 | 3.2 | Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 21722 | 17992 | 31 | 3H-MEPYRAMINE | 1 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| CHEMBL126224 | 17992 | 31 | 3H-MEPYRAMINE | 1 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | None | |||
| 44591098 | 176762 | 0 | UNDEFINED | -199 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 508 | 9 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)c1ccc(OCCCN2CCCCC2)cc1 | None | |||
| CHEMBL460402 | 176762 | 0 | UNDEFINED | -199 | 6 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 508 | 9 | 0 | 3 | 6.6 | CN(CCC=C1c2ccccc2CCc2ccccc21)C(=O)c1ccc(OCCCN2CCCCC2)cc1 | None | |||
| 16362 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 2172 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 90 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| CHEMBL1423 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| DB01100 | 3125 | 71 | 3H-PYRILAMINE | -489 | 30 | Human | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | None | |||
| 242 | 470 | 124 | None | -23 | 51 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 34 | 470 | 124 | None | -23 | 51 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 60795 | 470 | 124 | None | -23 | 51 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| CHEMBL1112 | 470 | 124 | None | -23 | 51 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| DB01238 | 470 | 124 | None | -23 | 51 | Guinea pig | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 1613 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 205 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3964 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| CHEMBL831 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| DB00408 | 2348 | 53 | 3H-PYRILAMINE | -3 | 44 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 135398745 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 135398745 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | UNDEFINED | 1 | 65 | Human | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | 3H-PYRILAMINE | -1 | 65 | Rat | 8.2 | pKi | = | 8.2 | Binding | PDSP KiDatabase | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 22530 | 56130 | 58 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 2 | 0 | 2 | 3.7 | CN1CCc2c(c3ccccc3n2Cc2ccccc2)C1 | None | |||
| CHEMBL1600878 | 56130 | 58 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 2 | 0 | 2 | 3.7 | CN1CCc2c(c3ccccc3n2Cc2ccccc2)C1 | None | |||
| CHEMBL1625607 | 56130 | 58 | None | -1 | 3 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 276 | 2 | 0 | 2 | 3.7 | CN1CCc2c(c3ccccc3n2Cc2ccccc2)C1 | None | |||
| 2995 | 204405 | 53 | None | -14 | 23 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | None | -14 | 23 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | None | -14 | 23 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 11579 | 635 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | None | |||
| 185460 | 635 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | None | |||
| CHEMBL1742423 | 635 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | None | |||
| DB11591 | 635 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | None | |||
| 214 | 3860 | 58 | None | -43 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2740 | 3860 | 58 | None | -43 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5566 | 3860 | 58 | None | -43 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 66064 | 3860 | 58 | None | -43 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL422 | 3860 | 58 | None | -43 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00831 | 3860 | 58 | None | -43 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 49831411 | 217746 | 0 | None | -1 | 15 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 659 | 19 | 0 | 6 | 8.7 | CCCCCCCCCCCC(=O)OCN1C(=O)CCC2=CC=C(OCCCCN3CCN(CC3)C3=C(Cl)C(Cl)=CC=C3)C=C12 | None | |||
| 4976 | 203579 | 29 | None | -1 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | None | |||
| CHEMBL668 | 203579 | 29 | None | -1 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | None | |||
| 146159772 | 2311 | 33 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 420 | 4 | 1 | 3 | 4.9 | N#C[C@@]1(CC[C@@H](CC1)N1CC[C@]([C@@H](C1)C)(C(=O)O)c1ccccc1)c1ccc(cc1)F | None | |||
| 1564 | 2311 | 33 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 420 | 4 | 1 | 3 | 4.9 | N#C[C@@]1(CC[C@@H](CC1)N1CC[C@]([C@@H](C1)C)(C(=O)O)c1ccccc1)c1ccc(cc1)F | None | |||
| 1586 | 2311 | 33 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 420 | 4 | 1 | 3 | 4.9 | N#C[C@@]1(CC[C@@H](CC1)N1CC[C@]([C@@H](C1)C)(C(=O)O)c1ccccc1)c1ccc(cc1)F | None | |||
| 54385 | 2311 | 33 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 420 | 4 | 1 | 3 | 4.9 | N#C[C@@]1(CC[C@@H](CC1)N1CC[C@]([C@@H](C1)C)(C(=O)O)c1ccccc1)c1ccc(cc1)F | None | |||
| CHEMBL1615438 | 2311 | 33 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 420 | 4 | 1 | 3 | 4.9 | N#C[C@@]1(CC[C@@H](CC1)N1CC[C@]([C@@H](C1)C)(C(=O)O)c1ccccc1)c1ccc(cc1)F | None | |||
| DB01106 | 2311 | 33 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 420 | 4 | 1 | 3 | 4.9 | N#C[C@@]1(CC[C@@H](CC1)N1CC[C@]([C@@H](C1)C)(C(=O)O)c1ccccc1)c1ccc(cc1)F | None | |||
| 2726 | 919 | 68 | None | -6 | 72 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | None | -6 | 72 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | None | -6 | 72 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | None | -6 | 72 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | None | -6 | 72 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 1212 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | 3H-PYRILAMINE | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 2337 | 3256 | 77 | None | -1 | 62 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | None | -1 | 62 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | None | -1 | 62 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | None | -1 | 62 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | None | -1 | 62 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 2337 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5440 | 28724 | 37 | None | -1 | 9 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 399 | 6 | 0 | 5 | 5.0 | CCSc1ccc2c(c1)N(CCCN1CCN(C)CC1)c1ccccc1S2 | None | |||
| CHEMBL1378 | 28724 | 37 | None | -1 | 9 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 399 | 6 | 0 | 5 | 5.0 | CCSc1ccc2c(c1)N(CCCN1CCN(C)CC1)c1ccccc1S2 | None | |||
| 11154555 | 800 | 62 | None | -56 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 5037 | 800 | 62 | None | -56 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 7671 | 800 | 62 | None | -56 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| CHEMBL2028019 | 800 | 62 | None | -56 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| CHEMBL3085826 | 800 | 62 | None | -56 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| DB06016 | 800 | 62 | None | -56 | 12 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 5 | 1 | 3 | 4.3 | O=C(N(C)C)N[C@@H]1CC[C@H](CC1)CCN1CCN(CC1)c1cccc(c1Cl)Cl | None | |||
| 2389 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | None | -52 | 67 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 3389 | 217711 | 0 | None | -1 | 26 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 549 | 12 | 0 | 6 | 6.8 | CCCCCCC(=O)OCCN1CCN(CCCN2C3=CC=CC=C3SC3=C2C=C(C=C3)C(F)(F)F)CC1 | None | |||
| 100 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 2637 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 5452 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| CHEMBL479 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| DB00679 | 3805 | 58 | None | -7 | 55 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | None | |||
| 1385580 | 29276 | 76 | None | -1 | 5 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | None | |||
| 4615 | 29276 | 76 | None | -1 | 5 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | None | |||
| CHEMBL13828 | 29276 | 76 | None | -1 | 5 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | None | |||
| 1588 | 2325 | 27 | None | -35 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 28864 | 2325 | 27 | None | -35 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 43 | 2325 | 27 | None | -35 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| CHEMBL157138 | 2325 | 27 | None | -35 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| DB00589 | 2325 | 27 | None | -35 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 338 | 3 | 2 | 2 | 2.8 | CCN(C(=O)N[C@@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC | None | |||
| 11978813 | 721 | 79 | None | -9 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
| 5014 | 721 | 79 | None | -9 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
| 7672 | 721 | 79 | None | -9 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
| CHEMBL2105760 | 721 | 79 | None | -9 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
| DB09128 | 721 | 79 | None | -9 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 433 | 7 | 1 | 5 | 4.7 | O=c1ccc2c([nH]1)cc(cc2)OCCCCN1CCN(CC1)c1cccc2c1ccs2 | None | |||
| 2274 | 3173 | 58 | None | -3 | 31 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 4917 | 3173 | 58 | None | -3 | 31 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 7279 | 3173 | 58 | None | -3 | 31 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| CHEMBL728 | 3173 | 58 | None | -3 | 31 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| DB00433 | 3173 | 58 | None | -3 | 31 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 12488 | 1657 | 56 | None | -2 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | None | |||
| 941361 | 1657 | 56 | None | -2 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | None | |||
| CHEMBL30008 | 1657 | 56 | None | -2 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | None | |||
| DB04841 | 1657 | 56 | None | -2 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 404 | 6 | 0 | 2 | 5.4 | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F | None | |||
| 1212 | 1662 | 50 | None | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | None | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | None | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | None | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | None | -41 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 25271818 | 12967 | 58 | None | -1 | 2 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| 5281071 | 12967 | 58 | None | -1 | 2 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| CHEMBL1189432 | 12967 | 58 | None | -1 | 2 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| CHEMBL1719 | 12967 | 58 | None | -1 | 2 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| 2865 | 4143 | 73 | None | -17 | 53 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 59 | 4143 | 73 | None | -17 | 53 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 60854 | 4143 | 73 | None | -17 | 53 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| CHEMBL708 | 4143 | 73 | None | -17 | 53 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| DB00246 | 4143 | 73 | None | -17 | 53 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | None | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 1222 | 1664 | 49 | None | -17 | 33 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 3396 | 1664 | 49 | None | -17 | 33 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 85 | 1664 | 49 | None | -17 | 33 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| CHEMBL46516 | 1664 | 49 | None | -17 | 33 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| DB04842 | 1664 | 49 | None | -17 | 33 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | None | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 3294 | 2006 | 111 | None | -14 | 45 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 71360 | 2006 | 111 | None | -14 | 45 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 87 | 2006 | 111 | None | -14 | 45 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| CHEMBL14376 | 2006 | 111 | None | -14 | 45 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| DB04946 | 2006 | 111 | None | -14 | 45 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 8 | 0 | 6 | 4.8 | COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C | None | |||
| 1214 | 2068 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1549000 | 2068 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 1566 | 2068 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 28145931 | 2068 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL1201191 | 2068 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB06282 | 2068 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 191 | 403 | 98 | None | -56 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| 201 | 403 | 98 | None | -56 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| 2170 | 403 | 98 | None | -56 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| CHEMBL1113 | 403 | 98 | None | -56 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| DB00543 | 403 | 98 | None | -56 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | None | |||
| 4601 | 206747 | 35 | None | -1 | 16 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | None | |||
| CHEMBL1201023 | 206747 | 35 | None | -1 | 16 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | None | |||
| CHEMBL900 | 206747 | 35 | None | -1 | 16 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 269 | 6 | 0 | 2 | 3.7 | Cc1ccccc1C(OCCN(C)C)c1ccccc1 | None | |||
| 1212 | 1662 | 50 | 3H-MEPYRAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 204 | 1662 | 50 | 3H-MEPYRAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 3372 | 1662 | 50 | 3H-MEPYRAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL726 | 1662 | 50 | 3H-MEPYRAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00623 | 1662 | 50 | 3H-MEPYRAMINE | -41 | 65 | Human | 7.2 | pKi | = | 7.2 | Binding | PDSP KiDatabase | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 16667681 | 216153 | 0 | 3H-MEPYRAMINE | -33 | 3 | Rat | 6.2 | pKi | = | 6.2 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 1204 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-MEPYRAMINE | -501 | 24 | Human | 5.2 | pKi | = | 5.2 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1353 | 1911 | 93 | UNDEFINED | -602 | 83 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | UNDEFINED | -602 | 83 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | UNDEFINED | -602 | 83 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | UNDEFINED | -602 | 83 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | UNDEFINED | -602 | 83 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 73333 | 5963 | 31 | UNDEFINED | -46 | 9 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 401 | 7 | 1 | 2 | 4.2 | CCNC(=O)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | None | |||
| CHEMBL1079935 | 5963 | 31 | UNDEFINED | -46 | 9 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 401 | 7 | 1 | 2 | 4.2 | CCNC(=O)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 | None | |||
| 2771 | 195017 | 74 | 3H-PYRILAMINE | -6 | 27 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1200781 | 195017 | 74 | 3H-PYRILAMINE | -6 | 27 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL549 | 195017 | 74 | 3H-PYRILAMINE | -6 | 27 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL146246 | 38278 | 0 | 3H-PYRILAMINE | -2041 | 10 | Bovine | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 401 | 5 | 1 | 5 | 2.2 | NS(=O)(=O)c1ccc(N2CCN(CCC3OCCc4ccccc43)CC2)cc1 | None | |||
| 44591099 | 176190 | 0 | UNDEFINED | -295 | 6 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 494 | 10 | 0 | 3 | 7.0 | CN(CCC=C1c2ccccc2CCc2ccccc21)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| CHEMBL459350 | 176190 | 0 | UNDEFINED | -295 | 6 | Human | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 494 | 10 | 0 | 3 | 7.0 | CN(CCC=C1c2ccccc2CCc2ccccc21)Cc1ccc(OCCCN2CCCCC2)cc1 | None | |||
| 1353 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-PYRILAMINE | -489 | 83 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | None | |||
| 3191 | 102858 | 97 | None | 2 | 25 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| CHEMBL305660 | 102858 | 97 | None | 2 | 25 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | None | |||
| 4066 | 204626 | 78 | None | -1 | 7 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | None | |||
| CHEMBL73451 | 204626 | 78 | None | -1 | 7 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | None | |||
| 209 | 3057 | 97 | 3H-PYRILAMINE | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 209 | 3057 | 97 | 3H-doxepin | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 2113 | 3057 | 97 | 3H-PYRILAMINE | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 2113 | 3057 | 97 | 3H-doxepin | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 4748 | 3057 | 97 | 3H-PYRILAMINE | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 4748 | 3057 | 97 | 3H-doxepin | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| CHEMBL567 | 3057 | 97 | 3H-PYRILAMINE | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| CHEMBL567 | 3057 | 97 | 3H-doxepin | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| DB00850 | 3057 | 97 | 3H-PYRILAMINE | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| DB00850 | 3057 | 97 | 3H-doxepin | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 90475904 | 216022 | 0 | 3H-MEPYRAMINE | -6 | 6 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 274 | 5 | 0 | 2 | 3.8 | CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 | None | |||
| None | 216174 | 0 | 3H-MEPYRAMINE | 1258 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 408 | 7 | 2 | 4 | 3.9 | CC(C1=CC=CC=N1)C2=C(CC3=CC=CC=C32)CCN(C)C.C(=CC(=O)O)C(=O)O | None | |||
| 2398 | 954 | 62 | None | -1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | |||
| 2801 | 954 | 62 | None | -1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | |||
| 701 | 954 | 62 | None | -1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | |||
| CHEMBL415 | 954 | 62 | None | -1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | |||
| DB01242 | 954 | 62 | None | -1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | None | |||
| 1547484 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 654 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 9072 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| CHEMBL43064 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| DB00568 | 940 | 74 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 368 | 6 | 0 | 2 | 5.1 | c1ccc(cc1)/C=C/CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 3103 | 41658 | 49 | None | -1 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| CHEMBL1492 | 41658 | 49 | None | -1 | 4 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 281 | 4 | 0 | 2 | 3.9 | CN1CCC(OC(c2ccccc2)c2ccccc2)CC1 | None | |||
| 11140 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | None | |||
| 1784 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | None | |||
| 26388 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | None | |||
| CHEMBL398615 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | None | |||
| DB13591 | 2519 | 49 | None | -9 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 445 | 6 | 1 | 6 | 3.3 | NC(=O)C1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)C | None | |||
| 209 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 2113 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 4748 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| CHEMBL567 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| DB00850 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 2267 | 559 | 71 | None | 10 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | None | |||
| 271 | 559 | 71 | None | 10 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | None | |||
| 7121 | 559 | 71 | None | 10 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | None | |||
| CHEMBL639 | 559 | 71 | None | 10 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | None | |||
| DB00972 | 559 | 71 | None | 10 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | None | |||
| 2726 | 919 | 68 | None | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | None | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | None | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | None | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | None | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 1613 | 2348 | 53 | None | -3 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 205 | 2348 | 53 | None | -3 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 3964 | 2348 | 53 | None | -3 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| CHEMBL831 | 2348 | 53 | None | -3 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| DB00408 | 2348 | 53 | None | -3 | 44 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | None | |||
| 135398745 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | None | -2 | 65 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 6834 | 205552 | 45 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | None | |||
| CHEMBL811 | 205552 | 45 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 318 | 5 | 0 | 2 | 3.9 | CN(C)CCC(c1ccc(Br)cc1)c1ccccn1 | None | |||
| 4066 | 204626 | 78 | None | -1 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | None | |||
| CHEMBL73451 | 204626 | 78 | None | -1 | 7 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | None | |||
| 115237 | 55585 | 119 | None | -36 | 54 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| CHEMBL1621 | 55585 | 119 | None | -36 | 54 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 426 | 4 | 1 | 7 | 3.1 | Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O | None | |||
| 25271818 | 12967 | 58 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| 5281071 | 12967 | 58 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| CHEMBL1189432 | 12967 | 58 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| CHEMBL1719 | 12967 | 58 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 337 | 5 | 1 | 3 | 3.6 | CN(C)CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 | None | |||
| 180 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | 3H-MEPYRAMINE | -11 | 40 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 209 | 3057 | 97 | UNDEFINED | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 2113 | 3057 | 97 | UNDEFINED | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 4748 | 3057 | 97 | UNDEFINED | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| CHEMBL567 | 3057 | 97 | UNDEFINED | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| DB00850 | 3057 | 97 | UNDEFINED | -11 | 23 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | None | |||
| 6726 | 1280 | 51 | None | 3 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 7151 | 1280 | 51 | None | 3 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 749 | 1280 | 51 | None | 3 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| CHEMBL648 | 1280 | 51 | None | 3 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| DB01176 | 1280 | 51 | None | 3 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 212 | 3806 | 47 | None | -5 | 25 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
| 2639 | 3806 | 47 | None | -5 | 25 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
| 941651 | 3806 | 47 | None | -5 | 25 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
| CHEMBL1201 | 3806 | 47 | None | -5 | 25 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
| DB01623 | 3806 | 47 | None | -5 | 25 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | None | |||
| 1971 | 2866 | 38 | 3H-doxepin | -1 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 2404 | 2866 | 38 | 3H-doxepin | -1 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 4543 | 2866 | 38 | 3H-doxepin | -1 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| CHEMBL445 | 2866 | 38 | 3H-doxepin | -1 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| DB00540 | 2866 | 38 | 3H-doxepin | -1 | 30 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | None | |||
| 19861 | 207523 | 50 | None | - | 1 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | None | |||
| CHEMBL946 | 207523 | 50 | None | - | 1 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 290 | 0 | 0 | 2 | 3.7 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | None | |||
| 135398737 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | None | -2 | 89 | Guinea pig | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 11976 | 920 | 59 | None | -4 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| 667467 | 920 | 59 | None | -4 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| CHEMBL908 | 920 | 59 | None | -4 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| DB01239 | 920 | 59 | None | -4 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | None | |||
| 6075 | 150108 | 42 | None | 2 | 16 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 310 | 2 | 0 | 3 | 4.6 | CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 | None | |||
| CHEMBL395110 | 150108 | 42 | None | 2 | 16 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 310 | 2 | 0 | 3 | 4.6 | CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 | None | |||
| 135398737 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | None | -4 | 89 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 26987 | 949 | 33 | None | 16 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| 6063 | 949 | 33 | None | 16 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| 671 | 949 | 33 | None | 16 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| CHEMBL1626 | 949 | 33 | None | 16 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| DB00283 | 949 | 33 | None | 16 | 21 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| 1210 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | None | -9 | 21 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1400 | 1957 | 70 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 3658 | 1957 | 70 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 7199 | 1957 | 70 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 91513 | 1957 | 70 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| CHEMBL896 | 1957 | 70 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| DB00557 | 1957 | 70 | None | 2 | 3 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | None | |||
| 2284 | 3182 | 33 | None | 1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 4926 | 3182 | 33 | None | 1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 7281 | 3182 | 33 | None | 1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| CHEMBL564 | 3182 | 33 | None | 1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| DB00420 | 3182 | 33 | None | 1 | 29 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | None | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | None | |||
| 5284550 | 41721 | 15 | None | -1 | 9 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | None | |||
| CHEMBL1492500 | 41721 | 15 | None | -1 | 9 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | None | |||
| 2337 | 3256 | 77 | UNDEFINED | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | UNDEFINED | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | UNDEFINED | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | UNDEFINED | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | UNDEFINED | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 2337 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 50 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 5002 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| CHEMBL716 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| DB01224 | 3256 | 77 | 3H-PYRILAMINE | 1 | 62 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | None | |||
| 4098 | 32505 | 30 | None | 1 | 11 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | None | |||
| CHEMBL1255739 | 32505 | 30 | None | 1 | 11 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | None | |||
| CHEMBL1411979 | 32505 | 30 | None | 1 | 11 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 261 | 6 | 0 | 4 | 2.7 | CN(C)CCN(Cc1cccs1)c1ccccn1 | None | |||
| 1712 | 2492 | 43 | None | 1 | 22 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 4078 | 2492 | 43 | None | 1 | 22 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 7227 | 2492 | 43 | None | 1 | 22 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| CHEMBL1088 | 2492 | 43 | None | 1 | 22 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| DB00933 | 2492 | 43 | None | 1 | 22 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 386 | 4 | 0 | 4 | 4.9 | CN1CCCCC1CCN1c2ccccc2Sc2c1cc(cc2)S(=O)C | None | |||
| 1524 | 2181 | 96 | None | -2 | 52 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 197 | 2181 | 96 | None | -2 | 52 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 3822 | 2181 | 96 | None | -2 | 52 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 88 | 2181 | 96 | None | -2 | 52 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| CHEMBL51 | 2181 | 96 | None | -2 | 52 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| DB12465 | 2181 | 96 | None | -2 | 52 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 395 | 5 | 1 | 5 | 2.4 | Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2 | None | |||
| 4011 | 82408 | 49 | None | 6 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | None | |||
| CHEMBL21731 | 82408 | 49 | None | 6 | 24 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | None | |||
| 1816 | 2540 | 102 | None | -3 | 18 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 4205 | 2540 | 102 | None | -3 | 18 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 7241 | 2540 | 102 | None | -3 | 18 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| CHEMBL654 | 2540 | 102 | None | -3 | 18 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| DB00370 | 2540 | 102 | None | -3 | 18 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 265 | 0 | 0 | 3 | 2.5 | CN1CCN2C(C1)c1ccccc1Cc1c2nccc1 | None | |||
| 2895 | 203592 | 41 | None | -1 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | None | |||
| CHEMBL669 | 203592 | 41 | None | -1 | 8 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | None | |||
| 10102 | 2546 | 88 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | None | |||
| 1824 | 2546 | 88 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | None | |||
| 65906 | 2546 | 88 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | None | |||
| CHEMBL94454 | 2546 | 88 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | None | |||
| DB12523 | 2546 | 88 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | None | |||
| 5584 | 203211 | 44 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 294 | 4 | 0 | 2 | 4.1 | CC(CN(C)C)CN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL644 | 203211 | 44 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 294 | 4 | 0 | 2 | 4.1 | CC(CN(C)C)CN1c2ccccc2CCc2ccccc21 | None | |||
| 3219 | 199795 | 60 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 302 | 5 | 0 | 5 | 2.2 | CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | None | |||
| CHEMBL594 | 199795 | 60 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 302 | 5 | 0 | 5 | 2.2 | CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21 | None | |||
| 2444 | 14478 | 26 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 333 | 6 | 0 | 2 | 4.1 | CN(C)CCOC(c1ccccc1)c1ccc(Br)cc1 | None | |||
| CHEMBL1201245 | 14478 | 26 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 333 | 6 | 0 | 2 | 4.1 | CN(C)CCOC(c1ccccc1)c1ccc(Br)cc1 | None | |||
| 1027 | 1576 | 73 | None | -6 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | |||
| 3241 | 1576 | 73 | None | -6 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | |||
| 7176 | 1576 | 73 | None | -6 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL1106 | 1576 | 73 | None | -6 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | |||
| DB00751 | 1576 | 73 | None | -6 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 249 | 0 | 2 | 1 | 2.7 | N=C1NCC2N1c1ccccc1Cc1c2cccc1 | None | |||
| 6761 | 67799 | 19 | None | -1 | 18 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 401 | 5 | 1 | 4 | 4.5 | NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 | None | |||
| CHEMBL1909072 | 67799 | 19 | None | -1 | 18 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 401 | 5 | 1 | 4 | 4.5 | NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 | None | |||
| 1201549 | 597 | 24 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | None | |||
| 333 | 597 | 24 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | None | |||
| 7601 | 597 | 24 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | None | |||
| CHEMBL1201203 | 597 | 24 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | None | |||
| CHEMBL438151 | 597 | 24 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | None | |||
| DB00245 | 597 | 24 | None | -1 | 20 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | None | |||
| 16667681 | 216153 | 0 | 3H-trans-H2-PAT,(-) | -4 | 3 | Guinea pig | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 1353 | 1911 | 93 | 3H-MEPYRAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 3559 | 1911 | 93 | 3H-MEPYRAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 86 | 1911 | 93 | 3H-MEPYRAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| CHEMBL54 | 1911 | 93 | 3H-MEPYRAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| DB00502 | 1911 | 93 | 3H-MEPYRAMINE | -213 | 83 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | None | |||
| 62857 | 216181 | 0 | 3H-PYRILAMINE | -12 | 7 | Guinea pig | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 345 | 6 | 1 | 2 | 4.9 | CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F.Cl | None | |||
| 24740862 | 148008 | 0 | UNDEFINED | -4 | 5 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 369 | 6 | 1 | 5 | 4.4 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1F | None | |||
| CHEMBL393436 | 148008 | 0 | UNDEFINED | -4 | 5 | Human | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 369 | 6 | 1 | 5 | 4.4 | CCOc1cc(CN2CCC(Nc3nc4ccccc4o3)CC2)ccc1F | None | |||
| 3033769 | 3281 | 61 | 3H-PYRILAMINE | -2344 | 19 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| 3033769 | 3281 | 61 | 3H-MEPYRAMINE | -2344 | 19 | Rat | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| 3299 | 3281 | 61 | 3H-PYRILAMINE | -2344 | 19 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| 3299 | 3281 | 61 | 3H-MEPYRAMINE | -2344 | 19 | Rat | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| 94 | 3281 | 61 | 3H-PYRILAMINE | -2344 | 19 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| 94 | 3281 | 61 | 3H-MEPYRAMINE | -2344 | 19 | Rat | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| CHEMBL8809 | 3281 | 61 | 3H-PYRILAMINE | -2344 | 19 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| CHEMBL8809 | 3281 | 61 | 3H-MEPYRAMINE | -2344 | 19 | Rat | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| DB12518 | 3281 | 61 | 3H-PYRILAMINE | -2344 | 19 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| DB12518 | 3281 | 61 | 3H-MEPYRAMINE | -2344 | 19 | Rat | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 346 | 5 | 2 | 4 | 2.9 | CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl | None | |||
| 13091268 | 78224 | 0 | UNDEFINED | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | None | |||
| CHEMBL210578 | 78224 | 0 | UNDEFINED | -9549 | 14 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 401 | 6 | 1 | 3 | 5.0 | O=C(CCCN1C2CCC1CC(O)(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 | None | |||
| 2389 | 3331 | 118 | UNDEFINED | -346 | 67 | Rat | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 5073 | 3331 | 118 | UNDEFINED | -346 | 67 | Rat | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 96 | 3331 | 118 | UNDEFINED | -346 | 67 | Rat | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| CHEMBL85 | 3331 | 118 | UNDEFINED | -346 | 67 | Rat | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| DB00734 | 3331 | 118 | UNDEFINED | -346 | 67 | Rat | 7.1 | pKi | = | 7.1 | Binding | PDSP KiDatabase | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | None | |||
| 2995 | 204405 | 53 | 3H-Histamine | -42 | 23 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL1696 | 204405 | 53 | 3H-Histamine | -42 | 23 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| CHEMBL72 | 204405 | 53 | 3H-Histamine | -42 | 23 | Rat | 6.1 | pKi | = | 6.1 | Binding | PDSP KiDatabase | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | None | |||
| 46780481 | 107531 | 20 | None | -13 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 9903970 | 107531 | 20 | None | -13 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3187365 | 107531 | 20 | None | -13 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3544974 | 107531 | 20 | None | -13 | 53 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 2726 | 919 | 68 | 3H-MEPYRAMINE | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 2726 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-MEPYRAMINE | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-MEPYRAMINE | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-MEPYRAMINE | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-MEPYRAMINE | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | 3H-doxepin | -2 | 72 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 2710 | 84308 | 31 | 3H-MEPYRAMINE | -1 | 3 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 300 | 3 | 0 | 2 | 3.7 | CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1 | None | |||
| CHEMBL22150 | 84308 | 31 | 3H-MEPYRAMINE | -1 | 3 | Rat | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 300 | 3 | 0 | 2 | 3.7 | CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1 | None | |||
| 135 | 2532 | 43 | None | -1 | 58 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 2726 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 621 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 83 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL71 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB00477 | 919 | 68 | UNDEFINED | -2 | 72 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | None | |||
| 1228 | 3866 | 34 | 3H-MEPYRAMINE | -10 | 4 | Mouse | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | 3H-MEPYRAMINE | -10 | 4 | Mouse | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | 3H-MEPYRAMINE | -10 | 4 | Mouse | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | 3H-MEPYRAMINE | -10 | 4 | Mouse | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | 3H-MEPYRAMINE | -10 | 4 | Mouse | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | None | |||
| 21855 | 84246 | 42 | None | 7 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 292 | 5 | 0 | 2 | 4.1 | CC(C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | None | |||
| CHEMBL22108 | 84246 | 42 | None | 7 | 6 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 292 | 5 | 0 | 2 | 4.1 | CC(C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1 | None | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | None | |||
| 1224 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-MEPYRAMINE | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 103 | 4153 | 61 | None | -1 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 2875 | 4153 | 61 | None | -1 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 5736 | 4153 | 61 | None | -1 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| CHEMBL285802 | 4153 | 61 | None | -1 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| DB09225 | 4153 | 61 | None | -1 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | None | |||
| 135 | 2532 | 43 | None | -1 | 58 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 1796 | 2532 | 43 | None | -1 | 58 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 4184 | 2532 | 43 | None | -1 | 58 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| CHEMBL6437 | 2532 | 43 | None | -1 | 58 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| DB06148 | 2532 | 43 | None | -1 | 58 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | None | |||
| 72287 | 61061 | 38 | None | 6 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 328 | 5 | 0 | 4 | 4.5 | COc1ccc2c(c1)N(C[C@H](C)CN(C)C)c1ccccc1S2 | None | |||
| CHEMBL1764 | 61061 | 38 | None | 6 | 2 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 328 | 5 | 0 | 4 | 4.5 | COc1ccc2c(c1)N(C[C@H](C)CN(C)C)c1ccccc1S2 | None | |||
| 2435 | 3590 | 83 | None | -95 | 48 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 60149 | 3590 | 83 | None | -95 | 48 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 98 | 3590 | 83 | None | -95 | 48 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| CHEMBL12713 | 3590 | 83 | None | -95 | 48 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| DB06144 | 3590 | 83 | None | -95 | 48 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | None | |||
| 180 | 401 | 56 | None | -1 | 40 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 200 | 401 | 56 | None | -1 | 40 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 2160 | 401 | 56 | None | -1 | 40 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| CHEMBL629 | 401 | 56 | None | -1 | 40 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| DB00321 | 401 | 56 | None | -1 | 40 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | None | |||
| 62865 | 1274 | 0 | 3H-PYRILAMINE | -3 | 14 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 323 | 4 | 0 | 4 | 4.4 | N#Cc1ccc2c(c1)N(CC(CN(C)C)C)c1c(S2)cccc1 | None | |||
| 746 | 1274 | 0 | 3H-PYRILAMINE | -3 | 14 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 323 | 4 | 0 | 4 | 4.4 | N#Cc1ccc2c(c1)N(CC(CN(C)C)C)c1c(S2)cccc1 | None | |||
| 84 | 1274 | 0 | 3H-PYRILAMINE | -3 | 14 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 323 | 4 | 0 | 4 | 4.4 | N#Cc1ccc2c(c1)N(CC(CN(C)C)C)c1c(S2)cccc1 | None | |||
| CHEMBL2104153 | 1274 | 0 | 3H-PYRILAMINE | -3 | 14 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 323 | 4 | 0 | 4 | 4.4 | N#Cc1ccc2c(c1)N(CC(CN(C)C)C)c1c(S2)cccc1 | None | |||
| DB09000 | 1274 | 0 | 3H-PYRILAMINE | -3 | 14 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 323 | 4 | 0 | 4 | 4.4 | N#Cc1ccc2c(c1)N(CC(CN(C)C)C)c1c(S2)cccc1 | None | |||
| 46780481 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| 9903970 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3187365 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| CHEMBL3544974 | 107531 | 20 | 3H-PYRILAMINE | -13 | 53 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 285 | 0 | 0 | 2 | 4.3 | CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 | None | |||
| None | 215992 | 0 | 3H-MEPYRAMINE | 1 | 11 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 522 | 10 | 0 | 3 | 6.2 | C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl | None | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | None | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | None | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | None | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | None | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | None | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 1530 | 2182 | 50 | None | 5 | 21 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 3827 | 2182 | 50 | None | 5 | 21 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 7206 | 2182 | 50 | None | 5 | 21 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| CHEMBL534 | 2182 | 50 | None | 5 | 21 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| DB00920 | 2182 | 50 | None | 5 | 21 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | None | |||
| 135398745 | 2914 | 112 | None | -1 | 65 | Rat | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 47 | 2914 | 112 | None | -1 | 65 | Rat | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| CHEMBL715 | 2914 | 112 | None | -1 | 65 | Rat | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| DB00334 | 2914 | 112 | None | -1 | 65 | Rat | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | None | |||
| 1224 | 1432 | 83 | 3H-trans-H2-PAT,(-) | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 1224 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-trans-H2-PAT,(-) | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 3100 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-trans-H2-PAT,(-) | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 8980 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-trans-H2-PAT,(-) | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 916 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-trans-H2-PAT,(-) | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| CHEMBL657 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-trans-H2-PAT,(-) | 1 | 13 | Guinea pig | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| DB01075 | 1432 | 83 | 3H-MEPYRAMINE | -2 | 13 | Human | 8.0 | pKi | = | 8.0 | Binding | PDSP KiDatabase | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | None | |||
| 2286 | 3183 | 51 | None | -2 | 30 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 4927 | 3183 | 51 | None | -2 | 30 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 7282 | 3183 | 51 | None | -2 | 30 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| CHEMBL643 | 3183 | 51 | None | -2 | 30 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| DB01069 | 3183 | 51 | None | -2 | 30 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | None | |||
| 1238 | 203174 | 24 | None | -38 | 16 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 344 | 1 | 0 | 3 | 4.3 | CN1CCN(C2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | None | |||
| CHEMBL64249 | 203174 | 24 | None | -38 | 16 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 344 | 1 | 0 | 3 | 4.3 | CN1CCN(C2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 | None | |||
| 1225 | 1471 | 26 | None | -1 | 22 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 3958 | 1471 | 26 | None | -1 | 22 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 667477 | 1471 | 26 | None | -1 | 22 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| CHEMBL860 | 1471 | 26 | None | -1 | 22 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| DB01142 | 1471 | 26 | None | -1 | 22 | Human | 8.0 | pKi | = | 8.0 | Binding | Drug Central | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | None | |||
| 1228 | 3866 | 34 | None | -5 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 2763 | 3866 | 34 | None | -5 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 5282443 | 3866 | 34 | None | -5 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| CHEMBL855 | 3866 | 34 | None | -5 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| DB00427 | 3866 | 34 | None | -5 | 4 | Human | 8.0 | pKi | = | 8 | Binding | Drug Central | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | None | |||
| 134 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1775 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 9681 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| CHEMBL1065 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| DB00247 | 2514 | 24 | 3H-MEPYRAMINE | -933 | 67 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 114743 | 216101 | 0 | 3H-PYRILAMINE | -5 | 8 | Human | 5.1 | pKi | = | 5.1 | Binding | PDSP KiDatabase | 291 | 1 | 1 | 1 | 4.9 | C1CC(C2=CC=CC=C2C1C3=CC(=C(C=C3)Cl)Cl)N | None | |||
| 10065083 | 32103 | 1 | UNDEFINED | -141 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 328 | 6 | 0 | 5 | 2.4 | O=C(CCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1 | None | |||
| CHEMBL140872 | 32103 | 1 | UNDEFINED | -141 | 10 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 328 | 6 | 0 | 5 | 2.4 | O=C(CCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1 | None | |||
| 46882133 | 5808 | 0 | UNDEFINED | -5 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 478 | 9 | 2 | 7 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NC(=O)C5CCC5)ccc4o3)CC2)ccc1OC | None | |||
| CHEMBL1078896 | 5808 | 0 | UNDEFINED | -5 | 7 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 478 | 9 | 2 | 7 | 5.1 | CCOc1cc(CN2CCC(Nc3nc4cc(NC(=O)C5CCC5)ccc4o3)CC2)ccc1OC | None | |||
| 1209 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 203 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 3386 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| CHEMBL41 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| DB00472 | 1658 | 75 | 3H-PYRILAMINE | -223 | 32 | Guinea pig | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | None | |||
| 44350664 | 118149 | 0 | UNDEFINED | -9 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 351 | 6 | 0 | 2 | 5.2 | O=C(CCCN1C2CCC1CC(c1ccccc1)C2)c1ccc(F)cc1 | None | |||
| CHEMBL340816 | 118149 | 0 | UNDEFINED | -9 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 351 | 6 | 0 | 2 | 5.2 | O=C(CCCN1C2CCC1CC(c1ccccc1)C2)c1ccc(F)cc1 | None | |||
| CHEMBL553417 | 118149 | 0 | UNDEFINED | -9 | 6 | Human | 6.0 | pKi | = | 6.0 | Binding | PDSP KiDatabase | 351 | 6 | 0 | 2 | 5.2 | O=C(CCCN1C2CCC1CC(c1ccccc1)C2)c1ccc(F)cc1 | None | |||
| 16667681 | 216153 | 0 | 3H-MEPYRAMINE | -4 | 3 | Guinea pig | 7.0 | pKi | = | 7.0 | Binding | PDSP KiDatabase | 390 | 7 | 1 | 5 | 3.5 | CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)C=CC(=O)O)Cl | None | |||
| 1204 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1247 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 1375 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 774 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| CHEMBL90 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| DB05381 | 1932 | 119 | 3H-trans-H2-PAT,(-) | -46 | 24 | Guinea pig | 5.0 | pKi | = | 5 | Binding | PDSP KiDatabase | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | None | |||
| 180 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 16782354 | |||
| 200 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 16782354 | |||
| 2160 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 16782354 | |||
| CHEMBL629 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 16782354 | |||
| DB00321 | 401 | 56 | None | -1 | 40 | Human | 9.3 | pKi | = | 9.3 | Binding | Guide to Pharmacology | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 16782354 | |||
| 11753159 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 23031591 | |||
| 7679 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 23031591 | |||
| CHEMBL2158814 | 547 | 6 | None | -1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | Guide to Pharmacology | 525 | 5 | 1 | 5 | 4.7 | Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CCC(CC1)N1CCC(CC1)Oc1ccc(c(c1)Cl)Cl | 23031591 | |||
| 11579 | 635 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | 16274260 | |||
| 185460 | 635 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | 16274260 | |||
| CHEMBL1742423 | 635 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | 16274260 | |||
| DB11591 | 635 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | 463 | 10 | 1 | 5 | 4.9 | CCOCCn1c(nc2c1cccc2)C1CCN(CC1)CCc1ccc(cc1)C(C(=O)O)(C)C | 16274260 | |||
| 2749 | 344 | 40 | None | 1 | 2 | Bovine | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | 2884340 | |||
| 5574 | 344 | 40 | None | 1 | 2 | Bovine | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | 2884340 | |||
| 7237 | 344 | 40 | None | 1 | 2 | Bovine | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | 2884340 | |||
| CHEMBL829 | 344 | 40 | None | 1 | 2 | Bovine | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | 2884340 | |||
| DB01246 | 344 | 40 | None | 1 | 2 | Bovine | 9.1 | pKi | = | 9.1 | Binding | Guide to Pharmacology | 298 | 4 | 0 | 3 | 4.5 | CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C | 2884340 | |||
| 10102 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 19553115 | |||
| 1824 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 19553115 | |||
| 65906 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 19553115 | |||
| CHEMBL94454 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 19553115 | |||
| DB12523 | 2546 | 88 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 432 | 5 | 1 | 6 | 3.4 | Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C | 19553115 | |||
| 277 | 1301 | 62 | None | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | Guide to Pharmacology | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 7925364 | |||
| 2913 | 1301 | 62 | None | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | Guide to Pharmacology | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 7925364 | |||
| 765 | 1301 | 62 | None | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | Guide to Pharmacology | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 7925364 | |||
| CHEMBL516 | 1301 | 62 | None | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | Guide to Pharmacology | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 7925364 | |||
| DB00434 | 1301 | 62 | None | -2 | 50 | Human | 10.2 | pKi | = | 10.2 | Binding | Guide to Pharmacology | 287 | 0 | 0 | 1 | 4.7 | CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1 | 7925364 | |||
| 26987 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | Guide to Pharmacology | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| 6063 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | Guide to Pharmacology | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| 671 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | Guide to Pharmacology | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| CHEMBL1626 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | Guide to Pharmacology | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| DB00283 | 949 | 33 | None | 16 | 21 | Human | 10.3 | pKi | = | 10.3 | Binding | Guide to Pharmacology | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | None | |||
| 10447834 | 1933 | 4 | None | -1862 | 5 | Human | 5.7 | pKi | = | 5.7 | Binding | Guide to Pharmacology | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 15947036 | |||
| 4026 | 1933 | 4 | None | -1862 | 5 | Human | 5.7 | pKi | = | 5.7 | Binding | Guide to Pharmacology | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 15947036 | |||
| CHEMBL275507 | 1933 | 4 | None | -1862 | 5 | Human | 5.7 | pKi | = | 5.7 | Binding | Guide to Pharmacology | 305 | 7 | 2 | 2 | 3.7 | NCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 15947036 | |||
| 5048 | 3133 | 64 | None | -109 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | Guide to Pharmacology | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 26084539 | |||
| 8924 | 3133 | 64 | None | -109 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | Guide to Pharmacology | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 26084539 | |||
| 9948102 | 3133 | 64 | None | -109 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | Guide to Pharmacology | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 26084539 | |||
| CHEMBL462605 | 3133 | 64 | None | -109 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | Guide to Pharmacology | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 26084539 | |||
| DB11642 | 3133 | 64 | None | -109 | 7 | Human | 5.8 | pKi | = | 5.8 | Binding | Guide to Pharmacology | 295 | 8 | 0 | 2 | 4.2 | Clc1ccc(cc1)CCCOCCCN1CCCCC1 | 26084539 | |||
| 10403687 | 2511 | 3 | None | -331 | 5 | Human | 6.4 | pKi | = | 6.4 | Binding | Guide to Pharmacology | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 12626648 | |||
| 1205 | 2511 | 3 | None | -331 | 5 | Human | 6.4 | pKi | = | 6.4 | Binding | Guide to Pharmacology | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 12626648 | |||
| CHEMBL275035 | 2511 | 3 | None | -331 | 5 | Human | 6.4 | pKi | = | 6.4 | Binding | Guide to Pharmacology | 319 | 8 | 2 | 2 | 3.9 | CNCCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1 | 12626648 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 6.6 | pKi | = | 6.6 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 1215 | 2083 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| 150716 | 2083 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| 28145930 | 2083 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| CHEMBL1334217 | 2083 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| 10104 | 3566 | 12 | None | -2 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | 292 | 5 | 0 | 2 | 4.1 | CN(CCC1=C([C@@H](c2ccccn2)C)c2c(C1)cccc2)C | 12593665 | |||
| 6604866 | 3566 | 12 | None | -2 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | 292 | 5 | 0 | 2 | 4.1 | CN(CCC1=C([C@@H](c2ccccn2)C)c2c(C1)cccc2)C | 12593665 | |||
| CHEMBL1493369 | 3566 | 12 | None | -2 | 6 | Human | 7.2 | pKi | = | 7.2 | Binding | Guide to Pharmacology | 292 | 5 | 0 | 2 | 4.1 | CN(CCC1=C([C@@H](c2ccccn2)C)c2c(C1)cccc2)C | 12593665 | |||
| 2600 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 19660947 | |||
| 2608 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 19660947 | |||
| 5405 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 19660947 | |||
| CHEMBL17157 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 19660947 | |||
| DB00342 | 3779 | 74 | None | 1 | 13 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 19660947 | |||
| 1605 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 15771458 | |||
| 3957 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 15771458 | |||
| 7216 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 15771458 | |||
| CHEMBL998 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 15771458 | |||
| DB00455 | 2342 | 117 | None | -2 | 4 | Human | 7.4 | pKi | = | 7.4 | Binding | Guide to Pharmacology | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 15771458 | |||
| 1170 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | Guide to Pharmacology | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 19660947 | |||
| 3348 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | Guide to Pharmacology | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 19660947 | |||
| 4819 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | Guide to Pharmacology | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 19660947 | |||
| 74685737 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | Guide to Pharmacology | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 19660947 | |||
| CHEMBL914 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | Guide to Pharmacology | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 19660947 | |||
| DB00950 | 1633 | 75 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | Guide to Pharmacology | 501 | 10 | 3 | 4 | 5.5 | OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C | 19660947 | |||
| 1224 | 1432 | 83 | None | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 12065734 | |||
| 3100 | 1432 | 83 | None | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 12065734 | |||
| 8980 | 1432 | 83 | None | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 12065734 | |||
| 916 | 1432 | 83 | None | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 12065734 | |||
| CHEMBL657 | 1432 | 83 | None | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 12065734 | |||
| DB01075 | 1432 | 83 | None | -2 | 13 | Human | 7.9 | pKi | = | 7.9 | Binding | Guide to Pharmacology | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 12065734 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 21381763 | |||
| 1222 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 7925364 | |||
| 2678 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 7925364 | |||
| 581 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 7925364 | |||
| CHEMBL1000 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 7925364 | |||
| DB00341 | 881 | 0 | None | -1 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 7925364 | |||
| 6726 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 7151 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 749 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| CHEMBL648 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| DB01176 | 1280 | 51 | None | 3 | 13 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 266 | 3 | 0 | 2 | 3.0 | CN1CCN(CC1)C(c1ccccc1)c1ccccc1 | None | |||
| 5282426 | 1466 | 0 | None | 4 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 295 | 3 | 0 | 2 | 4.7 | CN(CC/C=C/1\c2ccccc2SCc2c1cccc2)C | 10379421 | |||
| 7549 | 1466 | 0 | None | 4 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 295 | 3 | 0 | 2 | 4.7 | CN(CC/C=C/1\c2ccccc2SCc2c1cccc2)C | 10379421 | |||
| CHEMBL108947 | 1466 | 0 | None | 4 | 6 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 295 | 3 | 0 | 2 | 4.7 | CN(CC/C=C/1\c2ccccc2SCc2c1cccc2)C | 10379421 | |||
| 11976 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 19091563 | |||
| 667467 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 19091563 | |||
| CHEMBL908 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 19091563 | |||
| DB01239 | 920 | 59 | None | -4 | 24 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 315 | 3 | 0 | 2 | 5.2 | CN(C)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)Cl | 19091563 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 1210 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 1213 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 2725 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 33036 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 4411 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 616 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 6976 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| 716121 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| CHEMBL1201353 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| CHEMBL1554789 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| CHEMBL505 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| DB01114 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 12065734 | |||
| DB13679 | 918 | 51 | None | -20 | 21 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 7925364 | |||
| 1214 | 2068 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| 1549000 | 2068 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| 1566 | 2068 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| 28145931 | 2068 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| CHEMBL1201191 | 2068 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| DB06282 | 2068 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 388 | 8 | 1 | 4 | 3.1 | OC(=O)COCCN1CCN(CC1)[C@@H](c1ccc(cc1)Cl)c1ccccc1 | 15206929 | |||
| 2247 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 12747773 | |||
| 249 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 12747773 | |||
| 2603 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 12747773 | |||
| CHEMBL296419 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 12747773 | |||
| DB00637 | 505 | 81 | None | -4 | 42 | Human | 8.5 | pKi | = | 8.5 | Binding | Guide to Pharmacology | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 12747773 | |||
| 1530 | 2182 | 50 | None | -5 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 21470866 | |||
| 3827 | 2182 | 50 | None | -5 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 21470866 | |||
| 7206 | 2182 | 50 | None | -5 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 21470866 | |||
| CHEMBL534 | 2182 | 50 | None | -5 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 21470866 | |||
| DB00920 | 2182 | 50 | None | -5 | 21 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 21470866 | |||
| 1400 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 11809864 | |||
| 3658 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 11809864 | |||
| 7199 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 11809864 | |||
| 91513 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 11809864 | |||
| CHEMBL896 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 11809864 | |||
| DB00557 | 1957 | 70 | None | 2 | 3 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 374 | 8 | 1 | 4 | 3.1 | OCCOCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1 | 11809864 | |||
| 1228 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 12065734 | |||
| 1228 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 7925364 | |||
| 2763 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 12065734 | |||
| 2763 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 7925364 | |||
| 5282443 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 12065734 | |||
| 5282443 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 7925364 | |||
| CHEMBL855 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 12065734 | |||
| CHEMBL855 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 7925364 | |||
| DB00427 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 12065734 | |||
| DB00427 | 3866 | 34 | None | -5 | 4 | Human | 8.8 | pKi | = | 8.8 | Binding | Guide to Pharmacology | 278 | 4 | 0 | 2 | 3.9 | Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1 | 7925364 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 12065734 | |||
| 1227 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 15206929 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 12065734 | |||
| 2331 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 15206929 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 12065734 | |||
| 3957 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 15206929 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 12065734 | |||
| 4992 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 15206929 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 12065734 | |||
| CHEMBL511 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 15206929 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 12065734 | |||
| DB06691 | 2489 | 43 | None | -2 | 12 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 285 | 7 | 0 | 4 | 2.7 | COc1ccc(cc1)CN(c1ccccn1)CCN(C)C | 15206929 | |||
| 2267 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 21381763 | |||
| 271 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 21381763 | |||
| 7121 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 21381763 | |||
| CHEMBL639 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 21381763 | |||
| DB00972 | 559 | 71 | None | 10 | 7 | Human | 8.9 | pKi | = | 8.9 | Binding | Guide to Pharmacology | 381 | 3 | 0 | 4 | 4.3 | CN1CCCC(CC1)n1nc(Cc2ccc(cc2)Cl)c2c(c1=O)cccc2 | 21381763 | |||
| 124087 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 15482930 | |||
| 7157 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 15482930 | |||
| 814 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 15482930 | |||
| CHEMBL1172 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 15482930 | |||
| DB00967 | 1389 | 114 | None | 3 | 15 | Human | 9.0 | pKi | = | 9.0 | Binding | Guide to Pharmacology | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 15482930 | |||
| 2286 | 3183 | 51 | None | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 16782354 | |||
| 4927 | 3183 | 51 | None | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 16782354 | |||
| 7282 | 3183 | 51 | None | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 16782354 | |||
| CHEMBL643 | 3183 | 51 | None | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 16782354 | |||
| DB01069 | 3183 | 51 | None | -2 | 30 | Human | 9.6 | pKi | = | 9.6 | Binding | Guide to Pharmacology | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 16782354 | |||
| 10103 | 3416 | 72 | None | -25 | 3 | Guinea pig | 7.0 | pKi | = | 7 | Binding | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 8996188 | |||
| 133017 | 3416 | 72 | None | -25 | 3 | Guinea pig | 7.0 | pKi | = | 7 | Binding | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 8996188 | |||
| 2413 | 3416 | 72 | None | -25 | 3 | Guinea pig | 7.0 | pKi | = | 7 | Binding | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 8996188 | |||
| CHEMBL91397 | 3416 | 72 | None | -25 | 3 | Guinea pig | 7.0 | pKi | = | 7 | Binding | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 8996188 | |||
| DB11614 | 3416 | 72 | None | -25 | 3 | Guinea pig | 7.0 | pKi | = | 7 | Binding | Guide to Pharmacology | 415 | 2 | 0 | 3 | 5.6 | Cc1cncc(c1)CN1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 8996188 | |||
| 1265 | 942 | 60 | None | -17782 | 8 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 270 | 7 | 1 | 3 | 3.0 | O=C(c1ccc(cc1)OCCCc1[nH]cnc1)C1CC1 | 26084539 | |||
| 6422124 | 942 | 60 | None | -17782 | 8 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 270 | 7 | 1 | 3 | 3.0 | O=C(c1ccc(cc1)OCCCc1[nH]cnc1)C1CC1 | 26084539 | |||
| CHEMBL14638 | 942 | 60 | None | -17782 | 8 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 270 | 7 | 1 | 3 | 3.0 | O=C(c1ccc(cc1)OCCCc1[nH]cnc1)C1CC1 | 26084539 | |||
| 441082 | 1163 | 48 | None | -2137 | 8 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 356 | 1 | 0 | 2 | 4.8 | CN([C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]24[C@H]3CC[C@@H]4[C@@H](N(C2)C)C)C1)C)C | 26084539 | |||
| 8981 | 1163 | 48 | None | -2137 | 8 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 356 | 1 | 0 | 2 | 4.8 | CN([C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]24[C@H]3CC[C@@H]4[C@@H](N(C2)C)C)C1)C)C | 26084539 | |||
| CHEMBL191703 | 1163 | 48 | None | -2137 | 8 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 356 | 1 | 0 | 2 | 4.8 | CN([C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]24[C@H]3CC[C@@H]4[C@@H](N(C2)C)C)C1)C)C | 26084539 | |||
| 117072554 | 2023 | 0 | None | -1995 | 4 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 450 | 5 | 2 | 6 | 2.3 | CN1CCN(CC1)C1=CC(=NC(N1)N)c1ccc2c(c1)CN(CC2)C(=O)CCC1CCCC1 | 26084539 | |||
| 8982 | 2023 | 0 | None | -1995 | 4 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 450 | 5 | 2 | 6 | 2.3 | CN1CCN(CC1)C1=CC(=NC(N1)N)c1ccc2c(c1)CN(CC2)C(=O)CCC1CCCC1 | 26084539 | |||
| 11697697 | 2547 | 24 | None | -6309 | 6 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 431 | 6 | 0 | 5 | 4.6 | Cc1nc2cccc(c2c(=O)n1c1ccc(cc1)OCCCN1CCCC1)C(F)(F)F | 26084539 | |||
| 7346 | 2547 | 24 | None | -6309 | 6 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 431 | 6 | 0 | 5 | 4.6 | Cc1nc2cccc(c2c(=O)n1c1ccc(cc1)OCCCN1CCCC1)C(F)(F)F | 26084539 | |||
| CHEMBL476323 | 2547 | 24 | None | -6309 | 6 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 431 | 6 | 0 | 5 | 4.6 | Cc1nc2cccc(c2c(=O)n1c1ccc(cc1)OCCCN1CCCC1)C(F)(F)F | 26084539 | |||
| DB11910 | 2547 | 24 | None | -6309 | 6 | Human | 5.0 | pKi | > | 5 | Binding | Guide to Pharmacology | 431 | 6 | 0 | 5 | 4.6 | Cc1nc2cccc(c2c(=O)n1c1ccc(cc1)OCCCN1CCCC1)C(F)(F)F | 26084539 | |||
| 24994634 | 2142 | 31 | None | -194 | 7 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | 221 | 2 | 2 | 5 | 0.7 | N[C@@H]1CCN(C1)c1cc(nc(n1)N)C(C)C | 26084539 | |||
| 8984 | 2142 | 31 | None | -194 | 7 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | 221 | 2 | 2 | 5 | 0.7 | N[C@@H]1CCN(C1)c1cc(nc(n1)N)C(C)C | 26084539 | |||
| CHEMBL3236549 | 2142 | 31 | None | -194 | 7 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | 221 | 2 | 2 | 5 | 0.7 | N[C@@H]1CCN(C1)c1cc(nc(n1)N)C(C)C | 26084539 | |||
| 45257132 | 3682 | 10 | None | -83 | 4 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | 366 | 4 | 2 | 6 | 2.7 | CN1CCN(CC1)c1cc(NCc2c(Cl)cccc2Cl)nc(n1)N | 26084539 | |||
| 8983 | 3682 | 10 | None | -83 | 4 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | 366 | 4 | 2 | 6 | 2.7 | CN1CCN(CC1)c1cc(NCc2c(Cl)cccc2Cl)nc(n1)N | 26084539 | |||
| CHEMBL595180 | 3682 | 10 | None | -83 | 4 | Human | 6.0 | pKi | > | 6 | Binding | Guide to Pharmacology | 366 | 4 | 2 | 6 | 2.7 | CN1CCN(CC1)c1cc(NCc2c(Cl)cccc2Cl)nc(n1)N | 26084539 | |||
| 3012003 | 216145 | 0 | None | -6 | 12 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 311 | 5 | 0 | 3 | 3.8 | CN1CCC(C(C1)COC2=CC=C(C=C2)OC)C3=CC=CC=C3 | None | |||
| 134 | 2514 | 24 | None | -933 | 67 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 1775 | 2514 | 24 | None | -933 | 67 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 9681 | 2514 | 24 | None | -933 | 67 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| CHEMBL1065 | 2514 | 24 | None | -933 | 67 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| DB00247 | 2514 | 24 | None | -933 | 67 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 353 | 4 | 2 | 4 | 1.9 | CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO | None | |||
| 202 | 1508 | 77 | None | -1 | 30 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| 60835 | 1508 | 77 | None | -1 | 30 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| 972 | 1508 | 77 | None | -1 | 30 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| CHEMBL1175 | 1508 | 77 | None | -1 | 30 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| DB00476 | 1508 | 77 | None | -1 | 30 | Human | 8.3 | pKi | None | 8.3 | Binding | Drug Central | 297 | 6 | 1 | 3 | 4.6 | CNCC[C@@H](c1cccs1)Oc1cccc2c1cccc2 | None | |||
| 146570 | 43454 | 67 | None | -1 | 4 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| CHEMBL1508 | 43454 | 67 | None | -1 | 4 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 324 | 5 | 0 | 3 | 3.8 | CN(C)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 | None | |||
| 12057539 | 208041 | 42 | None | -676 | 20 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 3661 | 208041 | 42 | None | -676 | 20 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| CHEMBL9751 | 208041 | 42 | None | -676 | 20 | Human | 8.2 | pKi | None | 8.2 | Binding | Drug Central | 289 | 4 | 1 | 4 | 1.9 | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 | None | |||
| 5281878 | 1660 | 35 | None | -1 | 17 | Human | 8.0 | pKi | None | 8.0 | Binding | Drug Central | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 5281881 | 1660 | 35 | None | -1 | 17 | Human | 8.0 | pKi | None | 8.0 | Binding | Drug Central | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 948 | 1660 | 35 | None | -1 | 17 | Human | 8.0 | pKi | None | 8.0 | Binding | Drug Central | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 968 | 1660 | 35 | None | -1 | 17 | Human | 8.0 | pKi | None | 8.0 | Binding | Drug Central | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL42055 | 1660 | 35 | None | -1 | 17 | Human | 8.0 | pKi | None | 8.0 | Binding | Drug Central | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| CHEMBL54661 | 1660 | 35 | None | -1 | 17 | Human | 8.0 | pKi | None | 8.0 | Binding | Drug Central | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| DB00875 | 1660 | 35 | None | -1 | 17 | Human | 8.0 | pKi | None | 8.0 | Binding | Drug Central | 434 | 5 | 1 | 4 | 4.6 | OCCN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)C(F)(F)F | None | |||
| 1197 | 88 | 120 | None | - | 1 | Human | 3.7 | pKi | None | 3.7 | Binding | Guide to Pharmacology | 122 | 2 | 1 | 2 | 0.6 | NCCc1ccccn1 | 15206929 | |||
| 75919 | 88 | 120 | None | - | 1 | Human | 3.7 | pKi | None | 3.7 | Binding | Guide to Pharmacology | 122 | 2 | 1 | 2 | 0.6 | NCCc1ccccn1 | 15206929 | |||
| CHEMBL32813 | 88 | 120 | None | - | 1 | Human | 3.7 | pKi | None | 3.7 | Binding | Guide to Pharmacology | 122 | 2 | 1 | 2 | 0.6 | NCCc1ccccn1 | 15206929 | |||
| 1200 | 3963 | 2 | None | -39 | 3 | Human | 4.4 | pKi | None | 4.4 | Binding | Guide to Pharmacology | 335 | 8 | 4 | 5 | 0.7 | O=C(NC(=NCCCc1cnc[nH]1)N)CSCc1nc[nH]c1C | 16394198 | |||
| 25149519 | 3963 | 2 | None | -39 | 3 | Human | 4.4 | pKi | None | 4.4 | Binding | Guide to Pharmacology | 335 | 8 | 4 | 5 | 0.7 | O=C(NC(=NCCCc1cnc[nH]1)N)CSCc1nc[nH]c1C | 16394198 | |||
| CHEMBL513056 | 3963 | 2 | None | -39 | 3 | Human | 4.4 | pKi | None | 4.4 | Binding | Guide to Pharmacology | 335 | 8 | 4 | 5 | 0.7 | O=C(NC(=NCCCc1cnc[nH]1)N)CSCc1nc[nH]c1C | 16394198 | |||
| 1199 | 2976 | 0 | None | -316 | 3 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 394 | 8 | 3 | 4 | 2.5 | NC(=NCCCc1[nH]cnc1)NC(=O)CC(c1ccccn1)c1ccc(cc1)F | 16394198 | |||
| 25149244 | 2976 | 0 | None | -316 | 3 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 394 | 8 | 3 | 4 | 2.5 | NC(=NCCCc1[nH]cnc1)NC(=O)CC(c1ccccn1)c1ccc(cc1)F | 16394198 | |||
| CHEMBL472273 | 2976 | 0 | None | -316 | 3 | Human | 4.5 | pKi | None | 4.5 | Binding | Guide to Pharmacology | 394 | 8 | 3 | 4 | 2.5 | NC(=NCCCc1[nH]cnc1)NC(=O)CC(c1ccccn1)c1ccc(cc1)F | 16394198 | |||
| 1198 | 3962 | 1 | None | - | 1 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 401 | 8 | 4 | 4 | 2.0 | O=C(CC(c1ccc(c(c1)F)F)c1ncc[nH]1)NC(=NCCCc1cnc[nH]1)N | 16394198 | |||
| 25149704 | 3962 | 1 | None | - | 1 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 401 | 8 | 4 | 4 | 2.0 | O=C(CC(c1ccc(c(c1)F)F)c1ncc[nH]1)NC(=NCCCc1cnc[nH]1)N | 16394198 | |||
| CHEMBL470563 | 3962 | 1 | None | - | 1 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 401 | 8 | 4 | 4 | 2.0 | O=C(CC(c1ccc(c(c1)F)F)c1ncc[nH]1)NC(=NCCCc1cnc[nH]1)N | 16394198 | |||
| 1201 | 3964 | 1 | None | -2 | 2 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 361 | 7 | 3 | 3 | 2.6 | O=C(CC(c1ccccc1)c1ccccc1)NC(=NCCc1cnc[nH]1)N | 16394198 | |||
| 25150700 | 3964 | 1 | None | -2 | 2 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 361 | 7 | 3 | 3 | 2.6 | O=C(CC(c1ccccc1)c1ccccc1)NC(=NCCc1cnc[nH]1)N | 16394198 | |||
| CHEMBL499301 | 3964 | 1 | None | -2 | 2 | Human | 4.7 | pKi | None | 4.7 | Binding | Guide to Pharmacology | 361 | 7 | 3 | 3 | 2.6 | O=C(CC(c1ccccc1)c1ccccc1)NC(=NCCc1cnc[nH]1)N | 16394198 | |||
| 1226 | 2019 | 20 | None | -354 | 6 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 321 | 9 | 4 | 4 | 1.2 | NC(=NCCCc1cnc[nH]1)NCCSCc1nc[nH]c1C | 16394198 | |||
| 41376 | 2019 | 20 | None | -354 | 6 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 321 | 9 | 4 | 4 | 1.2 | NC(=NCCCc1cnc[nH]1)NCCSCc1nc[nH]c1C | 16394198 | |||
| CHEMBL12608 | 2019 | 20 | None | -354 | 6 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 321 | 9 | 4 | 4 | 1.2 | NC(=NCCCc1cnc[nH]1)NCCSCc1nc[nH]c1C | 16394198 | |||
| 1202 | 3965 | 1 | None | - | 1 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 411 | 8 | 3 | 3 | 3.3 | O=C(CC(c1ccc(cc1)F)c1ccc(cc1)F)NC(=NCCCc1cnc[nH]1)N | 16394198 | |||
| 25150704 | 3965 | 1 | None | - | 1 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 411 | 8 | 3 | 3 | 3.3 | O=C(CC(c1ccc(cc1)F)c1ccc(cc1)F)NC(=NCCCc1cnc[nH]1)N | 16394198 | |||
| CHEMBL513883 | 3965 | 1 | None | - | 1 | Human | 5.2 | pKi | None | 5.2 | Binding | Guide to Pharmacology | 411 | 8 | 3 | 3 | 3.3 | O=C(CC(c1ccc(cc1)F)c1ccc(cc1)F)NC(=NCCCc1cnc[nH]1)N | 16394198 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12065734 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12626648 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 15206929 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 16394198 | |||
| 1204 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 7925364 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12065734 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12626648 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 15206929 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 16394198 | |||
| 1247 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 7925364 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12065734 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12626648 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 15206929 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 16394198 | |||
| 1375 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 7925364 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12065734 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12626648 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 15206929 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 16394198 | |||
| 774 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 7925364 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12065734 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12626648 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 15206929 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 16394198 | |||
| CHEMBL90 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 7925364 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12065734 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 12626648 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 15206929 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 16394198 | |||
| DB05381 | 1932 | 119 | None | -501 | 24 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 111 | 2 | 2 | 2 | -0.1 | NCCc1cnc[nH]1 | 7925364 | |||
| 1193 | 44 | 0 | None | - | 1 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 128 | 2 | 1 | 3 | 0.6 | NCCc1nccs1 | 12626648 | |||
| 87653 | 44 | 0 | None | - | 1 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 128 | 2 | 1 | 3 | 0.6 | NCCc1nccs1 | 12626648 | |||
| CHEMBL25414 | 44 | 0 | None | - | 1 | Human | 5.3 | pKi | None | 5.3 | Binding | Guide to Pharmacology | 128 | 2 | 1 | 3 | 0.6 | NCCc1nccs1 | 12626648 | |||
| 10389213 | 197 | 12 | None | -6025 | 3 | Human | 5.4 | pKi | None | 5.4 | Binding | Guide to Pharmacology | 453 | 10 | 1 | 6 | 2.6 | O=C([C@H](NC(=O)c1ccco1)C)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1 | 12606603 | |||
| 10389213 | 197 | 12 | None | -6025 | 3 | Human | 5.4 | pKi | None | 5.4 | Binding | Guide to Pharmacology | 453 | 10 | 1 | 6 | 2.6 | O=C([C@H](NC(=O)c1ccco1)C)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1 | 15294456 | |||
| 1216 | 197 | 12 | None | -6025 | 3 | Human | 5.4 | pKi | None | 5.4 | Binding | Guide to Pharmacology | 453 | 10 | 1 | 6 | 2.6 | O=C([C@H](NC(=O)c1ccco1)C)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1 | 12606603 | |||
| 1216 | 197 | 12 | None | -6025 | 3 | Human | 5.4 | pKi | None | 5.4 | Binding | Guide to Pharmacology | 453 | 10 | 1 | 6 | 2.6 | O=C([C@H](NC(=O)c1ccco1)C)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1 | 15294456 | |||
| CHEMBL361355 | 197 | 12 | None | -6025 | 3 | Human | 5.4 | pKi | None | 5.4 | Binding | Guide to Pharmacology | 453 | 10 | 1 | 6 | 2.6 | O=C([C@H](NC(=O)c1ccco1)C)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1 | 12606603 | |||
| CHEMBL361355 | 197 | 12 | None | -6025 | 3 | Human | 5.4 | pKi | None | 5.4 | Binding | Guide to Pharmacology | 453 | 10 | 1 | 6 | 2.6 | O=C([C@H](NC(=O)c1ccco1)C)N1CCN(CC1)CCCOc1ccc(cc1)C(=O)C1CC1 | 15294456 | |||
| 1217 | 199 | 0 | None | -6309 | 3 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 321 | 9 | 0 | 8 | 0.5 | CO[C@H]([C@H]([C@H](C(OC(=O)C)[2H])OC(=O)C)OC)[C@@H](OC(=O)C)C | 15294456 | |||
| 15608077 | 199 | 0 | None | -6309 | 3 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 321 | 9 | 0 | 8 | 0.5 | CO[C@H]([C@H]([C@H](C(OC(=O)C)[2H])OC(=O)C)OC)[C@@H](OC(=O)C)C | 15294456 | |||
| 1223 | 953 | 41 | None | -14125 | 11 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 308 | 6 | 2 | 3 | 3.2 | Clc1ccc(cc1)CN=C(SCCCc1cnc[nH]1)N | 12606603 | |||
| 2790 | 953 | 41 | None | -14125 | 11 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 308 | 6 | 2 | 3 | 3.2 | Clc1ccc(cc1)CN=C(SCCCc1cnc[nH]1)N | 12606603 | |||
| CHEMBL14690 | 953 | 41 | None | -14125 | 11 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 308 | 6 | 2 | 3 | 3.2 | Clc1ccc(cc1)CN=C(SCCCc1cnc[nH]1)N | 12606603 | |||
| 2181 | 3128 | 46 | None | -269 | 35 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | 8935801 | |||
| 4830 | 3128 | 46 | None | -269 | 35 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | 8935801 | |||
| 92 | 3128 | 46 | None | -269 | 35 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | 8935801 | |||
| CHEMBL440294 | 3128 | 46 | None | -269 | 35 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | 8935801 | |||
| DB09286 | 3128 | 46 | None | -269 | 35 | Human | 5.6 | pKi | None | 5.6 | Binding | Guide to Pharmacology | 375 | 7 | 1 | 4 | 2.6 | O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N | 8935801 | |||
| 1194 | 45 | 3 | None | -2089 | 4 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 12626648 | |||
| 23786499 | 45 | 3 | None | -2089 | 4 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 12626648 | |||
| CHEMBL26116 | 45 | 3 | None | -2089 | 4 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 265 | 3 | 2 | 2 | 2.3 | NCCc1cnc([nH]1)c1cccc(c1)Br | 12626648 | |||
| 1195 | 46 | 5 | None | - | 1 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 221 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)Cl | 12626648 | |||
| 14827778 | 46 | 5 | None | - | 1 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 221 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)Cl | 12626648 | |||
| CHEMBL287052 | 46 | 5 | None | - | 1 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 221 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)Cl | 12626648 | |||
| 1830 | 2590 | 44 | None | -125 | 28 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | 12629531 | |||
| 207 | 2590 | 44 | None | -125 | 28 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | 12629531 | |||
| 23897 | 2590 | 44 | None | -125 | 28 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | 12629531 | |||
| CHEMBL460 | 2590 | 44 | None | -125 | 28 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | 12629531 | |||
| DB01618 | 2590 | 44 | None | -125 | 28 | Human | 5.7 | pKi | None | 5.7 | Binding | Guide to Pharmacology | 276 | 3 | 1 | 3 | 2.0 | CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1 | 12629531 | |||
| 10245039 | 49 | 0 | None | - | 1 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 313 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)I | 12626648 | |||
| 1196 | 49 | 0 | None | - | 1 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 313 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)I | 12626648 | |||
| CHEMBL287367 | 49 | 0 | None | - | 1 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 313 | 3 | 2 | 2 | 2.2 | NCCc1cnc([nH]1)c1cccc(c1)I | 12626648 | |||
| 1218 | 229 | 52 | None | -891 | 4 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 330 | 4 | 0 | 3 | 5.0 | N#Cc1ccc(cc1)c1ccc2c(c1)cc(o2)CCN1CCC[C@H]1C | 15608078 | |||
| 9818903 | 229 | 52 | None | -891 | 4 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 330 | 4 | 0 | 3 | 5.0 | N#Cc1ccc(cc1)c1ccc2c(c1)cc(o2)CCN1CCC[C@H]1C | 15608078 | |||
| CHEMBL351231 | 229 | 52 | None | -891 | 4 | Human | 5.8 | pKi | None | 5.8 | Binding | Guide to Pharmacology | 330 | 4 | 0 | 3 | 5.0 | N#Cc1ccc(cc1)c1ccc2c(c1)cc(o2)CCN1CCC[C@H]1C | 15608078 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 12629531 | |||
| 1353 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 8935801 | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 12629531 | |||
| 3559 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 8935801 | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 12629531 | |||
| 86 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 8935801 | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 12629531 | |||
| CHEMBL54 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 8935801 | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 12629531 | |||
| DB00502 | 1911 | 93 | None | -489 | 83 | Human | 5.9 | pKi | None | 5.9 | Binding | Guide to Pharmacology | 375 | 6 | 1 | 3 | 4.4 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl | 8935801 | |||
| 16362 | 3125 | 71 | None | -489 | 30 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 12629531 | |||
| 2172 | 3125 | 71 | None | -489 | 30 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 12629531 | |||
| 90 | 3125 | 71 | None | -489 | 30 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 12629531 | |||
| CHEMBL1423 | 3125 | 71 | None | -489 | 30 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 12629531 | |||
| DB01100 | 3125 | 71 | None | -489 | 30 | Human | 6.2 | pKi | None | 6.2 | Binding | Guide to Pharmacology | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 12629531 | |||
| 10042467 | 1426 | 1 | None | -173 | 3 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 12626648 | |||
| 1203 | 1426 | 1 | None | -173 | 3 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 12626648 | |||
| CHEMBL11553 | 1426 | 1 | None | -173 | 3 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | 333 | 8 | 1 | 2 | 4.3 | CN(CCc1cnc([nH]1)CCC(c1ccccc1)c1ccccc1)C | 12626648 | |||
| 1221 | 475 | 9 | None | -12 | 3 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 12626648 | |||
| 1221 | 475 | 9 | None | -12 | 3 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 16394198 | |||
| 65895 | 475 | 9 | None | -12 | 3 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 12626648 | |||
| 65895 | 475 | 9 | None | -12 | 3 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 16394198 | |||
| CHEMBL293802 | 475 | 9 | None | -12 | 3 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 12626648 | |||
| CHEMBL293802 | 475 | 9 | None | -12 | 3 | Human | 6.5 | pKi | None | 6.5 | Binding | Guide to Pharmacology | 380 | 9 | 3 | 3 | 3.0 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)F | 16394198 | |||
| 1219 | 737 | 0 | None | -3 | 2 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 396 | 9 | 3 | 3 | 3.5 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)Cl | 12626648 | |||
| 14660352 | 737 | 0 | None | -3 | 2 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 396 | 9 | 3 | 3 | 3.5 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)Cl | 12626648 | |||
| CHEMBL304239 | 737 | 0 | None | -3 | 2 | Human | 6.6 | pKi | None | 6.6 | Binding | Guide to Pharmacology | 396 | 9 | 3 | 3 | 3.5 | NC(=NCCCc1[nH]cnc1)NCCC(c1ccccn1)c1ccc(cc1)Cl | 12626648 | |||
| 1208 | 1985 | 0 | None | - | 1 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 15657195 | 1985 | 0 | None | - | 1 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 2435 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 12629531 | |||
| 2435 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 8935801 | |||
| 60149 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 12629531 | |||
| 60149 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 8935801 | |||
| 98 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 12629531 | |||
| 98 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 8935801 | |||
| CHEMBL12713 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 12629531 | |||
| CHEMBL12713 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 8935801 | |||
| DB06144 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 12629531 | |||
| DB06144 | 3590 | 83 | None | -95 | 48 | Human | 6.9 | pKi | None | 6.9 | Binding | Guide to Pharmacology | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 8935801 | |||
| 214 | 3860 | 58 | None | -43 | 30 | Human | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| 2740 | 3860 | 58 | None | -43 | 30 | Human | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| 5566 | 3860 | 58 | None | -43 | 30 | Human | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| 66064 | 3860 | 58 | None | -43 | 30 | Human | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| CHEMBL422 | 3860 | 58 | None | -43 | 30 | Human | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| DB00831 | 3860 | 58 | None | -43 | 30 | Human | 7.2 | pKi | None | 7.2 | Binding | Guide to Pharmacology | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| 10106214 | 2103 | 1 | None | -5 | 5 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 1207 | 2103 | 1 | None | -5 | 5 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 1209 | 2103 | 1 | None | -5 | 5 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| CHEMBL127307 | 2103 | 1 | None | -5 | 5 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 475100 | 189 | 0 | None | -31 | 6 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 426 | 4 | 1 | 7 | 2.6 | OC1CCc2n(C1)c(=O)c(c(n2)C)CCN1CCC(CC1)c1noc2c1ccc(c2)F | 8935801 | |||
| 67 | 189 | 0 | None | -31 | 6 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 426 | 4 | 1 | 7 | 2.6 | OC1CCc2n(C1)c(=O)c(c(n2)C)CCN1CCC(CC1)c1noc2c1ccc(c2)F | 8935801 | |||
| CHEMBL3542429 | 189 | 0 | None | -31 | 6 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 426 | 4 | 1 | 7 | 2.6 | OC1CCc2n(C1)c(=O)c(c(n2)C)CCN1CCC(CC1)c1noc2c1ccc(c2)F | 8935801 | |||
| 242 | 470 | 124 | None | -22 | 51 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 12629531 | |||
| 34 | 470 | 124 | None | -22 | 51 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 12629531 | |||
| 60795 | 470 | 124 | None | -22 | 51 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 12629531 | |||
| CHEMBL1112 | 470 | 124 | None | -22 | 51 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 12629531 | |||
| DB01238 | 470 | 124 | None | -22 | 51 | Human | 7.5 | pKi | None | 7.5 | Binding | Guide to Pharmacology | 447 | 7 | 1 | 4 | 4.9 | O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl | 12629531 | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 12629531 | |||
| 2865 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 8935801 | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 12629531 | |||
| 59 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 8935801 | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 12629531 | |||
| 60854 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 8935801 | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 12629531 | |||
| CHEMBL708 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 8935801 | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 12629531 | |||
| DB00246 | 4143 | 73 | None | -58 | 53 | Human | 7.6 | pKi | None | 7.6 | Binding | Guide to Pharmacology | 412 | 4 | 1 | 5 | 3.8 | O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2 | 8935801 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 12629531 | |||
| 2389 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 8935801 | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 12629531 | |||
| 5073 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 8935801 | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 12629531 | |||
| 96 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 8935801 | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 12629531 | |||
| CHEMBL85 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 8935801 | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 12629531 | |||
| DB00734 | 3331 | 118 | None | -46 | 67 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 410 | 4 | 0 | 6 | 3.6 | Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2 | 8935801 | |||
| 1212 | 1662 | 50 | None | -41 | 65 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| 204 | 1662 | 50 | None | -41 | 65 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| 3372 | 1662 | 50 | None | -41 | 65 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| CHEMBL726 | 1662 | 50 | None | -41 | 65 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| DB00623 | 1662 | 50 | None | -41 | 65 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 437 | 6 | 1 | 5 | 4.3 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 12629531 | |||
| 100 | 3805 | 58 | None | -7 | 55 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 12629531 | |||
| 2637 | 3805 | 58 | None | -7 | 55 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 12629531 | |||
| 5452 | 3805 | 58 | None | -7 | 55 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 12629531 | |||
| CHEMBL479 | 3805 | 58 | None | -7 | 55 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 12629531 | |||
| DB00679 | 3805 | 58 | None | -7 | 55 | Human | 7.7 | pKi | None | 7.7 | Binding | Guide to Pharmacology | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 12629531 | |||
| 10037815 | 3141 | 0 | None | - | 1 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| 1206 | 3141 | 0 | None | - | 1 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| CHEMBL340199 | 3141 | 0 | None | - | 1 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| 1222 | 1664 | 49 | None | -17 | 33 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 8935801 | |||
| 3396 | 1664 | 49 | None | -17 | 33 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 8935801 | |||
| 85 | 1664 | 49 | None | -17 | 33 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 8935801 | |||
| CHEMBL46516 | 1664 | 49 | None | -17 | 33 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 8935801 | |||
| DB04842 | 1664 | 49 | None | -17 | 33 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 8935801 | |||
| 209 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | None | 8.1 | Binding | Guide to Pharmacology | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 12629531 | |||
| 2113 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | None | 8.1 | Binding | Guide to Pharmacology | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 12629531 | |||
| 4748 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | None | 8.1 | Binding | Guide to Pharmacology | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 12629531 | |||
| CHEMBL567 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | None | 8.1 | Binding | Guide to Pharmacology | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 12629531 | |||
| DB00850 | 3057 | 97 | None | -11 | 23 | Human | 8.1 | pKi | None | 8.1 | Binding | Guide to Pharmacology | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 12629531 | |||
| 10037815 | 3141 | 0 | None | - | 1 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| 1206 | 3141 | 0 | None | - | 1 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| CHEMBL340199 | 3141 | 0 | None | - | 1 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| 2726 | 919 | 68 | None | -2 | 72 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 12629531 | |||
| 621 | 919 | 68 | None | -2 | 72 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 12629531 | |||
| 83 | 919 | 68 | None | -2 | 72 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 12629531 | |||
| CHEMBL71 | 919 | 68 | None | -2 | 72 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 12629531 | |||
| DB00477 | 919 | 68 | None | -2 | 72 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 12629531 | |||
| 1613 | 2348 | 53 | None | -3 | 44 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 12629531 | |||
| 205 | 2348 | 53 | None | -3 | 44 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 12629531 | |||
| 3964 | 2348 | 53 | None | -3 | 44 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 12629531 | |||
| CHEMBL831 | 2348 | 53 | None | -3 | 44 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 12629531 | |||
| DB00408 | 2348 | 53 | None | -3 | 44 | Human | 8.2 | pKi | None | 8.2 | Binding | Guide to Pharmacology | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 12629531 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 12629531 | |||
| 2337 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 8935801 | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 12629531 | |||
| 50 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 8935801 | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 12629531 | |||
| 5002 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 8935801 | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 12629531 | |||
| CHEMBL716 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 8935801 | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 12629531 | |||
| DB01224 | 3256 | 77 | None | 1 | 62 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 8935801 | |||
| 212 | 3806 | 47 | None | -5 | 25 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 12629531 | |||
| 2639 | 3806 | 47 | None | -5 | 25 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 12629531 | |||
| 941651 | 3806 | 47 | None | -5 | 25 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 12629531 | |||
| CHEMBL1201 | 3806 | 47 | None | -5 | 25 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 12629531 | |||
| DB01623 | 3806 | 47 | None | -5 | 25 | Human | 8.4 | pKi | None | 8.4 | Binding | Guide to Pharmacology | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 12629531 | |||
| 10106214 | 2103 | 1 | None | -5 | 5 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 1207 | 2103 | 1 | None | -5 | 5 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 1209 | 2103 | 1 | None | -5 | 5 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| CHEMBL127307 | 2103 | 1 | None | -5 | 5 | Human | 8.5 | pKi | None | 8.5 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@@H]1Cc2ccccc2[C@H](C1)c1ccccc1)C | 12065734 | |||
| 10015055 | 2104 | 4 | None | 15 | 5 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| 1212 | 2104 | 4 | None | 15 | 5 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| CHEMBL3402679 | 2104 | 4 | None | 15 | 5 | Human | 8.7 | pKi | None | 8.7 | Binding | Guide to Pharmacology | 251 | 2 | 0 | 1 | 3.7 | CN([C@H]1Cc2ccccc2[C@@H](C1)c1ccccc1)C | 12065734 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 12629531 | |||
| 135398745 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 8935801 | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 12629531 | |||
| 47 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 8935801 | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 12629531 | |||
| CHEMBL715 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 8935801 | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 12629531 | |||
| DB00334 | 2914 | 112 | None | 1 | 65 | Human | 9.0 | pKi | None | 9.0 | Binding | Guide to Pharmacology | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 8935801 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12065734 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12629531 | |||
| 135398737 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 8935801 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12065734 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12629531 | |||
| 38 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 8935801 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12065734 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12629531 | |||
| 722 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 8935801 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12065734 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12629531 | |||
| CHEMBL42 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 8935801 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12065734 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 12629531 | |||
| DB00363 | 958 | 93 | None | 2 | 89 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 8935801 | |||
| 103 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 8935801 | |||
| 2875 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 8935801 | |||
| 5736 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 8935801 | |||
| CHEMBL285802 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 8935801 | |||
| DB09225 | 4153 | 61 | None | -1 | 53 | Human | 9.2 | pKi | None | 9.2 | Binding | Guide to Pharmacology | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 8935801 | |||
| 1225 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 12065734 | |||
| 3958 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 12065734 | |||
| 667477 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 12065734 | |||
| CHEMBL860 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 12065734 | |||
| DB01142 | 1471 | 26 | None | -1 | 22 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 279 | 3 | 0 | 2 | 4.0 | CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C | 12065734 | |||
| 163091 | 494 | 34 | None | -6 | 10 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 285 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)[C@H]1CN(C[C@@H]1c1c(O2)cccc1)C | 8935801 | |||
| 22 | 494 | 34 | None | -6 | 10 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 285 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)[C@H]1CN(C[C@@H]1c1c(O2)cccc1)C | 8935801 | |||
| CHEMBL504548 | 494 | 34 | None | -6 | 10 | Human | 9.8 | pKi | None | 9.8 | Binding | Guide to Pharmacology | 285 | 0 | 0 | 2 | 4.3 | Clc1ccc2c(c1)[C@H]1CN(C[C@@H]1c1c(O2)cccc1)C | 8935801 | |||