Ligand source activities (1 row/activity)
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Activity | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
Reference ligand |
Vendors |
Species |
Assay Type |
Activity Type |
Activity Relation |
Activity Value |
p-value (-log) |
Fold selectivity |
Tested GPCRs |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
|
| 9815409 | 12368 | None | 21 | Mouse | Functional | pEC50 | = | 5 | 5.0 | 1 | 2 | ChEMBL | 180 | 2 | 1 | 5 | 0.3 | CCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL1185481 | 12368 | None | 21 | Mouse | Functional | pEC50 | = | 5 | 5.0 | 1 | 2 | ChEMBL | 180 | 2 | 1 | 5 | 0.3 | CCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL416736 | 12368 | None | 21 | Mouse | Functional | pEC50 | = | 5 | 5.0 | 1 | 2 | ChEMBL | 180 | 2 | 1 | 5 | 0.3 | CCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| 1979 | 77355 | None | 47 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -2089 | 7 | ChEMBL | 169 | 1 | 0 | 3 | 0.6 | CC(=O)OC1CN2CCC1CC2 | 10.1021/jm960467d | |||
| CHEMBL20835 | 77355 | None | 47 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -2089 | 7 | ChEMBL | 169 | 1 | 0 | 3 | 0.6 | CC(=O)OC1CN2CCC1CC2 | 10.1021/jm960467d | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.0 | 7.0 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.0 | 7.0 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.0 | 7.0 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.0 | 7.0 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.0 | 7.0 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.0 | 7.0 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/S0960-894X(00)80538-7 | |||
| 2551.0 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/S0960-894X(00)80538-7 | |||
| 298 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/S0960-894X(00)80538-7 | |||
| 488 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/S0960-894X(00)80538-7 | |||
| CHEMBL965 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/S0960-894X(00)80538-7 | |||
| DB00411 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/S0960-894X(00)80538-7 | |||
| 3652 | 4097 | None | 50 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/acsmedchemlett.3c00331 | |||
| 57 | 4097 | None | 50 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/acsmedchemlett.3c00331 | |||
| 60809 | 4097 | None | 50 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/acsmedchemlett.3c00331 | |||
| 60809.0 | 4097 | None | 50 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/acsmedchemlett.3c00331 | |||
| CHEMBL21536 | 4097 | None | 50 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/acsmedchemlett.3c00331 | |||
| DB15357 | 4097 | None | 50 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/acsmedchemlett.3c00331 | |||
| 9838581 | 11981 | None | 1 | Mouse | Functional | pEC50 | = | 6.0 | 6.0 | 4 | 2 | ChEMBL | 166 | 1 | 1 | 5 | 0.1 | Cc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL1183042 | 11981 | None | 1 | Mouse | Functional | pEC50 | = | 6.0 | 6.0 | 4 | 2 | ChEMBL | 166 | 1 | 1 | 5 | 0.1 | Cc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL277014 | 11981 | None | 1 | Mouse | Functional | pEC50 | = | 6.0 | 6.0 | 4 | 2 | ChEMBL | 166 | 1 | 1 | 5 | 0.1 | Cc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| 3652 | 4097 | None | 50 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | -1737 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm960467d | |||
| 57 | 4097 | None | 50 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | -1737 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm960467d | |||
| 60809 | 4097 | None | 50 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | -1737 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm960467d | |||
| 60809.0 | 4097 | None | 50 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | -1737 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm960467d | |||
| CHEMBL21536 | 4097 | None | 50 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | -1737 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm960467d | |||
| DB15357 | 4097 | None | 50 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | -1737 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm960467d | |||
| 10703031 | 11154 | None | 0 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 196 | 3 | 1 | 6 | -0.1 | COCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL1178347 | 11154 | None | 0 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 196 | 3 | 1 | 6 | -0.1 | COCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL22089 | 11154 | None | 0 | Mouse | Functional | pEC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 196 | 3 | 1 | 6 | -0.1 | COCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| 44589681 | 185394 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -12 | 5 | ChEMBL | 387 | 5 | 2 | 6 | 1.5 | NC(=O)OCCN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2008.09.032 | |||
| CHEMBL485913 | 185394 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -12 | 5 | ChEMBL | 387 | 5 | 2 | 6 | 1.5 | NC(=O)OCCN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2008.09.032 | |||
| 22745278 | 187169 | None | 1 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -53 | 5 | ChEMBL | 372 | 3 | 1 | 5 | 2.6 | CCOC(=O)N1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2008.09.023 | |||
| CHEMBL491209 | 187169 | None | 1 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -53 | 5 | ChEMBL | 372 | 3 | 1 | 5 | 2.6 | CCOC(=O)N1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2008.09.023 | |||
| 306 | 3456 | None | 17 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1 | 5 | ChEMBL | 193 | 2 | 0 | 4 | 0.9 | CO/N=C(/[C@H]1CN2CCC1CC2)\C#N | 10.1016/j.bmcl.2015.08.011 | |||
| 3536 | 3456 | None | 17 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1 | 5 | ChEMBL | 193 | 2 | 0 | 4 | 0.9 | CO/N=C(/[C@H]1CN2CCC1CC2)\C#N | 10.1016/j.bmcl.2015.08.011 | |||
| 53930639 | 3456 | None | 17 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1 | 5 | ChEMBL | 193 | 2 | 0 | 4 | 0.9 | CO/N=C(/[C@H]1CN2CCC1CC2)\C#N | 10.1016/j.bmcl.2015.08.011 | |||
| 9577995 | 3456 | None | 17 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1 | 5 | ChEMBL | 193 | 2 | 0 | 4 | 0.9 | CO/N=C(/[C@H]1CN2CCC1CC2)\C#N | 10.1016/j.bmcl.2015.08.011 | |||
| CHEMBL134641 | 3456 | None | 17 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1 | 5 | ChEMBL | 193 | 2 | 0 | 4 | 0.9 | CO/N=C(/[C@H]1CN2CCC1CC2)\C#N | 10.1016/j.bmcl.2015.08.011 | |||
| 3652 | 4097 | None | 50 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm100697g | |||
| 57 | 4097 | None | 50 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm100697g | |||
| 60809 | 4097 | None | 50 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm100697g | |||
| 60809.0 | 4097 | None | 50 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm100697g | |||
| CHEMBL21536 | 4097 | None | 50 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm100697g | |||
| DB15357 | 4097 | None | 50 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm100697g | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 1726 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 10.1021/jm9705115 | |||
| 1993 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 10.1021/jm9705115 | |||
| 1993.0 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 10.1021/jm9705115 | |||
| 7438 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 10.1021/jm9705115 | |||
| CHEMBL978 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 10.1021/jm9705115 | |||
| DB06709 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | ChEMBL | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 10.1021/jm9705115 | |||
| 2230 | 465 | None | 43 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | -17 | 9 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm960467d | |||
| 296 | 465 | None | 43 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | -17 | 9 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm960467d | |||
| CHEMBL7303 | 465 | None | 43 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | -17 | 9 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm960467d | |||
| DB04365 | 465 | None | 43 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | -17 | 9 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm960467d | |||
| 10375030 | 13959 | None | 0 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 180 | 2 | 1 | 4 | -0.1 | C#CCOC(=O)C1CCC(N)=NC1 | 10.1021/jm960467d | |||
| CHEMBL1196670 | 13959 | None | 0 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 180 | 2 | 1 | 4 | -0.1 | C#CCOC(=O)C1CCC(N)=NC1 | 10.1021/jm960467d | |||
| CHEMBL557795 | 13959 | None | 0 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 180 | 2 | 1 | 4 | -0.1 | C#CCOC(=O)C1CCC(N)=NC1 | 10.1021/jm960467d | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 650899 | 54430 | None | 6 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -4 | 5 | ChEMBL | 319 | 6 | 2 | 4 | 1.6 | CCOC(=O)N1CCC(NCCNC(=O)c2ccccc2)CC1 | nan | |||
| CHEMBL1535797 | 54430 | None | 6 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -4 | 5 | ChEMBL | 319 | 6 | 2 | 4 | 1.6 | CCOC(=O)N1CCC(NCCNC(=O)c2ccccc2)CC1 | nan | |||
| CHEMBL1609153 | 54430 | None | 6 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -4 | 5 | ChEMBL | 319 | 6 | 2 | 4 | 1.6 | CCOC(=O)N1CCC(NCCNC(=O)c2ccccc2)CC1 | nan | |||
| 42599070 | 16085 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -316 | 5 | ChEMBL | 370 | 4 | 0 | 3 | 4.1 | CCO[C@H]1CC[C@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223804 | 16085 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -316 | 5 | ChEMBL | 370 | 4 | 0 | 3 | 4.1 | CCO[C@H]1CC[C@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 42598359 | 16113 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -100 | 5 | ChEMBL | 436 | 5 | 0 | 7 | 3.4 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(S(C)(=O)=O)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223864 | 16113 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -100 | 5 | ChEMBL | 436 | 5 | 0 | 7 | 3.4 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(S(C)(=O)=O)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 9308 | 17761 | None | 16 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 3 | 9 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1021/jm9705115 | |||
| CHEMBL1255785 | 17761 | None | 16 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 3 | 9 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1021/jm9705115 | |||
| CHEMBL12587 | 17761 | None | 16 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 3 | 9 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1021/jm9705115 | |||
| CHEMBL292911 | 17761 | None | 16 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 3 | 9 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1021/jm9705115 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 156015300 | 177697 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 362 | 4 | 2 | 3 | 4.7 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4640703 | 177697 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 362 | 4 | 2 | 3 | 4.7 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| 10012139 | 13715 | None | 8 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 2 | ChEMBL | 156 | 1 | 1 | 4 | -0.1 | COC(=O)C1CCC(N)=NC1 | 10.1021/jm960467d | |||
| CHEMBL1194965 | 13715 | None | 8 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 2 | ChEMBL | 156 | 1 | 1 | 4 | -0.1 | COC(=O)C1CCC(N)=NC1 | 10.1021/jm960467d | |||
| CHEMBL553602 | 13715 | None | 8 | Mouse | Functional | pEC50 | = | 4.9 | 4.9 | 2 | 2 | ChEMBL | 156 | 1 | 1 | 4 | -0.1 | COC(=O)C1CCC(N)=NC1 | 10.1021/jm960467d | |||
| 10240891 | 208556 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -1 | 3 | ChEMBL | 140 | 1 | 0 | 3 | 0.3 | CO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| CHEMBL85678 | 208556 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -1 | 3 | ChEMBL | 140 | 1 | 0 | 3 | 0.3 | CO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm201348t | |||
| 2551.0 | 794 | None | 13 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm201348t | |||
| 298 | 794 | None | 13 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm201348t | |||
| 488 | 794 | None | 13 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm201348t | |||
| CHEMBL965 | 794 | None | 13 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm201348t | |||
| DB00411 | 794 | None | 13 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm201348t | |||
| 42598360 | 16111 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -630 | 5 | ChEMBL | 388 | 5 | 0 | 6 | 4.0 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(OC)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223862 | 16111 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -630 | 5 | ChEMBL | 388 | 5 | 0 | 6 | 4.0 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(OC)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 9990434 | 106395 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -3 | 3 | ChEMBL | 202 | 2 | 0 | 3 | 0.7 | C#CCC#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| CHEMBL313918 | 106395 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -3 | 3 | ChEMBL | 202 | 2 | 0 | 3 | 0.7 | C#CCC#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| 156021744 | 178219 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 374 | 3 | 1 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4648071 | 178219 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 374 | 3 | 1 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| 92209180 | 13158 | None | 4 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 2 | 2 | ChEMBL | 156 | 2 | 1 | 4 | -0.2 | CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| 9793884 | 13158 | None | 4 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 2 | 2 | ChEMBL | 156 | 2 | 1 | 4 | -0.2 | CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| CHEMBL1190710 | 13158 | None | 4 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 2 | 2 | ChEMBL | 156 | 2 | 1 | 4 | -0.2 | CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| CHEMBL541398 | 13158 | None | 4 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 2 | 2 | ChEMBL | 156 | 2 | 1 | 4 | -0.2 | CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| 124300908 | 13199 | None | 3 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 1 | 2 | ChEMBL | 166 | 2 | 1 | 4 | -0.6 | C#CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| 2606 | 13199 | None | 3 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 1 | 2 | ChEMBL | 166 | 2 | 1 | 4 | -0.6 | C#CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| CHEMBL1191029 | 13199 | None | 3 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 1 | 2 | ChEMBL | 166 | 2 | 1 | 4 | -0.6 | C#CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| CHEMBL542065 | 13199 | None | 3 | Mouse | Functional | pEC50 | = | 4.8 | 4.8 | 1 | 2 | ChEMBL | 166 | 2 | 1 | 4 | -0.6 | C#CCOC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| 2551 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2006.10.040 | |||
| 2551.0 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2006.10.040 | |||
| 298 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2006.10.040 | |||
| 488 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL965 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2006.10.040 | |||
| DB00411 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2006.10.040 | |||
| 156015097 | 177657 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 392 | 3 | 1 | 3 | 4.9 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4640324 | 177657 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 392 | 3 | 1 | 3 | 4.9 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 42598829 | 16087 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -251 | 5 | ChEMBL | 358 | 3 | 0 | 5 | 3.9 | CO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223806 | 16087 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -251 | 5 | ChEMBL | 358 | 3 | 0 | 5 | 3.9 | CO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 42598828 | 16110 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -1584 | 5 | ChEMBL | 390 | 4 | 0 | 5 | 4.4 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4c(F)cc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223861 | 16110 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -1584 | 5 | ChEMBL | 390 | 4 | 0 | 5 | 4.4 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4c(F)cc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 187 | 255 | None | 24 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2015.08.011 | |||
| 187.0 | 255 | None | 24 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2015.08.011 | |||
| 294 | 255 | None | 24 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2015.08.011 | |||
| 65 | 255 | None | 24 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2015.08.011 | |||
| 8593 | 255 | None | 24 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2015.08.011 | |||
| CHEMBL667 | 255 | None | 24 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2015.08.011 | |||
| DB03128 | 255 | None | 24 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2015.08.011 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 71737672 | 2576 | None | 21 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -3 | 6 | ChEMBL | 494 | 6 | 1 | 4 | 4.0 | CCN(C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cn[nH]2)Cc1ccccc1C(F)(F)F | 10.1021/jm500995y | |||
| 8687 | 2576 | None | 21 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -3 | 6 | ChEMBL | 494 | 6 | 1 | 4 | 4.0 | CCN(C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cn[nH]2)Cc1ccccc1C(F)(F)F | 10.1021/jm500995y | |||
| CHEMBL3329755 | 2576 | None | 21 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -3 | 6 | ChEMBL | 494 | 6 | 1 | 4 | 4.0 | CCN(C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cn[nH]2)Cc1ccccc1C(F)(F)F | 10.1021/jm500995y | |||
| 44158142 | 188777 | None | 42 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -1 | 4 | ChEMBL | 339 | 2 | 0 | 2 | 4.1 | O=C1C(=O)N(Cc2ccc(C(F)(F)F)cc2)c2c(Cl)cccc21 | 10.1016/j.bmcl.2009.11.089 | |||
| CHEMBL503735 | 188777 | None | 42 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -1 | 4 | ChEMBL | 339 | 2 | 0 | 2 | 4.1 | O=C1C(=O)N(Cc2ccc(C(F)(F)F)cc2)c2c(Cl)cccc21 | 10.1016/j.bmcl.2009.11.089 | |||
| 44158142 | 188777 | None | 42 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -1 | 4 | ChEMBL | 339 | 2 | 0 | 2 | 4.1 | O=C1C(=O)N(Cc2ccc(C(F)(F)F)cc2)c2c(Cl)cccc21 | 10.1021/jm900286j | |||
| CHEMBL503735 | 188777 | None | 42 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -1 | 4 | ChEMBL | 339 | 2 | 0 | 2 | 4.1 | O=C1C(=O)N(Cc2ccc(C(F)(F)F)cc2)c2c(Cl)cccc21 | 10.1021/jm900286j | |||
| 2551 | 794 | None | 13 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 2551.0 | 794 | None | 13 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 298 | 794 | None | 13 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 488 | 794 | None | 13 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL965 | 794 | None | 13 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| DB00411 | 794 | None | 13 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 16071018 | 16061 | None | 16 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -398 | 5 | ChEMBL | 333 | 2 | 1 | 4 | 2.6 | Cc1cc2c(cc1F)[nH]c(=O)n2C1CCN(C2CCOCC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223753 | 16061 | None | 16 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -398 | 5 | ChEMBL | 333 | 2 | 1 | 4 | 2.6 | Cc1cc2c(cc1F)[nH]c(=O)n2C1CCN(C2CCOCC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 42598357 | 16112 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -794 | 5 | ChEMBL | 383 | 4 | 0 | 6 | 3.8 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C#N)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223863 | 16112 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -794 | 5 | ChEMBL | 383 | 4 | 0 | 6 | 3.8 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C#N)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 16071018 | 16061 | None | 16 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -398 | 5 | ChEMBL | 333 | 2 | 1 | 4 | 2.6 | Cc1cc2c(cc1F)[nH]c(=O)n2C1CCN(C2CCOCC2)CC1 | 10.1021/ml100105x | |||
| CHEMBL1223753 | 16061 | None | 16 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -398 | 5 | ChEMBL | 333 | 2 | 1 | 4 | 2.6 | Cc1cc2c(cc1F)[nH]c(=O)n2C1CCN(C2CCOCC2)CC1 | 10.1021/ml100105x | |||
| 3652 | 4097 | None | 50 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm0606995 | |||
| 57 | 4097 | None | 50 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm0606995 | |||
| 60809 | 4097 | None | 50 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm0606995 | |||
| 60809.0 | 4097 | None | 50 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm0606995 | |||
| CHEMBL21536 | 4097 | None | 50 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm0606995 | |||
| DB15357 | 4097 | None | 50 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -109 | 15 | ChEMBL | 281 | 7 | 0 | 5 | 3.2 | CCCCCCOc1nsnc1C1=CCCN(C1)C | 10.1021/jm0606995 | |||
| 71792 | 78437 | None | 32 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -6 | 5 | ChEMBL | 165 | 2 | 0 | 2 | 0.7 | C#CCO[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2015.08.011 | |||
| CHEMBL2111051 | 78437 | None | 32 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -6 | 5 | ChEMBL | 165 | 2 | 0 | 2 | 0.7 | C#CCO[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2015.08.011 | |||
| 44251554 | 7063 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -1 | 4 | ChEMBL | 317 | 3 | 0 | 4 | 2.8 | Cn1cc(-c2ccc(CN3C(=O)C(=O)c4ccccc43)cc2)cn1 | nan | |||
| CHEMBL1084941 | 7063 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -1 | 4 | ChEMBL | 317 | 3 | 0 | 4 | 2.8 | Cn1cc(-c2ccc(CN3C(=O)C(=O)c4ccccc43)cc2)cn1 | nan | |||
| 44422692 | 11857 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | CC1COCC(C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL1182296 | 11857 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | CC1COCC(C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL228144 | 11857 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | CC1COCC(C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| 14235519 | 16563 | None | 3 | Mouse | Functional | pEC50 | = | 5.6 | 5.6 | 4 | 2 | ChEMBL | 179 | 1 | 0 | 4 | 1.1 | Cc1noc(C2=CCCN(C)C2)n1 | 10.1021/jm960467d | |||
| CHEMBL12378 | 16563 | None | 3 | Mouse | Functional | pEC50 | = | 5.6 | 5.6 | 4 | 2 | ChEMBL | 179 | 1 | 0 | 4 | 1.1 | Cc1noc(C2=CCCN(C)C2)n1 | 10.1021/jm960467d | |||
| 187 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2012.05.048 | |||
| 187.0 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2012.05.048 | |||
| 294 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2012.05.048 | |||
| 65 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2012.05.048 | |||
| 8593 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2012.05.048 | |||
| CHEMBL667 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2012.05.048 | |||
| DB03128 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmcl.2012.05.048 | |||
| 187 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/jm100697g | |||
| 187.0 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/jm100697g | |||
| 294 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/jm100697g | |||
| 65 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/jm100697g | |||
| 8593 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/jm100697g | |||
| CHEMBL667 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/jm100697g | |||
| DB03128 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -1 | 8 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/jm100697g | |||
| 9815331 | 205565 | None | 1 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 3 | 5 | ChEMBL | 169 | 1 | 1 | 3 | 0.8 | CC(=O)OC1CC2CCCC1N2 | 10.1021/jm9705115 | |||
| CHEMBL64000 | 205565 | None | 1 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 3 | 5 | ChEMBL | 169 | 1 | 1 | 3 | 0.8 | CC(=O)OC1CC2CCCC1N2 | 10.1021/jm9705115 | |||
| 9883040 | 100591 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -3 | 3 | ChEMBL | 307 | 8 | 0 | 5 | 3.2 | CCCCCCSc1nccnc1O[C@H]1CN2CCC1C2 | 10.1016/s0960-894x(99)00313-3 | |||
| CHEMBL291339 | 100591 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -3 | 3 | ChEMBL | 307 | 8 | 0 | 5 | 3.2 | CCCCCCSc1nccnc1O[C@H]1CN2CCC1C2 | 10.1016/s0960-894x(99)00313-3 | |||
| CHEMBL542622 | 100591 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -3 | 3 | ChEMBL | 307 | 8 | 0 | 5 | 3.2 | CCCCCCSc1nccnc1O[C@H]1CN2CCC1C2 | 10.1016/s0960-894x(99)00313-3 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.5 | 6.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.5 | 6.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.5 | 6.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.5 | 6.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.5 | 6.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.5 | 6.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 71737672 | 2576 | None | 21 | Rat | Functional | pEC50 | = | 5.5 | 5.5 | -5 | 6 | ChEMBL | 494 | 6 | 1 | 4 | 4.0 | CCN(C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cn[nH]2)Cc1ccccc1C(F)(F)F | 10.1021/jm500995y | |||
| 8687 | 2576 | None | 21 | Rat | Functional | pEC50 | = | 5.5 | 5.5 | -5 | 6 | ChEMBL | 494 | 6 | 1 | 4 | 4.0 | CCN(C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cn[nH]2)Cc1ccccc1C(F)(F)F | 10.1021/jm500995y | |||
| CHEMBL3329755 | 2576 | None | 21 | Rat | Functional | pEC50 | = | 5.5 | 5.5 | -5 | 6 | ChEMBL | 494 | 6 | 1 | 4 | 4.0 | CCN(C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cn[nH]2)Cc1ccccc1C(F)(F)F | 10.1021/jm500995y | |||
| 42599068 | 16086 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -100 | 5 | ChEMBL | 356 | 3 | 0 | 3 | 3.7 | CO[C@H]1CC[C@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223805 | 16086 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -100 | 5 | ChEMBL | 356 | 3 | 0 | 3 | 3.7 | CO[C@H]1CC[C@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 42599071 | 16131 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -1258 | 5 | ChEMBL | 450 | 6 | 0 | 7 | 3.8 | CCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(S(C)(=O)=O)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223939 | 16131 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -1258 | 5 | ChEMBL | 450 | 6 | 0 | 7 | 3.8 | CCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(S(C)(=O)=O)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 319 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 321 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 444031 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 444031.0 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 784 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL1346 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| DB00496 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 42598586 | 16130 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -1 | 4 | ChEMBL | 450 | 6 | 0 | 7 | 3.8 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(S(=O)(=O)CC)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223938 | 16130 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -1 | 4 | ChEMBL | 450 | 6 | 0 | 7 | 3.8 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(S(=O)(=O)CC)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 25207745 | 16133 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -398 | 5 | ChEMBL | 413 | 6 | 0 | 7 | 3.5 | COCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C#N)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223941 | 16133 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -398 | 5 | ChEMBL | 413 | 6 | 0 | 7 | 3.5 | COCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C#N)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 44253016 | 80488 | None | 1 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -316 | 4 | ChEMBL | 299 | 2 | 1 | 3 | 3.3 | O=c1[nH]c2ccccc2n1C1CCN(C2CCCCC2)CC1 | 10.1021/ml100105x | |||
| CHEMBL2146597 | 80488 | None | 1 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -316 | 4 | ChEMBL | 299 | 2 | 1 | 3 | 3.3 | O=c1[nH]c2ccccc2n1C1CCN(C2CCCCC2)CC1 | 10.1021/ml100105x | |||
| 16123945 | 80490 | None | 10 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -794 | 5 | ChEMBL | 315 | 2 | 1 | 4 | 2.5 | Cc1ccc2[nH]c(=O)n(C3CCN(C4CCOCC4)CC3)c2c1 | 10.1021/ml100105x | |||
| CHEMBL2146599 | 80490 | None | 10 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -794 | 5 | ChEMBL | 315 | 2 | 1 | 4 | 2.5 | Cc1ccc2[nH]c(=O)n(C3CCN(C4CCOCC4)CC3)c2c1 | 10.1021/ml100105x | |||
| 156011965 | 177397 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 380 | 4 | 2 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4636528 | 177397 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 380 | 4 | 2 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 24865895 | 96058 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | 6 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | C[C@H]1COC[C@@H](C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL259662 | 96058 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | 6 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | C[C@H]1COC[C@@H](C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL390842 | 96058 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | 6 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | C[C@H]1COC[C@@H](C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 319 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 321 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 444031 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 444031.0 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 784 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL1346 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| DB00496 | 1324 | None | 32 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -22 | 18 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.3 | 6.3 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm9705115 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.3 | 6.3 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm9705115 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.3 | 6.3 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm9705115 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.3 | 6.3 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm9705115 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.3 | 6.3 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm9705115 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 6.3 | 6.3 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm9705115 | |||
| 367 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 5487427 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 5487427.0 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 8592 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL1900528 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL3305968 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4650755 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| DB01409 | 3824 | None | 10 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -3 | 8 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 10197743 | 12950 | None | 5 | Mouse | Functional | pEC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 142 | 1 | 1 | 4 | -0.6 | COC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| 92209179 | 12950 | None | 5 | Mouse | Functional | pEC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 142 | 1 | 1 | 4 | -0.6 | COC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| CHEMBL1189286 | 12950 | None | 5 | Mouse | Functional | pEC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 142 | 1 | 1 | 4 | -0.6 | COC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| CHEMBL538467 | 12950 | None | 5 | Mouse | Functional | pEC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 142 | 1 | 1 | 4 | -0.6 | COC(=O)C1CN=CNC1 | 10.1021/jm960467d | |||
| 2551 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm0606995 | |||
| 2551.0 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm0606995 | |||
| 298 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm0606995 | |||
| 488 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm0606995 | |||
| CHEMBL965 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm0606995 | |||
| DB00411 | 794 | None | 13 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm0606995 | |||
| 44422699 | 11855 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | C[C@@H]1COC[C@H](C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL1182272 | 11855 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | C[C@@H]1COC[C@H](C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL227378 | 11855 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | C[C@@H]1COC[C@H](C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| 44422692 | 11857 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | CC1COCC(C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL1182296 | 11857 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | CC1COCC(C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| CHEMBL228144 | 11857 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -1 | 2 | ChEMBL | 174 | 2 | 0 | 2 | 0.5 | CC1COCC(C[N+](C)(C)C)O1 | 10.1016/j.bmc.2006.10.040 | |||
| 10727260 | 11992 | None | 0 | Mouse | Functional | pEC50 | = | 5.2 | 5.2 | 2 | 2 | ChEMBL | 212 | 3 | 1 | 6 | 0.6 | CSCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL1183133 | 11992 | None | 0 | Mouse | Functional | pEC50 | = | 5.2 | 5.2 | 2 | 2 | ChEMBL | 212 | 3 | 1 | 6 | 0.6 | CSCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| CHEMBL281411 | 11992 | None | 0 | Mouse | Functional | pEC50 | = | 5.2 | 5.2 | 2 | 2 | ChEMBL | 212 | 3 | 1 | 6 | 0.6 | CSCc1noc(C2CN=CNC2)n1 | 10.1021/jm960467d | |||
| 334 | 236 | None | 29 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -144 | 4 | ChEMBL | 348 | 7 | 0 | 3 | 3.8 | CCCCC1CCN(CC1)CCCN1C(=O)COc2c1ccc(c2)F | 10.1016/j.bmcl.2012.03.088 | |||
| 9928284 | 236 | None | 29 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -144 | 4 | ChEMBL | 348 | 7 | 0 | 3 | 3.8 | CCCCC1CCN(CC1)CCCN1C(=O)COc2c1ccc(c2)F | 10.1016/j.bmcl.2012.03.088 | |||
| CHEMBL2022960 | 236 | None | 29 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -144 | 4 | ChEMBL | 348 | 7 | 0 | 3 | 3.8 | CCCCC1CCN(CC1)CCCN1C(=O)COc2c1ccc(c2)F | 10.1016/j.bmcl.2012.03.088 | |||
| 644390 | 40425 | None | 2 | Human | Functional | pEC50 | = | 4.2 | 4.2 | -2 | 4 | ChEMBL | 353 | 6 | 2 | 4 | 2.3 | CCOC(=O)N1CCC(NCCNC(=O)c2ccccc2Cl)CC1 | nan | |||
| CHEMBL1482157 | 40425 | None | 2 | Human | Functional | pEC50 | = | 4.2 | 4.2 | -2 | 4 | ChEMBL | 353 | 6 | 2 | 4 | 2.3 | CCOC(=O)N1CCC(NCCNC(=O)c2ccccc2Cl)CC1 | nan | |||
| 156014812 | 178367 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 389 | 3 | 1 | 2 | 4.9 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1cccc(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4647437 | 178367 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 389 | 3 | 1 | 2 | 4.9 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1cccc(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4650736 | 178367 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 389 | 3 | 1 | 2 | 4.9 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1cccc(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| 156009673 | 178359 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 407 | 3 | 1 | 2 | 5.1 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4633816 | 178359 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 407 | 3 | 1 | 2 | 5.1 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4650683 | 178359 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 407 | 3 | 1 | 2 | 5.1 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| 156015300 | 177697 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 362 | 4 | 2 | 3 | 4.7 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4640703 | 177697 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 362 | 4 | 2 | 3 | 4.7 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| 42598591 | 16084 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -125 | 5 | ChEMBL | 384 | 5 | 0 | 3 | 4.5 | CCCO[C@H]1CC[C@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223803 | 16084 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -125 | 5 | ChEMBL | 384 | 5 | 0 | 3 | 4.5 | CCCO[C@H]1CC[C@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 25230693 | 16132 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -251 | 5 | ChEMBL | 402 | 6 | 0 | 6 | 3.9 | COCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223940 | 16132 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -251 | 5 | ChEMBL | 402 | 6 | 0 | 6 | 3.9 | COCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4ccc(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 3008304 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1021/jm900286j | |||
| 7632 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1021/jm900286j | |||
| CHEMBL523685 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1021/jm900286j | |||
| 147230103 | 180259 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 323 | 1 | 1 | 3 | 4.8 | CN1CC=C(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 | 10.1016/j.bmcl.2021.127911 | |||
| CHEMBL4748915 | 180259 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 323 | 1 | 1 | 3 | 4.8 | CN1CC=C(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 | 10.1016/j.bmcl.2021.127911 | |||
| 3008304 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1016/j.bmcl.2009.11.089 | |||
| 7632 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1016/j.bmcl.2009.11.089 | |||
| CHEMBL523685 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1016/j.bmcl.2009.11.089 | |||
| 3008304 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1016/j.bmcl.2010.08.042 | |||
| 7632 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1016/j.bmcl.2010.08.042 | |||
| CHEMBL523685 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1016/j.bmcl.2010.08.042 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 135409468 | 2035 | None | 50 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -13 | 5 | ChEMBL | 312 | 1 | 2 | 4 | 1.7 | Clc1ccc2c(c1)NC(=c1c(=N2)cccc1)N1CCNCC1 | 10.1016/j.bmcl.2021.127911 | |||
| 333 | 2035 | None | 50 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -13 | 5 | ChEMBL | 312 | 1 | 2 | 4 | 1.7 | Clc1ccc2c(c1)NC(=c1c(=N2)cccc1)N1CCNCC1 | 10.1016/j.bmcl.2021.127911 | |||
| CHEMBL845 | 2035 | None | 50 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -13 | 5 | ChEMBL | 312 | 1 | 2 | 4 | 1.7 | Clc1ccc2c(c1)NC(=c1c(=N2)cccc1)N1CCNCC1 | 10.1016/j.bmcl.2021.127911 | |||
| 647412 | 27327 | None | 5 | Human | Functional | pEC50 | = | 4.1 | 4.1 | -5 | 4 | ChEMBL | 325 | 6 | 2 | 5 | 1.7 | CCOC(=O)N1CCC(NCCNC(=O)c2cccs2)CC1 | nan | |||
| CHEMBL1367424 | 27327 | None | 5 | Human | Functional | pEC50 | = | 4.1 | 4.1 | -5 | 4 | ChEMBL | 325 | 6 | 2 | 5 | 1.7 | CCOC(=O)N1CCC(NCCNC(=O)c2cccs2)CC1 | nan | |||
| 24967746 | 16062 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -199 | 5 | ChEMBL | 403 | 5 | 1 | 4 | 4.5 | CCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)[nH]c4cc(F)c(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223754 | 16062 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -199 | 5 | ChEMBL | 403 | 5 | 1 | 4 | 4.5 | CCCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)[nH]c4cc(F)c(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 42598358 | 16109 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -794 | 5 | ChEMBL | 390 | 4 | 0 | 5 | 4.4 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4cc(F)c(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| CHEMBL1223860 | 16109 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -794 | 5 | ChEMBL | 390 | 4 | 0 | 5 | 4.4 | CCO[C@H]1CC[C@](C)(N2CCC(n3c(=O)oc4cc(F)c(C)cc43)CC2)CC1 | 10.1016/j.bmcl.2010.07.097 | |||
| 10397133 | 107118 | None | 1 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -3 | 3 | ChEMBL | 164 | 2 | 0 | 3 | 0.3 | C#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| CHEMBL315676 | 107118 | None | 1 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -3 | 3 | ChEMBL | 164 | 2 | 0 | 3 | 0.3 | C#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| 10397356 | 120780 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -5 | 3 | ChEMBL | 178 | 2 | 0 | 3 | 0.7 | CC#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| CHEMBL354738 | 120780 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -5 | 3 | ChEMBL | 178 | 2 | 0 | 3 | 0.7 | CC#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| 10130070 | 120394 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 154 | 2 | 0 | 3 | 0.7 | CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| CHEMBL352908 | 120394 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 154 | 2 | 0 | 3 | 0.7 | CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| 156011965 | 177397 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 380 | 4 | 2 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4636528 | 177397 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 380 | 4 | 2 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| 2551 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 2551.0 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 298 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 488 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| CHEMBL965 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| DB00411 | 794 | None | 13 | Rat | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1074/jbc.m704875200 | |||
| 10375322 | 58747 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -1 | 3 | ChEMBL | 192 | 2 | 0 | 3 | 1.1 | CCC#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| CHEMBL168545 | 58747 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -1 | 3 | ChEMBL | 192 | 2 | 0 | 3 | 1.1 | CCC#CCO/N=C1\CN2CCC1C2 | 10.1016/S0960-894X(00)80538-7 | |||
| 2551 | 794 | None | 13 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -93 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960467d | |||
| 2551.0 | 794 | None | 13 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -93 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960467d | |||
| 298 | 794 | None | 13 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -93 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960467d | |||
| 488 | 794 | None | 13 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -93 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960467d | |||
| CHEMBL965 | 794 | None | 13 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -93 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960467d | |||
| DB00411 | 794 | None | 13 | Mouse | Functional | pEC50 | = | 5 | 5.0 | -93 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960467d | |||
| 2551 | 794 | None | 13 | Human | Functional | pED50 | = | 7 | 7.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960683m | |||
| 2551.0 | 794 | None | 13 | Human | Functional | pED50 | = | 7 | 7.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960683m | |||
| 298 | 794 | None | 13 | Human | Functional | pED50 | = | 7 | 7.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960683m | |||
| 488 | 794 | None | 13 | Human | Functional | pED50 | = | 7 | 7.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960683m | |||
| CHEMBL965 | 794 | None | 13 | Human | Functional | pED50 | = | 7 | 7.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960683m | |||
| DB00411 | 794 | None | 13 | Human | Functional | pED50 | = | 7 | 7.0 | -4 | 13 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm960683m | |||
| 5487543 | 208104 | None | 2 | Human | Functional | pED50 | = | 5.4 | 5.4 | -41 | 6 | ChEMBL | 270 | 3 | 0 | 4 | 1.8 | COc1cccc(C#CCO/N=C2\CN3CCC2C3)c1 | 10.1021/jm960683m | |||
| CHEMBL81878 | 208104 | None | 2 | Human | Functional | pED50 | = | 5.4 | 5.4 | -41 | 6 | ChEMBL | 270 | 3 | 0 | 4 | 1.8 | COc1cccc(C#CCO/N=C2\CN3CCC2C3)c1 | 10.1021/jm960683m | |||
| 9795428 | 96541 | None | 4 | Human | Functional | pED50 | = | 6.1 | 6.1 | -20 | 5 | ChEMBL | 270 | 3 | 0 | 4 | 1.8 | COc1cccc(C#CCO/N=C2\CN3CC[C@@H]2C3)c1 | 10.1021/jm960683m | |||
| CHEMBL262455 | 96541 | None | 4 | Human | Functional | pED50 | = | 6.1 | 6.1 | -20 | 5 | ChEMBL | 270 | 3 | 0 | 4 | 1.8 | COc1cccc(C#CCO/N=C2\CN3CC[C@@H]2C3)c1 | 10.1021/jm960683m | |||
| 11442478 | 106534 | None | 0 | Human | Functional | pIC50 | = | 9 | 9.0 | 1 | 3 | ChEMBL | 377 | 4 | 0 | 4 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085073 | 106534 | None | 0 | Human | Functional | pIC50 | = | 9 | 9.0 | 1 | 3 | ChEMBL | 377 | 4 | 0 | 4 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140113 | 106534 | None | 0 | Human | Functional | pIC50 | = | 9 | 9.0 | 1 | 3 | ChEMBL | 377 | 4 | 0 | 4 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL5074216 | 216803 | None | 0 | Rat | Functional | pIC50 | = | 9 | 9.0 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)O[C@@H]3CCN(C)C3)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| CHEMBL5074599 | 216807 | None | 2 | Rat | Functional | pIC50 | = | 9 | 9.0 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)O[C@H]3CN4CCC3CC4)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| CHEMBL5074216 | 216803 | None | 0 | Rat | Functional | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)O[C@@H]3CCN(C)C3)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| CHEMBL5086393 | 217515 | None | 0 | Rat | Functional | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC3CCN(C)CC3)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 44589585 | 189000 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 577 | 10 | 4 | 5 | 4.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(F)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL507375 | 189000 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 577 | 10 | 4 | 5 | 4.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(F)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL555474 | 189000 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 577 | 10 | 4 | 5 | 4.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(F)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL5074599 | 216807 | None | 2 | Rat | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)O[C@H]3CN4CCC3CC4)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 44232700 | 106567 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 364 | 4 | 1 | 1 | 4.9 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3084399 | 106567 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 364 | 4 | 1 | 1 | 4.9 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3140218 | 106567 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 364 | 4 | 1 | 1 | 4.9 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| 11341753 | 187409 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 429 | 8 | 2 | 4 | 4.1 | CCOc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492978 | 187409 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 429 | 8 | 2 | 4 | 4.1 | CCOc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11341940 | 187468 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | CC1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL493328 | 187468 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | CC1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11364721 | 192833 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 427 | 7 | 2 | 4 | 3.9 | CC(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL522020 | 192833 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 427 | 7 | 2 | 4 | 3.9 | CC(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589495 | 186086 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | 10 | 3 | ChEMBL | 560 | 11 | 5 | 7 | 3.8 | CCCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL486982 | 186086 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | 10 | 3 | ChEMBL | 560 | 11 | 5 | 7 | 3.8 | CCCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590173 | 189200 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL510029 | 189200 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL555019 | 189200 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL5076886 | 216955 | None | 0 | Rat | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC3C[C@H]4CC[C@H](C3)N4C)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 71452454 | 83952 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 41 | 2 | ChEMBL | 603 | 9 | 3 | 7 | 3.9 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(Cc3ccc4c(c3)OCO4)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206587 | 83952 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 41 | 2 | ChEMBL | 603 | 9 | 3 | 7 | 3.9 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(Cc3ccc4c(c3)OCO4)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 11552174 | 103556 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 1 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085090 | 103556 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 1 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 11330061 | 187418 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 419 | 6 | 2 | 3 | 4.3 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(Cl)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492997 | 187418 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 419 | 6 | 2 | 3 | 4.3 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(Cl)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589570 | 172860 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | 15 | 2 | ChEMBL | 568 | 10 | 5 | 6 | 3.5 | CC(C)NC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL451040 | 172860 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | 15 | 2 | ChEMBL | 568 | 10 | 5 | 6 | 3.5 | CC(C)NC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44589498 | 172861 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | 3 | 3 | ChEMBL | 572 | 11 | 5 | 7 | 3.8 | O=C(Nc1ccc(C(=O)OCC2CC2)cc1)N[C@@H](Cc1ccc(O)cc1)C(=O)NC1CCN(Cc2ccc(O)cc2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL451043 | 172861 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | 3 | 3 | ChEMBL | 572 | 11 | 5 | 7 | 3.8 | O=C(Nc1ccc(C(=O)OCC2CC2)cc1)N[C@@H](Cc1ccc(O)cc1)C(=O)NC1CCN(Cc2ccc(O)cc2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44573500 | 187826 | None | 0 | Human | Functional | pIC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 419 | 6 | 2 | 3 | 4.3 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccccc1Cl | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495361 | 187826 | None | 0 | Human | Functional | pIC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 419 | 6 | 2 | 3 | 4.3 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccccc1Cl | 10.1016/j.bmcl.2009.01.098 | |||
| 44589575 | 175747 | None | 0 | Human | Functional | pIC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 596 | 9 | 4 | 7 | 2.9 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)N4CCOCC4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL458105 | 175747 | None | 0 | Human | Functional | pIC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 596 | 9 | 4 | 7 | 2.9 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)N4CCOCC4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 145955917 | 162578 | None | 0 | Human | Functional | pIC50 | = | 5 | 5.0 | -29 | 2 | ChEMBL | 418 | 6 | 2 | 4 | 4.2 | NC[C@H]1CC[C@H](CN(C[C@H]2Cc3ccccc3CN2)[C@H]2CCCc3cccnc32)CC1 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4167221 | 162578 | None | 0 | Human | Functional | pIC50 | = | 5 | 5.0 | -29 | 2 | ChEMBL | 418 | 6 | 2 | 4 | 4.2 | NC[C@H]1CC[C@H](CN(C[C@H]2Cc3ccccc3CN2)[C@H]2CCCc3cccnc32)CC1 | 10.1021/acsmedchemlett.7b00406 | |||
| 44233187 | 86059 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -2 | 3 | ChEMBL | 474 | 8 | 1 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(=O)(=O)c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL2306159 | 86059 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -2 | 3 | ChEMBL | 474 | 8 | 1 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(=O)(=O)c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44233187 | 86059 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -2 | 3 | ChEMBL | 474 | 8 | 1 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(=O)(=O)c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL2306159 | 86059 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -2 | 3 | ChEMBL | 474 | 8 | 1 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(=O)(=O)c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 76324336 | 103552 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 370 | 4 | 0 | 4 | 4.8 | Cc1ccsc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085086 | 103552 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 370 | 4 | 0 | 4 | 4.8 | Cc1ccsc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| 76331543 | 103558 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 362 | 4 | 0 | 4 | 4.9 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(CC1CCCCC1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085092 | 103558 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 362 | 4 | 0 | 4 | 4.9 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(CC1CCCCC1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 57758637 | 106555 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 441 | 7 | 0 | 1 | 7.2 | C[N+]1(CCC2CCCCC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084466 | 106555 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 441 | 7 | 0 | 1 | 7.2 | C[N+]1(CCC2CCCCC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140183 | 106555 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 441 | 7 | 0 | 1 | 7.2 | C[N+]1(CCC2CCCCC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 44232702 | 106559 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 372 | 4 | 1 | 1 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(F)c1)c1cccc(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084401 | 106559 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 372 | 4 | 1 | 1 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(F)c1)c1cccc(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140203 | 106559 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 372 | 4 | 1 | 1 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(F)c1)c1cccc(F)c1)C2 | 10.1021/jm900736e | |||
| 11547053 | 106521 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -1 | 3 | ChEMBL | 377 | 4 | 0 | 3 | 5.0 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(CC1CCCCC1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085074 | 106521 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -1 | 3 | ChEMBL | 377 | 4 | 0 | 3 | 5.0 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(CC1CCCCC1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140097 | 106521 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -1 | 3 | ChEMBL | 377 | 4 | 0 | 3 | 5.0 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(CC1CCCCC1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 145958296 | 162376 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -38 | 2 | ChEMBL | 376 | 6 | 2 | 4 | 3.4 | C/C(=C/CN)CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4164075 | 162376 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -38 | 2 | ChEMBL | 376 | 6 | 2 | 4 | 3.4 | C/C(=C/CN)CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| 142416754 | 162436 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | -112 | 2 | ChEMBL | 480 | 8 | 2 | 4 | 5.2 | FC1(F)CCC(NC/C=C\CN(C[C@H]2Cc3ccccc3CN2)[C@H]2CCCc3cccnc32)CC1 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4164874 | 162436 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | -112 | 2 | ChEMBL | 480 | 8 | 2 | 4 | 5.2 | FC1(F)CCC(NC/C=C\CN(C[C@H]2Cc3ccccc3CN2)[C@H]2CCCc3cccnc32)CC1 | 10.1021/acsmedchemlett.7b00406 | |||
| 44232708 | 106542 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 408 | 4 | 1 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084407 | 106542 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 408 | 4 | 1 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140145 | 106542 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 408 | 4 | 1 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1)C2 | 10.1021/jm900736e | |||
| 76320693 | 103548 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | 1 | 3 | ChEMBL | 428 | 4 | 0 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccccc1Br)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085082 | 103548 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | 1 | 3 | ChEMBL | 428 | 4 | 0 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccccc1Br)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 76309756 | 103549 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -1 | 3 | ChEMBL | 375 | 4 | 0 | 4 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccc(C#N)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085083 | 103549 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -1 | 3 | ChEMBL | 375 | 4 | 0 | 4 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccc(C#N)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 44590174 | 170160 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -3 | 3 | ChEMBL | 651 | 10 | 3 | 6 | 4.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Br)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL444300 | 170160 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -3 | 3 | ChEMBL | 651 | 10 | 3 | 6 | 4.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Br)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL466271 | 170160 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -3 | 3 | ChEMBL | 651 | 10 | 3 | 6 | 4.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Br)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590177 | 189030 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -5 | 3 | ChEMBL | 677 | 12 | 3 | 7 | 5.1 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C(=O)c3ccccc3)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL507874 | 189030 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -5 | 3 | ChEMBL | 677 | 12 | 3 | 7 | 5.1 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C(=O)c3ccccc3)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL554918 | 189030 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -5 | 3 | ChEMBL | 677 | 12 | 3 | 7 | 5.1 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C(=O)c3ccccc3)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL5076535 | 216933 | None | 0 | Rat | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCCN(C)C)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 11699452 | 12625 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 456 | 8 | 1 | 2 | 5.8 | Cc1ccc(C(O)(c2ccc(C)cc2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL1187080 | 12625 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 456 | 8 | 1 | 2 | 5.8 | Cc1ccc(C(O)(c2ccc(C)cc2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL489626 | 12625 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 456 | 8 | 1 | 2 | 5.8 | Cc1ccc(C(O)(c2ccc(C)cc2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| 44590179 | 172820 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccccc2Cl)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL450538 | 172820 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccccc2Cl)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL553446 | 172820 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccccc2Cl)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44573621 | 187318 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 477 | 8 | 2 | 4 | 5.5 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(Oc2ccccc2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492391 | 187318 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 477 | 8 | 2 | 4 | 5.5 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(Oc2ccccc2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573263 | 193259 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 459 | 7 | 2 | 6 | 3.4 | COc1ccc(CN2CCNCC2)cc1-c1cccc(CNC(=O)c2ccc3c(c2)OCO3)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL522992 | 193259 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 459 | 7 | 2 | 6 | 3.4 | COc1ccc(CN2CCNCC2)cc1-c1cccc(CNC(=O)c2ccc3c(c2)OCO3)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44590181 | 173668 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -25 | 3 | ChEMBL | 633 | 12 | 3 | 8 | 3.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(OC)c(OC)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL453248 | 173668 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -25 | 3 | ChEMBL | 633 | 12 | 3 | 8 | 3.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(OC)c(OC)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL551113 | 173668 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -25 | 3 | ChEMBL | 633 | 12 | 3 | 8 | 3.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(OC)c(OC)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 162646559 | 179746 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -97 | 4 | ChEMBL | 406 | 5 | 0 | 4 | 4.1 | Cc1cc(F)cnc1N1CCN(C(=O)CCCc2cccc3ncccc23)[C@@H](C)C1 | 10.1021/acsmedchemlett.0c00626 | |||
| CHEMBL4742997 | 179746 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -97 | 4 | ChEMBL | 406 | 5 | 0 | 4 | 4.1 | Cc1cc(F)cnc1N1CCN(C(=O)CCCc2cccc3ncccc23)[C@@H](C)C1 | 10.1021/acsmedchemlett.0c00626 | |||
| 71459724 | 84041 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 63 | 3 | ChEMBL | 621 | 10 | 3 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@@H]([N+](C)(C)Cc3ccc(Cl)cc3)C2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2207177 | 84041 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 63 | 3 | ChEMBL | 621 | 10 | 3 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@@H]([N+](C)(C)Cc3ccc(Cl)cc3)C2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 42626092 | 12639 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccccc1COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187132 | 12639 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccccc1COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL491246 | 12639 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccccc1COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 145956824 | 162355 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | -1412 | 2 | ChEMBL | 376 | 6 | 2 | 4 | 3.1 | NCC1CC1CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4163770 | 162355 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | -1412 | 2 | ChEMBL | 376 | 6 | 2 | 4 | 3.1 | NCC1CC1CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| 44233417 | 86080 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -1 | 3 | ChEMBL | 467 | 8 | 2 | 2 | 5.7 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNC(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL2307674 | 86080 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -1 | 3 | ChEMBL | 467 | 8 | 2 | 2 | 5.7 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNC(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44233417 | 86080 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -1 | 3 | ChEMBL | 467 | 8 | 2 | 2 | 5.7 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNC(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL2307674 | 86080 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -1 | 3 | ChEMBL | 467 | 8 | 2 | 2 | 5.7 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNC(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 76324303 | 103304 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 335 | 5 | 1 | 2 | 4.6 | CN1[C@H]2CC[C@@H]1C[C@H](CCC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084394 | 103304 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 335 | 5 | 1 | 2 | 4.6 | CN1[C@H]2CC[C@@H]1C[C@H](CCC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 76327870 | 103307 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 273 | 4 | 1 | 2 | 3.5 | CCC(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 | 10.1021/jm900736e | |||
| CHEMBL3084397 | 103307 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 273 | 4 | 1 | 2 | 3.5 | CCC(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 | 10.1021/jm900736e | |||
| 76327903 | 103559 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 381 | 4 | 0 | 5 | 4.4 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccc(C#N)cc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085093 | 103559 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 381 | 4 | 0 | 5 | 4.4 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccc(C#N)cc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 76316969 | 106579 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -2 | 3 | ChEMBL | 396 | 4 | 0 | 4 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1cccc(C#N)c1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085075 | 106579 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -2 | 3 | ChEMBL | 396 | 4 | 0 | 4 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1cccc(C#N)c1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140262 | 106579 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -2 | 3 | ChEMBL | 396 | 4 | 0 | 4 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1cccc(C#N)c1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 71455969 | 83964 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 3 | 3 | ChEMBL | 581 | 12 | 4 | 5 | 4.7 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206603 | 83964 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 3 | 3 | ChEMBL | 581 | 12 | 4 | 5 | 4.7 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 1765112 | 103303 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 307 | 3 | 1 | 2 | 3.8 | CN1[C@H]2CC[C@@H]1C[C@H](C(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084393 | 103303 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 307 | 3 | 1 | 2 | 3.8 | CN1[C@H]2CC[C@@H]1C[C@H](C(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 25034111 | 193527 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL526009 | 193527 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| 16040727 | 169546 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -3 | 3 | ChEMBL | 649 | 11 | 3 | 6 | 5.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(-c3ccccc3)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL442672 | 169546 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -3 | 3 | ChEMBL | 649 | 11 | 3 | 6 | 5.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(-c3ccccc3)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL495102 | 169546 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -3 | 3 | ChEMBL | 649 | 11 | 3 | 6 | 5.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(-c3ccccc3)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590124 | 169897 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 39 | 2 | ChEMBL | 598 | 10 | 4 | 6 | 4.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(C(F)(F)F)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL443925 | 169897 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 39 | 2 | ChEMBL | 598 | 10 | 4 | 6 | 4.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(C(F)(F)F)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590172 | 170421 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 591 | 10 | 3 | 6 | 4.0 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL444688 | 170421 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 591 | 10 | 3 | 6 | 4.0 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL527216 | 170421 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 591 | 10 | 3 | 6 | 4.0 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590171 | 178853 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 587 | 10 | 3 | 6 | 4.2 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL468609 | 178853 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 587 | 10 | 3 | 6 | 4.2 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL554632 | 178853 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 587 | 10 | 3 | 6 | 4.2 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590125 | 183967 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 12 | 3 | ChEMBL | 530 | 10 | 4 | 6 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccccc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL480878 | 183967 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 12 | 3 | ChEMBL | 530 | 10 | 4 | 6 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccccc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590170 | 188478 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 588 | 10 | 4 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(N)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL501348 | 188478 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 588 | 10 | 4 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(N)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL553431 | 188478 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 588 | 10 | 4 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(N)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 25034111 | 193527 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL526009 | 193527 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 76309754 | 106577 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -1 | 3 | ChEMBL | 395 | 5 | 0 | 3 | 4.6 | COc1ccc(CN(C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)cc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085062 | 106577 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -1 | 3 | ChEMBL | 395 | 5 | 0 | 3 | 4.6 | COc1ccc(CN(C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)cc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140260 | 106577 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -1 | 3 | ChEMBL | 395 | 5 | 0 | 3 | 4.6 | COc1ccc(CN(C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)cc1 | 10.1016/j.bmcl.2007.09.071 | |||
| 44589571 | 172690 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 10 | 2 | ChEMBL | 580 | 11 | 5 | 6 | 3.5 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)NCC4CC4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL448904 | 172690 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 10 | 2 | ChEMBL | 580 | 11 | 5 | 6 | 3.5 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)NCC4CC4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 71452456 | 83970 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 525 | 10 | 4 | 5 | 3.8 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(C)CCCCCC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206609 | 83970 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 525 | 10 | 4 | 5 | 3.8 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(C)CCCCCC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 25034180 | 188519 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -1 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL502000 | 188519 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -1 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| 44573744 | 187755 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 457 | 7 | 1 | 5 | 4.2 | CCN1CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494996 | 187755 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 457 | 7 | 1 | 5 | 4.2 | CCN1CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589573 | 189013 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 616 | 11 | 5 | 6 | 4.3 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)NCc4ccccc4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL507581 | 189013 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 616 | 11 | 5 | 6 | 4.3 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)NCc4ccccc4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 11510358 | 106540 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 355 | 4 | 0 | 3 | 4.2 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccoc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085069 | 106540 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 355 | 4 | 0 | 3 | 4.2 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccoc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140143 | 106540 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | -1 | 3 | ChEMBL | 355 | 4 | 0 | 3 | 4.2 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccoc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 44232947 | 106525 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 348 | 4 | 1 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccsc1)c1ccsc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084411 | 106525 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 348 | 4 | 1 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccsc1)c1ccsc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140100 | 106525 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 348 | 4 | 1 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccsc1)c1ccsc1)C2 | 10.1021/jm900736e | |||
| 11664153 | 12761 | None | 0 | Human | Functional | pIC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 488 | 10 | 1 | 4 | 5.2 | COc1cccc(C(O)(c2cccc(OC)c2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| CHEMBL1187845 | 12761 | None | 0 | Human | Functional | pIC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 488 | 10 | 1 | 4 | 5.2 | COc1cccc(C(O)(c2cccc(OC)c2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| CHEMBL523767 | 12761 | None | 0 | Human | Functional | pIC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 488 | 10 | 1 | 4 | 5.2 | COc1cccc(C(O)(c2cccc(OC)c2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| 76324304 | 103305 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 322 | 4 | 1 | 3 | 3.6 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccn1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084395 | 103305 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 322 | 4 | 1 | 3 | 3.6 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccn1)C2 | 10.1021/jm900736e | |||
| 15945874 | 188873 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL505452 | 188873 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| 44573578 | 187313 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 443 | 7 | 2 | 5 | 3.5 | COC(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492374 | 187313 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 443 | 7 | 2 | 5 | 3.5 | COC(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11455956 | 187707 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 463 | 7 | 2 | 5 | 3.1 | CS(=O)(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494749 | 187707 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 463 | 7 | 2 | 5 | 3.1 | CS(=O)(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44590033 | 183784 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 12 | 3 | ChEMBL | 560 | 11 | 4 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(OC)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL480299 | 183784 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 12 | 3 | ChEMBL | 560 | 11 | 4 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(OC)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 15945874 | 188873 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL505452 | 188873 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44589984 | 190667 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(O)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL518001 | 190667 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(O)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 1201549 | 597 | None | 17 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -4 | 26 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1021/acsmedchemlett.0c00626 | |||
| 1201549.0 | 597 | None | 17 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -4 | 26 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1021/acsmedchemlett.0c00626 | |||
| 333 | 597 | None | 17 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -4 | 26 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1021/acsmedchemlett.0c00626 | |||
| 7601 | 597 | None | 17 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -4 | 26 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1021/acsmedchemlett.0c00626 | |||
| CHEMBL1201203 | 597 | None | 17 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -4 | 26 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1021/acsmedchemlett.0c00626 | |||
| CHEMBL438151 | 597 | None | 17 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -4 | 26 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1021/acsmedchemlett.0c00626 | |||
| DB00245 | 597 | None | 17 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -4 | 26 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | 10.1021/acsmedchemlett.0c00626 | |||
| CHEMBL5076445 | 216929 | None | 0 | Rat | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@H]3CCN3C)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| CHEMBL5078006 | 217016 | None | 0 | Rat | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@H]3CN4CCC3CC4)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| CHEMBL5086393 | 217515 | None | 0 | Rat | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC3CCN(C)CC3)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 44232953 | 103446 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -1 | 3 | ChEMBL | 405 | 7 | 2 | 2 | 4.6 | CCNC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1021/jm900736e | |||
| CHEMBL3084663 | 103446 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -1 | 3 | ChEMBL | 405 | 7 | 2 | 2 | 4.6 | CCNC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1021/jm900736e | |||
| 44232953 | 103446 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -1 | 3 | ChEMBL | 405 | 7 | 2 | 2 | 4.6 | CCNC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084663 | 103446 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -1 | 3 | ChEMBL | 405 | 7 | 2 | 2 | 4.6 | CCNC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2009.07.006 | |||
| 71459689 | 83950 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -1 | 3 | ChEMBL | 595 | 13 | 4 | 5 | 5.1 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206585 | 83950 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -1 | 3 | ChEMBL | 595 | 13 | 4 | 5 | 5.1 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 44573264 | 187308 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1cccc(-c2ccc(F)c(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492359 | 187308 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1cccc(-c2ccc(F)c(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573619 | 187708 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 442 | 7 | 3 | 4 | 3.6 | CC(=O)Nc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494752 | 187708 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 442 | 7 | 3 | 4 | 3.6 | CC(=O)Nc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11714747 | 187739 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 428 | 7 | 2 | 4 | 3.8 | CN(C)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494950 | 187739 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 428 | 7 | 2 | 4 | 3.8 | CN(C)c1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11578568 | 187740 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 400 | 6 | 3 | 4 | 3.3 | Nc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494951 | 187740 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 400 | 6 | 3 | 4 | 3.3 | Nc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573661 | 188488 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 401 | 6 | 3 | 4 | 3.4 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(O)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL501486 | 188488 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 401 | 6 | 3 | 4 | 3.4 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(O)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 25034112 | 188500 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | -1 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL501727 | 188500 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | -1 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| 11690968 | 106557 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085072 | 106557 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140185 | 106557 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 11518068 | 106562 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | 1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccs1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085059 | 106562 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | 1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccs1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140213 | 106562 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | 1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccs1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 11583262 | 106553 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | -1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085060 | 106553 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | -1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140181 | 106553 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | -1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 69444105 | 103542 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccs1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085077 | 103542 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccs1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 44233675 | 103433 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -1 | 3 | ChEMBL | 381 | 5 | 0 | 1 | 6.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084639 | 103433 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -1 | 3 | ChEMBL | 381 | 5 | 0 | 1 | 6.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44233675 | 103433 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -1 | 3 | ChEMBL | 381 | 5 | 0 | 1 | 6.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084639 | 103433 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -1 | 3 | ChEMBL | 381 | 5 | 0 | 1 | 6.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(c1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 11712408 | 106578 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -1 | 3 | ChEMBL | 385 | 4 | 0 | 3 | 5.0 | Cc1ccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)s1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085067 | 106578 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -1 | 3 | ChEMBL | 385 | 4 | 0 | 3 | 5.0 | Cc1ccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)s1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140261 | 106578 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -1 | 3 | ChEMBL | 385 | 4 | 0 | 3 | 5.0 | Cc1ccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)s1 | 10.1016/j.bmcl.2007.09.071 | |||
| 76327901 | 103550 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -1 | 3 | ChEMBL | 380 | 5 | 0 | 4 | 4.5 | COc1cccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)N3C)c2ccccc2)c1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085084 | 103550 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -1 | 3 | ChEMBL | 380 | 5 | 0 | 4 | 4.5 | COc1cccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)N3C)c2ccccc2)c1 | 10.1016/j.bmcl.2007.09.071 | |||
| 11508710 | 103555 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1cccs1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085089 | 103555 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1cccs1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 42626088 | 12628 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | - | 1 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3Br)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187091 | 12628 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | - | 1 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3Br)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL490236 | 12628 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | - | 1 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3Br)(CC1)CC2 | 10.1021/jm801601v | |||
| 71450615 | 83965 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | 1 | 3 | ChEMBL | 609 | 14 | 4 | 5 | 5.5 | CC[N+](CC)(CCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(C(=O)OC(C)C)cc1)Cc1ccc(Cl)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206604 | 83965 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | 1 | 3 | ChEMBL | 609 | 14 | 4 | 5 | 5.5 | CC[N+](CC)(CCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(C(=O)OC(C)C)cc1)Cc1ccc(Cl)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 44232951 | 106526 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 378 | 4 | 1 | 1 | 5.3 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CCC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3084416 | 106526 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 378 | 4 | 1 | 1 | 5.3 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CCC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3140101 | 106526 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 378 | 4 | 1 | 1 | 5.3 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CCC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| 10092649 | 193182 | None | 43 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -29 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| CHEMBL522460 | 193182 | None | 43 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -29 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| 145954567 | 162601 | None | 0 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -100 | 2 | ChEMBL | 416 | 6 | 2 | 4 | 4.3 | NCC1=C(CN(C[C@H]2Cc3ccccc3CN2)[C@H]2CCCc3cccnc32)CCCC1 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4167521 | 162601 | None | 0 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -100 | 2 | ChEMBL | 416 | 6 | 2 | 4 | 4.3 | NCC1=C(CN(C[C@H]2Cc3ccccc3CN2)[C@H]2CCCc3cccnc32)CCCC1 | 10.1021/acsmedchemlett.7b00406 | |||
| 76324335 | 103547 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -1 | 3 | ChEMBL | 428 | 4 | 0 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1cccc(Br)c1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085081 | 103547 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -1 | 3 | ChEMBL | 428 | 4 | 0 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1cccc(Br)c1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 10092649 | 193182 | None | 43 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -29 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| CHEMBL522460 | 193182 | None | 43 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -29 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| 71450617 | 83971 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 527 | 12 | 4 | 5 | 4.1 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C(C)C)C(C)C)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206610 | 83971 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 527 | 12 | 4 | 5 | 4.1 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C(C)C)C(C)C)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 44455159 | 97818 | None | 0 | Rat | Functional | pIC50 | = | 4.6 | 4.6 | -20 | 5 | ChEMBL | 383 | 5 | 1 | 3 | 4.2 | CCN1CCN(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3)cc2Cl)CC1 | 10.1016/j.bmcl.2007.12.051 | |||
| CHEMBL271704 | 97818 | None | 0 | Rat | Functional | pIC50 | = | 4.6 | 4.6 | -20 | 5 | ChEMBL | 383 | 5 | 1 | 3 | 4.2 | CCN1CCN(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3)cc2Cl)CC1 | 10.1016/j.bmcl.2007.12.051 | |||
| 44234432 | 106541 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 404 | 4 | 1 | 1 | 5.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(Cl)c1)c1cccc(Cl)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084402 | 106541 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 404 | 4 | 1 | 1 | 5.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(Cl)c1)c1cccc(Cl)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140144 | 106541 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 404 | 4 | 1 | 1 | 5.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(Cl)c1)c1cccc(Cl)c1)C2 | 10.1021/jm900736e | |||
| 44590180 | 172749 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | -1 | 3 | ChEMBL | 641 | 10 | 3 | 6 | 5.2 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Cl)c(Cl)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL449640 | 172749 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | -1 | 3 | ChEMBL | 641 | 10 | 3 | 6 | 5.2 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Cl)c(Cl)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540398 | 172749 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | -1 | 3 | ChEMBL | 641 | 10 | 3 | 6 | 5.2 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(Cl)c(Cl)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590167 | 179130 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 494 | 10 | 4 | 6 | 2.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(CC3CC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL471214 | 179130 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 494 | 10 | 4 | 6 | 2.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(CC3CC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590182 | 183257 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 12 | 3 | ChEMBL | 532 | 9 | 5 | 7 | 3.0 | COC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL479526 | 183257 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 12 | 3 | ChEMBL | 532 | 9 | 5 | 7 | 3.0 | COC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590034 | 190086 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 12 | 3 | ChEMBL | 560 | 11 | 4 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(OC)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL517087 | 190086 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 12 | 3 | ChEMBL | 560 | 11 | 4 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(OC)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44573370 | 187554 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1cc(-c2cccc(CN3CCNCC3)c2)ccc1F)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL493939 | 187554 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1cc(-c2cccc(CN3CCNCC3)c2)ccc1F)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573662 | 187633 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 399 | 6 | 2 | 3 | 4.0 | Cc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494410 | 187633 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 399 | 6 | 2 | 3 | 4.0 | Cc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573420 | 187715 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 465 | 7 | 2 | 6 | 3.0 | O=S(=O)(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494778 | 187715 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 465 | 7 | 2 | 6 | 3.0 | O=S(=O)(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589497 | 175397 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 5 | 2 | ChEMBL | 574 | 11 | 5 | 7 | 4.0 | CC(C)COC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL457302 | 175397 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 5 | 2 | ChEMBL | 574 | 11 | 5 | 7 | 4.0 | CC(C)COC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 11285415 | 187307 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 458 | 6 | 1 | 4 | 3.9 | C[N+]1(C)CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492358 | 187307 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 458 | 6 | 1 | 4 | 3.9 | C[N+]1(C)CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL538863 | 187307 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 458 | 6 | 1 | 4 | 3.9 | C[N+]1(C)CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573372 | 193399 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1F)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL524031 | 193399 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1F)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589499 | 191950 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 540 | 9 | 5 | 6 | 2.7 | CNC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL519893 | 191950 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 540 | 9 | 5 | 6 | 2.7 | CNC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 11442669 | 74305 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2023761 | 74305 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 76320694 | 103551 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 1 | 3 | ChEMBL | 370 | 4 | 0 | 4 | 4.8 | Cc1ccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)N3C)c2ccccc2)s1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085085 | 103551 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 1 | 3 | ChEMBL | 370 | 4 | 0 | 4 | 4.8 | Cc1ccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)N3C)c2ccccc2)s1 | 10.1016/j.bmcl.2007.09.071 | |||
| 11617374 | 103543 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 2 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085078 | 103543 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 2 | 3 | ChEMBL | 356 | 4 | 0 | 4 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccsc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 71455965 | 83954 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 621 | 10 | 3 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](Cc3ccc(Cl)cc3)(C(C)C)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206589 | 83954 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 621 | 10 | 3 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](Cc3ccc(Cl)cc3)(C(C)C)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 44234194 | 103451 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -1 | 3 | ChEMBL | 412 | 7 | 1 | 3 | 3.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(C)(=O)=O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084670 | 103451 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -1 | 3 | ChEMBL | 412 | 7 | 1 | 3 | 3.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(C)(=O)=O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44234194 | 103451 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -1 | 3 | ChEMBL | 412 | 7 | 1 | 3 | 3.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(C)(=O)=O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084670 | 103451 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -1 | 3 | ChEMBL | 412 | 7 | 1 | 3 | 3.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNS(C)(=O)=O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 9044803 | 124172 | None | 12 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -1 | 2 | ChEMBL | 391 | 6 | 1 | 4 | 2.8 | CN(CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12)CC(=O)N1CCOCC1 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633650 | 124172 | None | 12 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -1 | 2 | ChEMBL | 391 | 6 | 1 | 4 | 2.8 | CN(CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12)CC(=O)N1CCOCC1 | 10.1021/acs.jmedchem.5b01254 | |||
| 9044803 | 124172 | None | 12 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -1 | 2 | ChEMBL | 391 | 6 | 1 | 4 | 2.8 | CN(CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12)CC(=O)N1CCOCC1 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633650 | 124172 | None | 12 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -1 | 2 | ChEMBL | 391 | 6 | 1 | 4 | 2.8 | CN(CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12)CC(=O)N1CCOCC1 | 10.1021/acs.jmedchem.5b01254 | |||
| 44233419 | 103454 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1 | 3 | ChEMBL | 376 | 6 | 1 | 2 | 4.4 | CC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1021/jm900736e | |||
| CHEMBL3084674 | 103454 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1 | 3 | ChEMBL | 376 | 6 | 1 | 2 | 4.4 | CC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1021/jm900736e | |||
| 44233419 | 103454 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1 | 3 | ChEMBL | 376 | 6 | 1 | 2 | 4.4 | CC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084674 | 103454 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1 | 3 | ChEMBL | 376 | 6 | 1 | 2 | 4.4 | CC(=O)NCC(C[C@@H]1C[C@@H]2CC[C@H](C1)N2C)(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2009.07.006 | |||
| 44232710 | 106550 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 408 | 4 | 1 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccc(F)c(F)c1)c1ccc(F)c(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084408 | 106550 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 408 | 4 | 1 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccc(F)c(F)c1)c1ccc(F)c(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140173 | 106550 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 408 | 4 | 1 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccc(F)c(F)c1)c1ccc(F)c(F)c1)C2 | 10.1021/jm900736e | |||
| 11503336 | 106570 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | -1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1cccs1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085071 | 106570 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | -1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1cccs1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140242 | 106570 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | -1 | 3 | ChEMBL | 371 | 4 | 0 | 3 | 4.7 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1cccs1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL5078006 | 217016 | None | 0 | Rat | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@H]3CN4CCC3CC4)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 11557048 | 187759 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 497 | 8 | 2 | 5 | 3.4 | CN1CCN(Cc2cccc(C(=O)NCc3cccc(-c4cccc(CN5CCNCC5)c4)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495028 | 187759 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 497 | 8 | 2 | 5 | 3.4 | CN1CCN(Cc2cccc(C(=O)NCc3cccc(-c4cccc(CN5CCNCC5)c4)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11633399 | 12623 | None | 0 | Human | Functional | pIC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 352 | 6 | 1 | 2 | 3.6 | COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187077 | 12623 | None | 0 | Human | Functional | pIC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 352 | 6 | 1 | 2 | 3.6 | COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL489225 | 12623 | None | 0 | Human | Functional | pIC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 352 | 6 | 1 | 2 | 3.6 | COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 11318734 | 187436 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 5 | 2 | ChEMBL | 429 | 6 | 2 | 5 | 3.4 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL493079 | 187436 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 5 | 2 | ChEMBL | 429 | 6 | 2 | 5 | 3.4 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 11273131 | 193238 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 459 | 7 | 2 | 6 | 3.4 | COc1ccc(CNC(=O)c2ccc3c(c2)OCO3)cc1-c1cccc(CN2CCNCC2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL522838 | 193238 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 459 | 7 | 2 | 6 | 3.4 | COc1ccc(CNC(=O)c2ccc3c(c2)OCO3)cc1-c1cccc(CN2CCNCC2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44590036 | 188484 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 6 | 3 | ChEMBL | 574 | 10 | 4 | 8 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL501419 | 188484 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 6 | 3 | ChEMBL | 574 | 10 | 4 | 8 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590176 | 189174 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -3 | 3 | ChEMBL | 641 | 10 | 3 | 6 | 4.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C(F)(F)F)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL509614 | 189174 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -3 | 3 | ChEMBL | 641 | 10 | 3 | 6 | 4.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C(F)(F)F)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL555707 | 189174 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -3 | 3 | ChEMBL | 641 | 10 | 3 | 6 | 4.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C(F)(F)F)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 24882532 | 95170 | None | 0 | Rat | Functional | pIC50 | = | 5.5 | 5.5 | -7 | 4 | ChEMBL | 363 | 6 | 1 | 3 | 4.4 | CCN1CCN(c2ccc(NC(=O)CCC3CCCC3)cc2Cl)CC1 | 10.1016/j.bmcl.2007.12.051 | |||
| CHEMBL255523 | 95170 | None | 0 | Rat | Functional | pIC50 | = | 5.5 | 5.5 | -7 | 4 | ChEMBL | 363 | 6 | 1 | 3 | 4.4 | CCN1CCN(c2ccc(NC(=O)CCC3CCCC3)cc2Cl)CC1 | 10.1016/j.bmcl.2007.12.051 | |||
| 44573265 | 187371 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 459 | 7 | 2 | 6 | 3.4 | COc1ccc(-c2cccc(CNC(=O)c3ccc4c(c3)OCO4)c2)cc1CN1CCNCC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492756 | 187371 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 459 | 7 | 2 | 6 | 3.4 | COc1ccc(-c2cccc(CNC(=O)c3ccc4c(c3)OCO4)c2)cc1CN1CCNCC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573501 | 187419 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 419 | 6 | 2 | 3 | 4.3 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492998 | 187419 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 419 | 6 | 2 | 3 | 4.3 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573663 | 187634 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 413 | 7 | 2 | 3 | 4.3 | CCc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494411 | 187634 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 413 | 7 | 2 | 3 | 4.3 | CCc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11421571 | 187723 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | O=C(NCc1cccc(-c2cccc(CN3CCCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494836 | 187723 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | O=C(NCc1cccc(-c2cccc(CN3CCCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573423 | 187758 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 410 | 6 | 2 | 4 | 3.6 | N#Cc1ccccc1C(=O)NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495025 | 187758 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 410 | 6 | 2 | 4 | 3.6 | N#Cc1ccccc1C(=O)NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589529 | 186626 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 554 | 10 | 5 | 6 | 3.1 | CCNC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL487764 | 186626 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 554 | 10 | 5 | 6 | 3.1 | CCNC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 25034110 | 188874 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 1 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL505453 | 188874 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 1 | 3 | ChEMBL | 546 | 10 | 5 | 7 | 3.4 | CCOC(=O)c1ccc(NC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1021/jm800634k | |||
| 11584660 | 93321 | None | 8 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -19 | 5 | ChEMBL | 537 | 7 | 0 | 8 | 5.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc(-c6cc(C)nn6C)cc5CC4)n3C)cccc2n1 | 10.1021/jm0705612 | |||
| CHEMBL244946 | 93321 | None | 8 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -19 | 5 | ChEMBL | 537 | 7 | 0 | 8 | 5.6 | Cc1ccc2c(-c3nnc(SCCCN4CCc5ccc(-c6cc(C)nn6C)cc5CC4)n3C)cccc2n1 | 10.1021/jm0705612 | |||
| 44573371 | 187593 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.7 | Cc1ccc(-c2cccc(CN3CCNCC3)c2)cc1CNC(=O)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494131 | 187593 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.7 | Cc1ccc(-c2cccc(CN3CCNCC3)c2)cc1CNC(=O)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 57758634 | 106519 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 421 | 6 | 0 | 1 | 6.5 | C[N+]1(Cc2ccccc2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084465 | 106519 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 421 | 6 | 0 | 1 | 6.5 | C[N+]1(Cc2ccccc2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140095 | 106519 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 421 | 6 | 0 | 1 | 6.5 | C[N+]1(Cc2ccccc2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11431874 | 74307 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 413 | 9 | 0 | 1 | 6.6 | C=CCCCC[N+]1(C)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2023763 | 74307 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 413 | 9 | 0 | 1 | 6.6 | C=CCCCC[N+]1(C)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 145958111 | 162109 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -3 | 2 | ChEMBL | 376 | 6 | 2 | 4 | 3.4 | C/C(=C/CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21)CN | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4159607 | 162109 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -3 | 2 | ChEMBL | 376 | 6 | 2 | 4 | 3.4 | C/C(=C/CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21)CN | 10.1021/acsmedchemlett.7b00406 | |||
| 71463136 | 83969 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 621 | 12 | 4 | 5 | 5.7 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCCC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206608 | 83969 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 621 | 12 | 4 | 5 | 5.7 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCCC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 76320690 | 106516 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccc(Br)c1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085063 | 106516 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccc(Br)c1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140092 | 106516 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1cccc(Br)c1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 6908726 | 109021 | None | 3 | Rat | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 274 | 3 | 1 | 5 | 2.2 | O=C(N/N=C/c1ccsc1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2018.07.015 | |||
| CHEMBL3211778 | 109021 | None | 3 | Rat | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 274 | 3 | 1 | 5 | 2.2 | O=C(N/N=C/c1ccsc1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2018.07.015 | |||
| 42626096 | 12749 | None | 0 | Human | Functional | pIC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 488 | 10 | 1 | 4 | 5.2 | COc1ccc(C(O)(c2ccc(OC)cc2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL1187802 | 12749 | None | 0 | Human | Functional | pIC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 488 | 10 | 1 | 4 | 5.2 | COc1ccc(C(O)(c2ccc(OC)cc2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL521921 | 12749 | None | 0 | Human | Functional | pIC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 488 | 10 | 1 | 4 | 5.2 | COc1ccc(C(O)(c2ccc(OC)cc2)C23CC[N+](CCOCc4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| 137647734 | 157938 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 5 | ChEMBL | 448 | 4 | 0 | 5 | 4.7 | O=C(C1CCN(c2cc(Oc3ccc(Cl)cc3)ncn2)CC1)N1CCc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| CHEMBL4083681 | 157938 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 5 | ChEMBL | 448 | 4 | 0 | 5 | 4.7 | O=C(C1CCN(c2cc(Oc3ccc(Cl)cc3)ncn2)CC1)N1CCc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| 44234683 | 106560 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 400 | 4 | 1 | 1 | 5.2 | Cc1ccc(F)cc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1cc(F)ccc1C | 10.1021/jm900736e | |||
| CHEMBL3084406 | 106560 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 400 | 4 | 1 | 1 | 5.2 | Cc1ccc(F)cc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1cc(F)ccc1C | 10.1021/jm900736e | |||
| CHEMBL3140205 | 106560 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 400 | 4 | 1 | 1 | 5.2 | Cc1ccc(F)cc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1cc(F)ccc1C | 10.1021/jm900736e | |||
| 46830361 | 7893 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -10 | 3 | ChEMBL | 433 | 4 | 1 | 3 | 4.4 | CCN1CCN(c2ccc(NC(=O)c3c(F)c(F)c(F)c(F)c3F)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| CHEMBL1090094 | 7893 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -10 | 3 | ChEMBL | 433 | 4 | 1 | 3 | 4.4 | CCN1CCN(c2ccc(NC(=O)c3c(F)c(F)c(F)c(F)c3F)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| 137637944 | 155905 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -3 | 5 | ChEMBL | 450 | 4 | 0 | 5 | 4.3 | O=C(C1CCN(c2cc(Oc3ccc(F)cc3F)ncn2)CC1)N1CCc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| CHEMBL4059829 | 155905 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -3 | 5 | ChEMBL | 450 | 4 | 0 | 5 | 4.3 | O=C(C1CCN(c2cc(Oc3ccc(F)cc3F)ncn2)CC1)N1CCc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| 11364984 | 187367 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 444 | 6 | 2 | 6 | 3.2 | C[C@H]1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)n2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492701 | 187367 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 444 | 6 | 2 | 6 | 3.2 | C[C@H]1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)n2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44590169 | 188350 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -7 | 3 | ChEMBL | 603 | 11 | 3 | 7 | 3.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(OC)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL499565 | 188350 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -7 | 3 | ChEMBL | 603 | 11 | 3 | 7 | 3.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(OC)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL539885 | 188350 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -7 | 3 | ChEMBL | 603 | 11 | 3 | 7 | 3.9 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(OC)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 11606547 | 12604 | None | 0 | Human | Functional | pIC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 484 | 8 | 1 | 2 | 6.4 | CC(C)(C)c1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL1186941 | 12604 | None | 0 | Human | Functional | pIC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 484 | 8 | 1 | 2 | 6.4 | CC(C)(C)c1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL483253 | 12604 | None | 0 | Human | Functional | pIC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 484 | 8 | 1 | 2 | 6.4 | CC(C)(C)c1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| 71463134 | 83958 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | 2 | 2 | ChEMBL | 618 | 11 | 3 | 6 | 4.7 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206594 | 83958 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | 2 | 2 | ChEMBL | 618 | 11 | 3 | 6 | 4.7 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 44589574 | 172791 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 582 | 11 | 4 | 6 | 3.9 | CCN(CC)C(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL450093 | 172791 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 582 | 11 | 4 | 6 | 3.9 | CCN(CC)C(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44573543 | 187595 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 453 | 6 | 2 | 3 | 4.7 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccccc1C(F)(F)F | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494151 | 187595 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 453 | 6 | 2 | 3 | 4.7 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccccc1C(F)(F)F | 10.1016/j.bmcl.2009.01.098 | |||
| 11399125 | 193262 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 471 | 6 | 1 | 5 | 3.7 | CC(=O)N1CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL523012 | 193262 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 471 | 6 | 1 | 5 | 3.7 | CC(=O)N1CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11619198 | 106547 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -1 | 3 | ChEMBL | 365 | 4 | 0 | 2 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085058 | 106547 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -1 | 3 | ChEMBL | 365 | 4 | 0 | 2 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140170 | 106547 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -1 | 3 | ChEMBL | 365 | 4 | 0 | 2 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 137655063 | 159065 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -3 | 5 | ChEMBL | 432 | 4 | 0 | 5 | 4.2 | O=C(C1CCN(c2cc(Oc3ccccc3F)ncn2)CC1)N1CCc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| CHEMBL4096143 | 159065 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -3 | 5 | ChEMBL | 432 | 4 | 0 | 5 | 4.2 | O=C(C1CCN(c2cc(Oc3ccccc3F)ncn2)CC1)N1CCc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| 76313454 | 106563 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | 1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1Br)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085064 | 106563 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | 1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1Br)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140214 | 106563 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | 1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1Br)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 122195453 | 124177 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -2 | 2 | ChEMBL | 431 | 5 | 1 | 4 | 3.6 | O=C(CN1CCCC(C(=O)N2CCOCC2)C1)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633663 | 124177 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -2 | 2 | ChEMBL | 431 | 5 | 1 | 4 | 3.6 | O=C(CN1CCCC(C(=O)N2CCOCC2)C1)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| 71450662 | 84040 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -1 | 3 | ChEMBL | 611 | 13 | 4 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc3ccccc3c2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2207176 | 84040 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -1 | 3 | ChEMBL | 611 | 13 | 4 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc3ccccc3c2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 122195446 | 124176 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1 | 5 | ChEMBL | 421 | 7 | 1 | 5 | 2.8 | COc1ccc(-c2[nH]c3ccccc3c2C(=O)CN(C)CC(=O)N2CCOCC2)cc1 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633656 | 124176 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1 | 5 | ChEMBL | 421 | 7 | 1 | 5 | 2.8 | COc1ccc(-c2[nH]c3ccccc3c2C(=O)CN(C)CC(=O)N2CCOCC2)cc1 | 10.1021/acs.jmedchem.5b01254 | |||
| 76324334 | 106533 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | 369 | 4 | 0 | 3 | 4.5 | Cc1ccoc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085070 | 106533 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | 369 | 4 | 0 | 3 | 4.5 | Cc1ccoc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140112 | 106533 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | 369 | 4 | 0 | 3 | 4.5 | Cc1ccoc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| 46830362 | 7896 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -8 | 5 | ChEMBL | 479 | 4 | 1 | 3 | 5.8 | CCN1CCN(c2ccc(NC(=O)c3cc(C(F)(F)F)ccc3C(F)(F)F)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| CHEMBL1090097 | 7896 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -8 | 5 | ChEMBL | 479 | 4 | 1 | 3 | 5.8 | CCN1CCN(c2ccc(NC(=O)c3cc(C(F)(F)F)ccc3C(F)(F)F)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| 76327902 | 103554 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -1 | 3 | ChEMBL | 354 | 4 | 0 | 4 | 4.4 | Cc1ccoc1CN(C(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085088 | 103554 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -1 | 3 | ChEMBL | 354 | 4 | 0 | 4 | 4.4 | Cc1ccoc1CN(C(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| 46883796 | 7895 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1 | 4 | ChEMBL | 411 | 4 | 1 | 3 | 4.8 | CCN1CCN(c2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| CHEMBL1090096 | 7895 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1 | 4 | ChEMBL | 411 | 4 | 1 | 3 | 4.8 | CCN1CCN(c2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| 71463135 | 83968 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 2 | 3 | ChEMBL | 607 | 12 | 4 | 5 | 5.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206607 | 83968 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 2 | 3 | ChEMBL | 607 | 12 | 4 | 5 | 5.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 71455968 | 83960 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 621 | 10 | 3 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@H]([N+](C)(C)Cc3ccc(Cl)cc3)C2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206599 | 83960 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 621 | 10 | 3 | 5 | 5.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@H]([N+](C)(C)Cc3ccc(Cl)cc3)C2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 11168935 | 187469 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | C[C@H]1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL493329 | 187469 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | C[C@H]1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589496 | 186087 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 15 | 3 | ChEMBL | 560 | 10 | 5 | 7 | 3.8 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL486983 | 186087 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 15 | 3 | ChEMBL | 560 | 10 | 5 | 7 | 3.8 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL5076445 | 216929 | None | 0 | Rat | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@H]3CCN3C)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| CHEMBL5081816 | 217258 | None | 0 | Rat | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCC3CCN(C)CC3)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 11215075 | 187443 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | C[C@@H]1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL493131 | 187443 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 443 | 6 | 2 | 5 | 3.8 | C[C@@H]1CN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11410490 | 187705 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 453 | 6 | 2 | 3 | 4.7 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494741 | 187705 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 453 | 6 | 2 | 3 | 4.7 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11249473 | 187788 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 410 | 6 | 2 | 4 | 3.6 | N#Cc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495172 | 187788 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 410 | 6 | 2 | 4 | 3.6 | N#Cc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44590175 | 188739 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -3 | 3 | ChEMBL | 598 | 10 | 3 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C#N)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL503025 | 188739 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -3 | 3 | ChEMBL | 598 | 10 | 3 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C#N)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL553433 | 188739 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -3 | 3 | ChEMBL | 598 | 10 | 3 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(C#N)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590035 | 191863 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 560 | 11 | 4 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccccc3OC)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL519760 | 191863 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 560 | 11 | 4 | 7 | 3.7 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccccc3OC)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 152278786 | 182858 | None | 1 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -30 | 4 | ChEMBL | 467 | 5 | 0 | 8 | 2.6 | N#Cc1ccc(N2C3CCC2CN(C(=O)CCS(=O)(=O)c2cccc4ncsc24)C3)nc1 | 10.1021/acsmedchemlett.0c00626 | |||
| CHEMBL4790083 | 182858 | None | 1 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -30 | 4 | ChEMBL | 467 | 5 | 0 | 8 | 2.6 | N#Cc1ccc(N2C3CCC2CN(C(=O)CCS(=O)(=O)c2cccc4ncsc24)C3)nc1 | 10.1021/acsmedchemlett.0c00626 | |||
| 71452455 | 83953 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 565 | 9 | 3 | 5 | 4.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(CC3CCCCC3)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206588 | 83953 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 565 | 9 | 3 | 5 | 4.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(CC3CCCCC3)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 44573305 | 187368 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 449 | 6 | 2 | 6 | 3.9 | C[C@H]1CN(Cc2ccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)s2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492702 | 187368 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 449 | 6 | 2 | 6 | 3.9 | C[C@H]1CN(Cc2ccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)s2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11398832 | 187717 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 443 | 6 | 1 | 5 | 3.8 | CN1CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494781 | 187717 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 443 | 6 | 1 | 5 | 3.8 | CN1CCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573620 | 187741 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 469 | 7 | 2 | 4 | 4.6 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(OC(F)(F)F)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494953 | 187741 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 469 | 7 | 2 | 4 | 4.6 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(OC(F)(F)F)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573499 | 187825 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 415 | 7 | 2 | 4 | 3.7 | COc1ccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495360 | 187825 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 415 | 7 | 2 | 4 | 3.7 | COc1ccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573466 | 193421 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 415 | 7 | 2 | 4 | 3.7 | COc1ccccc1C(=O)NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL524168 | 193421 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 415 | 7 | 2 | 4 | 3.7 | COc1ccccc1C(=O)NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589569 | 172835 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 568 | 11 | 5 | 6 | 3.5 | CCCNC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL450685 | 172835 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 568 | 11 | 5 | 6 | 3.5 | CCCNC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3ccc(C#N)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44589572 | 189093 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 602 | 10 | 5 | 6 | 4.6 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL508556 | 189093 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 602 | 10 | 5 | 6 | 4.6 | N#Cc1ccc(CN2CCC(NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 162657046 | 180949 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -79 | 4 | ChEMBL | 406 | 5 | 0 | 4 | 4.1 | Cc1cc(F)cnc1N1CCN(C(=O)CCCc2cccc3ncccc23)[C@H](C)C1 | 10.1021/acsmedchemlett.0c00626 | |||
| CHEMBL4757103 | 180949 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -79 | 4 | ChEMBL | 406 | 5 | 0 | 4 | 4.1 | Cc1cc(F)cnc1N1CCN(C(=O)CCCc2cccc3ncccc23)[C@H](C)C1 | 10.1021/acsmedchemlett.0c00626 | |||
| 44573786 | 187415 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 443 | 5 | 2 | 5 | 3.1 | O=C(NCc1cccc(-c2cccc(C(=O)N3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492989 | 187415 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 443 | 5 | 2 | 5 | 3.1 | O=C(NCc1cccc(-c2cccc(C(=O)N3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 71454215 | 83959 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 714 | 13 | 4 | 6 | 6.5 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCc2n(Cc3ccc(Cl)cc3)cc[n+]2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206595 | 83959 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 714 | 13 | 4 | 6 | 6.5 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCc2n(Cc3ccc(Cl)cc3)cc[n+]2Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 122195454 | 124179 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | -8 | 2 | ChEMBL | 377 | 7 | 1 | 4 | 3.3 | CN(CCN1CCOCC1)CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633665 | 124179 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | -8 | 2 | ChEMBL | 377 | 7 | 1 | 4 | 3.3 | CN(CCN1CCOCC1)CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| 122195453 | 124177 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | -2 | 2 | ChEMBL | 431 | 5 | 1 | 4 | 3.6 | O=C(CN1CCCC(C(=O)N2CCOCC2)C1)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633663 | 124177 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | -2 | 2 | ChEMBL | 431 | 5 | 1 | 4 | 3.6 | O=C(CN1CCCC(C(=O)N2CCOCC2)C1)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| 10092649 | 193182 | None | 43 | Rat | Functional | pIC50 | = | 5.3 | 5.3 | -69 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| CHEMBL522460 | 193182 | None | 43 | Rat | Functional | pIC50 | = | 5.3 | 5.3 | -69 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| 10092649 | 193182 | None | 43 | Rat | Functional | pIC50 | = | 5.3 | 5.3 | -69 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| CHEMBL522460 | 193182 | None | 43 | Rat | Functional | pIC50 | = | 5.3 | 5.3 | -69 | 11 | ChEMBL | 404 | 4 | 1 | 4 | 3.9 | Cc1ccccc1CN1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2012.10.132 | |||
| 152278786 | 182858 | None | 1 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -30 | 4 | ChEMBL | 467 | 5 | 0 | 8 | 2.6 | N#Cc1ccc(N2C3CCC2CN(C(=O)CCS(=O)(=O)c2cccc4ncsc24)C3)nc1 | 10.1021/acsmedchemlett.0c00626 | |||
| CHEMBL4790083 | 182858 | None | 1 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -30 | 4 | ChEMBL | 467 | 5 | 0 | 8 | 2.6 | N#Cc1ccc(N2C3CCC2CN(C(=O)CCS(=O)(=O)c2cccc4ncsc24)C3)nc1 | 10.1021/acsmedchemlett.0c00626 | |||
| 76327900 | 106539 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccc(Br)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085061 | 106539 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccc(Br)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140142 | 106539 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -1 | 3 | ChEMBL | 443 | 4 | 0 | 2 | 5.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccc(Br)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 3156646 | 8266 | None | 6 | Human | Functional | pIC50 | = | 5.3 | 5.3 | -6 | 3 | ChEMBL | 373 | 5 | 1 | 4 | 3.7 | CCN1CCN(c2ccc(NC(=O)c3ccccc3OC)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| CHEMBL1092460 | 8266 | None | 6 | Human | Functional | pIC50 | = | 5.3 | 5.3 | -6 | 3 | ChEMBL | 373 | 5 | 1 | 4 | 3.7 | CCN1CCN(c2ccc(NC(=O)c3ccccc3OC)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| 76309757 | 103553 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 1 | 3 | ChEMBL | 340 | 4 | 0 | 4 | 4.0 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccoc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085087 | 103553 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 1 | 3 | ChEMBL | 340 | 4 | 0 | 4 | 4.0 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccoc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 122195446 | 124176 | None | 0 | Human | Functional | pIC50 | = | 4.2 | 4.2 | -1 | 5 | ChEMBL | 421 | 7 | 1 | 5 | 2.8 | COc1ccc(-c2[nH]c3ccccc3c2C(=O)CN(C)CC(=O)N2CCOCC2)cc1 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633656 | 124176 | None | 0 | Human | Functional | pIC50 | = | 4.2 | 4.2 | -1 | 5 | ChEMBL | 421 | 7 | 1 | 5 | 2.8 | COc1ccc(-c2[nH]c3ccccc3c2C(=O)CN(C)CC(=O)N2CCOCC2)cc1 | 10.1021/acs.jmedchem.5b01254 | |||
| 71454217 | 83962 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 551 | 9 | 3 | 5 | 4.3 | CC[N+]1(C2CCN(C(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC(C)C)cc3)CC2)CCCC1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206601 | 83962 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 551 | 9 | 3 | 5 | 4.3 | CC[N+]1(C2CCN(C(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC(C)C)cc3)CC2)CCCC1 | 10.1016/j.bmcl.2012.09.085 | |||
| 122195454 | 124179 | None | 0 | Human | Functional | pIC50 | = | 4.2 | 4.2 | -8 | 2 | ChEMBL | 377 | 7 | 1 | 4 | 3.3 | CN(CCN1CCOCC1)CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| CHEMBL3633665 | 124179 | None | 0 | Human | Functional | pIC50 | = | 4.2 | 4.2 | -8 | 2 | ChEMBL | 377 | 7 | 1 | 4 | 3.3 | CN(CCN1CCOCC1)CC(=O)c1c(-c2ccccc2)[nH]c2ccccc12 | 10.1021/acs.jmedchem.5b01254 | |||
| 71450616 | 83967 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 2 | 3 | ChEMBL | 591 | 11 | 4 | 5 | 4.9 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)C23CC4CC(CC(C4)C2)C3)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206606 | 83967 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 2 | 3 | ChEMBL | 591 | 11 | 4 | 5 | 4.9 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)C23CC4CC(CC(C4)C2)C3)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 11284402 | 192824 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1ccc(F)c(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL521986 | 192824 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 447 | 6 | 2 | 5 | 3.6 | O=C(NCc1ccc(F)c(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589583 | 172584 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 561 | 10 | 5 | 6 | 3.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL448294 | 172584 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 561 | 10 | 5 | 6 | 3.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL555471 | 172584 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 561 | 10 | 5 | 6 | 3.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590168 | 172832 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 589 | 10 | 4 | 7 | 3.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL450652 | 172832 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 589 | 10 | 4 | 7 | 3.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540399 | 172832 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 589 | 10 | 4 | 7 | 3.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44589584 | 188887 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 563 | 10 | 4 | 5 | 4.0 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc(F)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL505651 | 188887 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 563 | 10 | 4 | 5 | 4.0 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc(F)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540144 | 188887 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 563 | 10 | 4 | 5 | 4.0 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc(F)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590122 | 192669 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 15 | 3 | ChEMBL | 555 | 10 | 4 | 7 | 3.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(C#N)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL521244 | 192669 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 15 | 3 | ChEMBL | 555 | 10 | 4 | 7 | 3.6 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(C#N)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 11626847 | 106532 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -1 | 3 | ChEMBL | 385 | 4 | 0 | 3 | 5.0 | Cc1ccsc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085068 | 106532 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -1 | 3 | ChEMBL | 385 | 4 | 0 | 3 | 5.0 | Cc1ccsc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140111 | 106532 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -1 | 3 | ChEMBL | 385 | 4 | 0 | 3 | 5.0 | Cc1ccsc1CN(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.071 | |||
| 137655938 | 159076 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -64 | 2 | ChEMBL | 362 | 6 | 2 | 4 | 3.0 | NC/C=C\CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4096305 | 159076 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -64 | 2 | ChEMBL | 362 | 6 | 2 | 4 | 3.0 | NC/C=C\CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL5081816 | 217258 | None | 0 | Rat | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCC3CCN(C)CC3)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 44573785 | 187413 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 457 | 6 | 1 | 5 | 4.2 | CN1CCCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492987 | 187413 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 457 | 6 | 1 | 5 | 4.2 | CN1CCCN(Cc2cccc(-c3cccc(CNC(=O)c4ccc5c(c4)OCO5)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573544 | 193348 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 453 | 6 | 2 | 3 | 4.7 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL523712 | 193348 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 453 | 6 | 2 | 3 | 4.7 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573421 | 187716 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 415 | 5 | 2 | 5 | 3.7 | O=C(Nc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494779 | 187716 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 415 | 5 | 2 | 5 | 3.7 | O=C(Nc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573745 | 187756 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 428 | 6 | 1 | 4 | 5.0 | O=C(NCc1cccc(-c2cccc(CN3CCCCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494997 | 187756 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 428 | 6 | 1 | 4 | 5.0 | O=C(NCc1cccc(-c2cccc(CN3CCCCC3)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 58975257 | 103432 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -1 | 3 | ChEMBL | 377 | 6 | 2 | 2 | 3.9 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNC(N)=O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084638 | 103432 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -1 | 3 | ChEMBL | 377 | 6 | 2 | 2 | 3.9 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CNC(N)=O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 57758619 | 106548 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 499 | 15 | 0 | 1 | 9.2 | CCCCCCCCCCCC[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084469 | 106548 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 499 | 15 | 0 | 1 | 9.2 | CCCCCCCCCCCC[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140171 | 106548 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 499 | 15 | 0 | 1 | 9.2 | CCCCCCCCCCCC[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 44232706 | 106522 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 400 | 4 | 1 | 1 | 5.2 | Cc1c(F)cccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1cccc(F)c1C | 10.1021/jm900736e | |||
| CHEMBL3084405 | 106522 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 400 | 4 | 1 | 1 | 5.2 | Cc1c(F)cccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1cccc(F)c1C | 10.1021/jm900736e | |||
| CHEMBL3140098 | 106522 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 400 | 4 | 1 | 1 | 5.2 | Cc1c(F)cccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1cccc(F)c1C | 10.1021/jm900736e | |||
| 44234686 | 106535 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 376 | 4 | 1 | 3 | 5.1 | Cc1cc(C(O)(C[C@@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2csc(C)c2)cs1 | 10.1021/jm900736e | |||
| CHEMBL3084412 | 106535 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 376 | 4 | 1 | 3 | 5.1 | Cc1cc(C(O)(C[C@@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2csc(C)c2)cs1 | 10.1021/jm900736e | |||
| CHEMBL3140114 | 106535 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 376 | 4 | 1 | 3 | 5.1 | Cc1cc(C(O)(C[C@@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2csc(C)c2)cs1 | 10.1021/jm900736e | |||
| 137654353 | 159108 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -1 | 6 | ChEMBL | 436 | 4 | 0 | 5 | 4.3 | O=C(C1CCN(c2cc(Oc3ccc(F)cc3F)ncn2)CC1)N1Cc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| CHEMBL4096589 | 159108 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -1 | 6 | ChEMBL | 436 | 4 | 0 | 5 | 4.3 | O=C(C1CCN(c2cc(Oc3ccc(F)cc3F)ncn2)CC1)N1Cc2ccccc2C1 | 10.1016/j.bmcl.2017.04.009 | |||
| 71457770 | 83961 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 1 | 3 | ChEMBL | 647 | 10 | 3 | 5 | 6.1 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC([N+]3(Cc4ccc(Cl)cc4)CCCC3)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206600 | 83961 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 1 | 3 | ChEMBL | 647 | 10 | 3 | 5 | 6.1 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC([N+]3(Cc4ccc(Cl)cc4)CCCC3)CC2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 44233189 | 103456 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -2 | 3 | ChEMBL | 349 | 5 | 1 | 2 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084678 | 103456 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -2 | 3 | ChEMBL | 349 | 5 | 1 | 2 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44233189 | 103456 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -2 | 3 | ChEMBL | 349 | 5 | 1 | 2 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084678 | 103456 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -2 | 3 | ChEMBL | 349 | 5 | 1 | 2 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 11602980 | 103557 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 1 | 3 | ChEMBL | 362 | 4 | 0 | 5 | 4.6 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccsc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085091 | 103557 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 1 | 3 | ChEMBL | 362 | 4 | 0 | 5 | 4.6 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccsc1)c1ccsc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 44590178 | 172841 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL450781 | 172841 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540400 | 172841 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | -1 | 3 | ChEMBL | 607 | 10 | 3 | 6 | 4.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)N[C@H]2CC[N+](C)(Cc3ccc4c(c3)OCO4)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44590123 | 183966 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 15 | 3 | ChEMBL | 564 | 10 | 4 | 6 | 4.3 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(Cl)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL480877 | 183966 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 15 | 3 | ChEMBL | 564 | 10 | 4 | 6 | 4.3 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(Cc3cccc(Cl)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 71457771 | 83963 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 5 | 3 | ChEMBL | 691 | 14 | 4 | 5 | 7.0 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206602 | 83963 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 5 | 3 | ChEMBL | 691 | 14 | 4 | 5 | 7.0 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 52176747 | 159123 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -16 | 8 | ChEMBL | 435 | 4 | 0 | 6 | 3.0 | C[C@H]1CCCCN1c1ccc(N2CCN(S(=O)(=O)c3ccccc3Cl)CC2)nn1 | 10.1016/j.bmcl.2017.05.042 | |||
| CHEMBL4096727 | 159123 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -16 | 8 | ChEMBL | 435 | 4 | 0 | 6 | 3.0 | C[C@H]1CCCCN1c1ccc(N2CCN(S(=O)(=O)c3ccccc3Cl)CC2)nn1 | 10.1016/j.bmcl.2017.05.042 | |||
| 2986945 | 95108 | None | 4 | Rat | Functional | pIC50 | = | 4.2 | 4.2 | -63 | 5 | ChEMBL | 371 | 6 | 1 | 3 | 4.1 | CCN1CCN(c2ccc(NC(=O)CCc3ccccc3)cc2Cl)CC1 | 10.1016/j.bmcl.2007.12.051 | |||
| CHEMBL255169 | 95108 | None | 4 | Rat | Functional | pIC50 | = | 4.2 | 4.2 | -63 | 5 | ChEMBL | 371 | 6 | 1 | 3 | 4.1 | CCN1CCN(c2ccc(NC(=O)CCc3ccccc3)cc2Cl)CC1 | 10.1016/j.bmcl.2007.12.051 | |||
| 76320692 | 106564 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -2 | 3 | ChEMBL | 390 | 4 | 0 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccc(C#N)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085065 | 106564 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -2 | 3 | ChEMBL | 390 | 4 | 0 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccc(C#N)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140215 | 106564 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -2 | 3 | ChEMBL | 390 | 4 | 0 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)N(Cc1ccc(C#N)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 76309755 | 103544 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 1 | 3 | ChEMBL | 428 | 4 | 0 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccc(Br)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085079 | 103544 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 1 | 3 | ChEMBL | 428 | 4 | 0 | 3 | 5.2 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccc(Br)cc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 44234681 | 106549 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 404 | 4 | 1 | 1 | 5.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084404 | 106549 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 404 | 4 | 1 | 1 | 5.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140172 | 106549 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 404 | 4 | 1 | 1 | 5.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C2 | 10.1021/jm900736e | |||
| 76316970 | 103541 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 2 | 3 | ChEMBL | 350 | 4 | 0 | 3 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085076 | 103541 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 2 | 3 | ChEMBL | 350 | 4 | 0 | 3 | 4.5 | CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)N(Cc1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2007.09.071 | |||
| 145960175 | 162222 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -27 | 2 | ChEMBL | 394 | 6 | 2 | 4 | 3.7 | C/C(CN)=C(\F)CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4161528 | 162222 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -27 | 2 | ChEMBL | 394 | 6 | 2 | 4 | 3.7 | C/C(CN)=C(\F)CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| 76313457 | 103546 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -1 | 3 | ChEMBL | 380 | 5 | 0 | 4 | 4.5 | COc1ccc(CN(C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)N3C)c2ccccc2)cc1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085080 | 103546 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -1 | 3 | ChEMBL | 380 | 5 | 0 | 4 | 4.5 | COc1ccc(CN(C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)N3C)c2ccccc2)cc1 | 10.1016/j.bmcl.2007.09.071 | |||
| 137638270 | 156969 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -6 | 5 | ChEMBL | 434 | 4 | 0 | 8 | 2.2 | Cc1noc(C)c1S(=O)(=O)N1CCN(c2ccc(N3CCCC(C)(C)C3)nn2)CC1 | 10.1016/j.bmcl.2017.05.042 | |||
| CHEMBL4071900 | 156969 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -6 | 5 | ChEMBL | 434 | 4 | 0 | 8 | 2.2 | Cc1noc(C)c1S(=O)(=O)N1CCN(c2ccc(N3CCCC(C)(C)C3)nn2)CC1 | 10.1016/j.bmcl.2017.05.042 | |||
| 44573465 | 187380 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 410 | 6 | 2 | 4 | 3.6 | N#Cc1ccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492802 | 187380 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 410 | 6 | 2 | 4 | 3.6 | N#Cc1ccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)cc1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11410317 | 187414 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 441 | 6 | 2 | 5 | 3.6 | O=C(NCc1cccc(-c2cccc(CN3C[C@@H]4C[C@H]3CN4)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492988 | 187414 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 441 | 6 | 2 | 5 | 3.6 | O=C(NCc1cccc(-c2cccc(CN3C[C@@H]4C[C@H]3CN4)c2)c1)c1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 11443944 | 187790 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 415 | 7 | 2 | 4 | 3.7 | COc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495180 | 187790 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 415 | 7 | 2 | 4 | 3.7 | COc1cccc(C(=O)NCc2cccc(-c3cccc(CN4CCNCC4)c3)c2)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL5076535 | 216933 | None | 0 | Rat | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | None | None | None | COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCCN(C)C)c3ccccc3)s2)cc1OC | 10.1021/acs.jmedchem.1c00204 | |||||
| 44573545 | 187706 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 403 | 6 | 2 | 3 | 3.8 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(F)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494742 | 187706 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 403 | 6 | 2 | 3 | 3.8 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)c1cccc(F)c1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44590166 | 189525 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 3 | 2 | ChEMBL | 468 | 9 | 4 | 6 | 2.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(CC)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL513228 | 189525 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 3 | 2 | ChEMBL | 468 | 9 | 4 | 6 | 2.5 | CCOC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC2CCN(CC)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44573422 | 187744 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 444 | 6 | 3 | 5 | 3.8 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494962 | 187744 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 444 | 6 | 3 | 5 | 3.8 | O=C(NCc1cccc(-c2cccc(CN3CCNCC3)c2)c1)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2009.01.098 | |||
| 71459691 | 83966 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -5 | 3 | ChEMBL | 723 | 14 | 4 | 5 | 8.0 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc3ccccc3c2)Cc2ccc3ccccc3c2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| CHEMBL2206605 | 83966 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -5 | 3 | ChEMBL | 723 | 14 | 4 | 5 | 8.0 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc3ccccc3c2)Cc2ccc3ccccc3c2)cc1 | 10.1016/j.bmcl.2012.09.085 | |||
| 1090202 | 8493 | None | 6 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 1 | 3 | ChEMBL | 377 | 4 | 1 | 3 | 4.4 | CCN1CCN(c2ccc(NC(=O)c3ccccc3Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| CHEMBL1094003 | 8493 | None | 6 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 1 | 3 | ChEMBL | 377 | 4 | 1 | 3 | 4.4 | CCN1CCN(c2ccc(NC(=O)c3ccccc3Cl)cc2Cl)CC1 | 10.1016/j.bmcl.2010.02.041 | |||
| 44233928 | 86108 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -1 | 3 | ChEMBL | 438 | 7 | 1 | 2 | 5.6 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL2308786 | 86108 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -1 | 3 | ChEMBL | 438 | 7 | 1 | 2 | 5.6 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44233928 | 86108 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -1 | 3 | ChEMBL | 438 | 7 | 1 | 2 | 5.6 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL2308786 | 86108 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -1 | 3 | ChEMBL | 438 | 7 | 1 | 2 | 5.6 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(=O)NCc1ccccc1)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 57758624 | 106520 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 413 | 9 | 0 | 1 | 6.6 | C=CCCCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084467 | 106520 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 413 | 9 | 0 | 1 | 6.6 | C=CCCCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140096 | 106520 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 413 | 9 | 0 | 1 | 6.6 | C=CCCCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11691471 | 12571 | None | 0 | Human | Functional | pIC50 | = | 4.1 | 4.1 | - | 1 | ChEMBL | 398 | 6 | 1 | 1 | 5.2 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1186783 | 12571 | None | 0 | Human | Functional | pIC50 | = | 4.1 | 4.1 | - | 1 | ChEMBL | 398 | 6 | 1 | 1 | 5.2 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL478070 | 12571 | None | 0 | Human | Functional | pIC50 | = | 4.1 | 4.1 | - | 1 | ChEMBL | 398 | 6 | 1 | 1 | 5.2 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 145951963 | 163097 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | -199 | 2 | ChEMBL | 394 | 6 | 2 | 4 | 3.7 | C/C(CN)=C(/F)CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4175500 | 163097 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | -199 | 2 | ChEMBL | 394 | 6 | 2 | 4 | 3.7 | C/C(CN)=C(/F)CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 | 10.1021/acsmedchemlett.7b00406 | |||
| 11398062 | 106518 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 427 | 6 | 0 | 1 | 6.9 | C[N+]1(CC2CCCCC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084464 | 106518 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 427 | 6 | 0 | 1 | 6.9 | C[N+]1(CC2CCCCC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140094 | 106518 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 427 | 6 | 0 | 1 | 6.9 | C[N+]1(CC2CCCCC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11692150 | 12634 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 442 | 9 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187107 | 12634 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 442 | 9 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL490651 | 12634 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 442 | 9 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 145950432 | 163047 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | -120 | 2 | ChEMBL | 394 | 6 | 2 | 4 | 3.7 | C/C(CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21)=C(\F)CN | 10.1021/acsmedchemlett.7b00406 | |||
| CHEMBL4174727 | 163047 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | -120 | 2 | ChEMBL | 394 | 6 | 2 | 4 | 3.7 | C/C(CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21)=C(\F)CN | 10.1021/acsmedchemlett.7b00406 | |||
| 76313456 | 106565 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 395 | 5 | 0 | 3 | 4.6 | COc1cccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)c1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3085066 | 106565 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 395 | 5 | 0 | 3 | 4.6 | COc1cccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)c1 | 10.1016/j.bmcl.2007.09.071 | |||
| CHEMBL3140216 | 106565 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 395 | 5 | 0 | 3 | 4.6 | COc1cccc(CN(C(=O)O[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)c2ccccc2)c1 | 10.1016/j.bmcl.2007.09.071 | |||
| 66875589 | 103445 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 321 | 4 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084662 | 103445 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 321 | 4 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 11504490 | 192711 | None | 0 | Human | Functional | pKd | = | 11 | 11.0 | - | 0 | ChEMBL | 514 | 8 | 3 | 4 | 4.8 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CC5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1021/jm800935u | |||
| CHEMBL521523 | 192711 | None | 0 | Human | Functional | pKd | = | 11 | 11.0 | - | 0 | ChEMBL | 514 | 8 | 3 | 4 | 4.8 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CC5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1021/jm800935u | |||
| 11504490 | 192711 | None | 0 | Human | Functional | pKd | = | 11 | 11.0 | - | 0 | ChEMBL | 514 | 8 | 3 | 4 | 4.8 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CC5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL521523 | 192711 | None | 0 | Human | Functional | pKd | = | 11 | 11.0 | - | 0 | ChEMBL | 514 | 8 | 3 | 4 | 4.8 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CC5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 25034186 | 203895 | None | 0 | Human | Functional | pKd | = | 10.9 | 10.9 | - | 0 | ChEMBL | 722 | 11 | 4 | 8 | 7.1 | Cc1cn2cc(CNC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC4CCCCC4)s3)[n+](Cc3ccc4ccccc4c3)c2s1 | 10.1021/jm800634k | |||
| CHEMBL540396 | 203895 | None | 0 | Human | Functional | pKd | = | 10.9 | 10.9 | - | 0 | ChEMBL | 722 | 11 | 4 | 8 | 7.1 | Cc1cn2cc(CNC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC4CCCCC4)s3)[n+](Cc3ccc4ccccc4c3)c2s1 | 10.1021/jm800634k | |||
| CHEMBL604842 | 203895 | None | 0 | Human | Functional | pKd | = | 10.9 | 10.9 | - | 0 | ChEMBL | 722 | 11 | 4 | 8 | 7.1 | Cc1cn2cc(CNC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC4CCCCC4)s3)[n+](Cc3ccc4ccccc4c3)c2s1 | 10.1021/jm800634k | |||
| 25195533 | 78417 | None | 2 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL2103803 | 78417 | None | 2 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL2110584 | 78417 | None | 2 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 25195533 | 78417 | None | 2 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL2103803 | 78417 | None | 2 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL2110584 | 78417 | None | 2 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 44589580 | 173251 | None | 0 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 635 | 10 | 5 | 7 | 5.3 | C[N+]1(Cc2ccc(O)cc2)CCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)Nc2ccc(C(=O)OC3CCCCC3)s2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL452142 | 173251 | None | 0 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 635 | 10 | 5 | 7 | 5.3 | C[N+]1(Cc2ccc(O)cc2)CCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)Nc2ccc(C(=O)OC3CCCCC3)s2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL553448 | 173251 | None | 0 | Human | Functional | pKd | = | 10.7 | 10.7 | - | 0 | ChEMBL | 635 | 10 | 5 | 7 | 5.3 | C[N+]1(Cc2ccc(O)cc2)CCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)Nc2ccc(C(=O)OC3CCCCC3)s2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| 11533795 | 12622 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3cccc(F)c3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187076 | 12622 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3cccc(F)c3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL489212 | 12622 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3cccc(F)c3)(CC1)CC2 | 10.1021/jm801601v | |||
| 25034184 | 188504 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 676 | 11 | 4 | 7 | 6.1 | Cc1cn2cc(CNC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC(C)C)cc3)[n+](Cc3ccc4ccccc4c3)c2s1 | 10.1021/jm800634k | |||
| CHEMBL501803 | 188504 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 676 | 11 | 4 | 7 | 6.1 | Cc1cn2cc(CNC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC(C)C)cc3)[n+](Cc3ccc4ccccc4c3)c2s1 | 10.1021/jm800634k | |||
| CHEMBL539887 | 188504 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 676 | 11 | 4 | 7 | 6.1 | Cc1cn2cc(CNC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)Nc3ccc(C(=O)OC(C)C)cc3)[n+](Cc3ccc4ccccc4c3)c2s1 | 10.1021/jm800634k | |||
| 11442669 | 74481 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2023760 | 74481 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2027876 | 74481 | None | 0 | Human | Functional | pKd | = | 10.6 | 10.6 | - | 0 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11519069 | 3939 | None | 2 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 11519070 | 3939 | None | 2 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 11519070.0 | 3939 | None | 2 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 4816 | 3939 | None | 2 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 7354 | 3939 | None | 2 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| CHEMBL1187833 | 3939 | None | 2 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| DB09076 | 3939 | None | 2 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 11528123 | 192742 | None | 0 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 0 | ChEMBL | 529 | 8 | 2 | 5 | 4.0 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCN(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL521696 | 192742 | None | 0 | Human | Functional | pKd | = | 10.5 | 10.5 | - | 0 | ChEMBL | 529 | 8 | 2 | 5 | 4.0 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCN(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 42626090 | 12621 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL1187075 | 12621 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL489211 | 12621 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| 42626094 | 12629 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3F)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187092 | 12629 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3F)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL490237 | 12629 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3F)(CC1)CC2 | 10.1021/jm801601v | |||
| 11585117 | 12765 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(Br)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187851 | 12765 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(Br)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL523957 | 12765 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(Br)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 70689729 | 74505 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 479 | 10 | 0 | 2 | 6.9 | C[N+]1(CCCOCc2ccccc2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2021997 | 74505 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 479 | 10 | 0 | 2 | 6.9 | C[N+]1(CCCOCc2ccccc2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2028006 | 74505 | None | 0 | Human | Functional | pKd | = | 10.4 | 10.4 | - | 0 | ChEMBL | 479 | 10 | 0 | 2 | 6.9 | C[N+]1(CCCOCc2ccccc2)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11753447 | 187457 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 459 | 7 | 2 | 4 | 4.4 | CC(=O)c1cccc(C(=O)NCc2ccc(F)c(-c3cccc(CN4CCN[C@@H](C)C4)c3)c2)c1 | 10.1021/jm800935u | |||
| CHEMBL493265 | 187457 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 459 | 7 | 2 | 4 | 4.4 | CC(=O)c1cccc(C(=O)NCc2ccc(F)c(-c3cccc(CN4CCN[C@@H](C)C4)c3)c2)c1 | 10.1021/jm800935u | |||
| 11365314 | 187458 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 473 | 8 | 2 | 4 | 4.8 | CCC(=O)c1cccc(C(=O)NCc2ccc(F)c(-c3cccc(CN4CCN[C@@H](C)C4)c3)c2)c1 | 10.1021/jm800935u | |||
| CHEMBL493266 | 187458 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 473 | 8 | 2 | 4 | 4.8 | CCC(=O)c1cccc(C(=O)NCc2ccc(F)c(-c3cccc(CN4CCN[C@@H](C)C4)c3)c2)c1 | 10.1021/jm800935u | |||
| 57758618 | 106529 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 359 | 5 | 0 | 1 | 5.3 | CC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084457 | 106529 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 359 | 5 | 0 | 1 | 5.3 | CC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140108 | 106529 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 359 | 5 | 0 | 1 | 5.3 | CC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 57758626 | 106545 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 373 | 6 | 0 | 1 | 5.7 | CCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084458 | 106545 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 373 | 6 | 0 | 1 | 5.7 | CCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140168 | 106545 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 373 | 6 | 0 | 1 | 5.7 | CCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 57758627 | 106546 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084459 | 106546 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140169 | 106546 | None | 0 | Human | Functional | pKd | = | 10.3 | 10.3 | - | 0 | ChEMBL | 385 | 6 | 0 | 1 | 5.7 | C[N+]1(CC2CC2)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 44232952 | 103438 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 4.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084650 | 103438 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 4.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 11592005 | 12751 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 464 | 8 | 1 | 2 | 5.4 | OC(c1ccc(F)cc1)(c1ccc(F)cc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187807 | 12751 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 464 | 8 | 1 | 2 | 5.4 | OC(c1ccc(F)cc1)(c1ccc(F)cc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL522081 | 12751 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 464 | 8 | 1 | 2 | 5.4 | OC(c1ccc(F)cc1)(c1ccc(F)cc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 11649606 | 12757 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 462 | 8 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(Cl)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187835 | 12757 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 462 | 8 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(Cl)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL523474 | 12757 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 462 | 8 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(Cl)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 11651006 | 189056 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 573 | 11 | 3 | 6 | 3.7 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCN(CCCO)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL508097 | 189056 | None | 0 | Human | Functional | pKd | = | 10.2 | 10.2 | - | 0 | ChEMBL | 573 | 11 | 3 | 6 | 3.7 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCN(CCCO)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11519318 | 12748 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(F)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187800 | 12748 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(F)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL521781 | 12748 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 446 | 8 | 1 | 2 | 5.3 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccc(F)cc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 11693689 | 171031 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 620 | 10 | 2 | 4 | 5.7 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+](C)(Cc6ccccc6)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL445527 | 171031 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 620 | 10 | 2 | 4 | 5.7 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+](C)(Cc6ccccc6)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL554706 | 171031 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 620 | 10 | 2 | 4 | 5.7 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+](C)(Cc6ccccc6)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44573747 | 187823 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 543 | 9 | 2 | 5 | 3.5 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCN(C=O)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495350 | 187823 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 543 | 9 | 2 | 5 | 3.5 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCN(C=O)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 70685520 | 74491 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 443 | 11 | 0 | 1 | 7.6 | CCCCCCCC[N+]1(C)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2021998 | 74491 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 443 | 11 | 0 | 1 | 7.6 | CCCCCCCC[N+]1(C)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL2027937 | 74491 | None | 0 | Human | Functional | pKd | = | 10.1 | 10.1 | - | 0 | ChEMBL | 443 | 11 | 0 | 1 | 7.6 | CCCCCCCC[N+]1(C)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 44233188 | 103309 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 348 | 5 | 1 | 2 | 3.7 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(N)=O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084419 | 103309 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 348 | 5 | 1 | 2 | 3.7 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C(N)=O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44234688 | 106536 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 346 | 3 | 0 | 0 | 5.8 | Cc1ccccc1C(=C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3084414 | 106536 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 346 | 3 | 0 | 0 | 5.8 | Cc1ccccc1C(=C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3140115 | 106536 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 346 | 3 | 0 | 0 | 5.8 | Cc1ccccc1C(=C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| 11223598 | 106581 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 5.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084413 | 106581 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 5.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140264 | 106581 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 5.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| 42626019 | 12569 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1cccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| CHEMBL1186756 | 12569 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1cccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| CHEMBL476434 | 12569 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1cccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| 25195533 | 78417 | None | 2 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL2103803 | 78417 | None | 2 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL2110584 | 78417 | None | 2 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 345 | 4 | 0 | 1 | 4.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 11586041 | 172787 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 572 | 10 | 2 | 4 | 4.9 | CCC[N+]1(C)CCN(Cc2cccc(C(=O)NCc3ccc(F)c(-c4cccc(CN5CCN[C@@H](C)C5)c4)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL450060 | 172787 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 572 | 10 | 2 | 4 | 4.9 | CCC[N+]1(C)CCN(Cc2cccc(C(=O)NCc3ccc(F)c(-c4cccc(CN5CCN[C@@H](C)C5)c4)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL540251 | 172787 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 572 | 10 | 2 | 4 | 4.9 | CCC[N+]1(C)CCN(Cc2cccc(C(=O)NCc3ccc(F)c(-c4cccc(CN5CCN[C@@H](C)C5)c4)c3)c2)CC1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589581 | 188896 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 615 | 12 | 5 | 6 | 4.9 | C=CC[N+]1(Cc2cccc(O)c2)CCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)Nc2ccc(C(=O)OC(C)C)cc2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL505751 | 188896 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 615 | 12 | 5 | 6 | 4.9 | C=CC[N+]1(Cc2cccc(O)c2)CCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)Nc2ccc(C(=O)OC(C)C)cc2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540145 | 188896 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 615 | 12 | 5 | 6 | 4.9 | C=CC[N+]1(Cc2cccc(O)c2)CCC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)Nc2ccc(C(=O)OC(C)C)cc2)C1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44589579 | 189162 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 595 | 10 | 5 | 7 | 4.4 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(O)cc3)C2)s1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL509515 | 189162 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 595 | 10 | 5 | 7 | 4.4 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(O)cc3)C2)s1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540148 | 189162 | None | 0 | Human | Functional | pKd | = | 10 | 10.0 | - | 0 | ChEMBL | 595 | 10 | 5 | 7 | 4.4 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(O)cc3)C2)s1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44233930 | 106580 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 363 | 5 | 1 | 1 | 3.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C(N)=O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084409 | 106580 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 363 | 5 | 1 | 1 | 3.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C(N)=O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140263 | 106580 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 363 | 5 | 1 | 1 | 3.9 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C(N)=O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 42626017 | 12767 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3cccc(Br)c3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187854 | 12767 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3cccc(Br)c3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL524119 | 12767 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3cccc(Br)c3)(CC1)CC2 | 10.1021/jm801601v | |||
| 25034182 | 172687 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL448870 | 172687 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL540359 | 172687 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1021/jm800634k | |||
| 11585987 | 187824 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 516 | 8 | 2 | 5 | 4.0 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCOCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL495358 | 187824 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 516 | 8 | 2 | 5 | 4.0 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCOCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11607628 | 188419 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 584 | 8 | 2 | 4 | 5.0 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+]6(CCCCC6)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL500560 | 188419 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 584 | 8 | 2 | 4 | 5.0 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+]6(CCCCC6)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL539886 | 188419 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 584 | 8 | 2 | 4 | 5.0 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+]6(CCCCC6)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 25034182 | 172687 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL448870 | 172687 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540359 | 172687 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 25132856 | 187322 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 515 | 8 | 3 | 5 | 3.6 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1021/jm800935u | |||
| CHEMBL492437 | 187322 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 515 | 8 | 3 | 5 | 3.6 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1021/jm800935u | |||
| 25132856 | 187322 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 515 | 8 | 3 | 5 | 3.6 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL492437 | 187322 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 515 | 8 | 3 | 5 | 3.6 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCNCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11556983 | 187471 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 544 | 8 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+](C)(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL493331 | 187471 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 544 | 8 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+](C)(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL538864 | 187471 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 544 | 8 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+](C)(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL555476 | 187471 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 544 | 8 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CC[N+](C)(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 57758616 | 106530 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 398 | 7 | 0 | 2 | 5.6 | C[N+]1(CCCC#N)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084463 | 106530 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 398 | 7 | 0 | 2 | 5.6 | C[N+]1(CCCC#N)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140109 | 106530 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 398 | 7 | 0 | 2 | 5.6 | C[N+]1(CCCC#N)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 57758629 | 106552 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 375 | 6 | 1 | 2 | 4.3 | C[N+]1(CCO)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084460 | 106552 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 375 | 6 | 1 | 2 | 4.3 | C[N+]1(CCO)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140180 | 106552 | None | 0 | Human | Functional | pKd | = | 9.8 | 9.8 | - | 0 | ChEMBL | 375 | 6 | 1 | 2 | 4.3 | C[N+]1(CCO)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11535362 | 187724 | None | 0 | Human | Functional | pKd | = | 9.7 | 9.7 | - | 0 | ChEMBL | 545 | 12 | 2 | 5 | 4.6 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN(C)CCCN(C)C)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494837 | 187724 | None | 0 | Human | Functional | pKd | = | 9.7 | 9.7 | - | 0 | ChEMBL | 545 | 12 | 2 | 5 | 4.6 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN(C)CCCN(C)C)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 16086059 | 80806 | None | 0 | Rat | Functional | pKd | = | 9.7 | 9.7 | - | 0 | ChEMBL | 662 | 9 | 3 | 5 | 3.9 | O=C(NCC1CCNCC1)[C@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CC(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1021/jm051205r | |||
| CHEMBL215180 | 80806 | None | 0 | Rat | Functional | pKd | = | 9.7 | 9.7 | - | 0 | ChEMBL | 662 | 9 | 3 | 5 | 3.9 | O=C(NCC1CCNCC1)[C@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CC(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1 | 10.1021/jm051205r | |||
| 11249888 | 187483 | None | 0 | Human | Functional | pKd | = | 9.6 | 9.6 | - | 0 | ChEMBL | 442 | 6 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(C#N)c4)ccc3F)c2)CCN1 | 10.1021/jm800935u | |||
| CHEMBL493465 | 187483 | None | 0 | Human | Functional | pKd | = | 9.6 | 9.6 | - | 0 | ChEMBL | 442 | 6 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(C#N)c4)ccc3F)c2)CCN1 | 10.1021/jm800935u | |||
| 11642407 | 12624 | None | 0 | Human | Functional | pKd | = | 9.6 | 9.6 | - | 0 | ChEMBL | 464 | 8 | 1 | 2 | 5.4 | OC(c1cccc(F)c1)(c1cccc(F)c1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187079 | 12624 | None | 0 | Human | Functional | pKd | = | 9.6 | 9.6 | - | 0 | ChEMBL | 464 | 8 | 1 | 2 | 5.4 | OC(c1cccc(F)c1)(c1cccc(F)c1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL489625 | 12624 | None | 0 | Human | Functional | pKd | = | 9.6 | 9.6 | - | 0 | ChEMBL | 464 | 8 | 1 | 2 | 5.4 | OC(c1cccc(F)c1)(c1cccc(F)c1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 11564285 | 193264 | None | 0 | Human | Functional | pKd | = | 9.6 | 9.6 | - | 0 | ChEMBL | 543 | 8 | 2 | 5 | 4.4 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCCN(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL523044 | 193264 | None | 0 | Human | Functional | pKd | = | 9.6 | 9.6 | - | 0 | ChEMBL | 543 | 8 | 2 | 5 | 4.4 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCCN(C)CC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44232952 | 103438 | None | 0 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 4.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084650 | 103438 | None | 0 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 4.8 | CN1[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 11519069 | 3939 | None | 2 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 11519070 | 3939 | None | 2 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 11519070.0 | 3939 | None | 2 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 4816 | 3939 | None | 2 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 7354 | 3939 | None | 2 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| CHEMBL1187833 | 3939 | None | 2 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| DB09076 | 3939 | None | 2 | Human | Functional | pKd | = | 9.5 | 9.5 | - | 3 | ChEMBL | 428 | 8 | 1 | 2 | 5.1 | OC(C12CC[N+](CC1)(CC2)CCOCc1ccccc1)(c1ccccc1)c1ccccc1 | 10.1021/jm801601v | |||
| 42625938 | 12620 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 337 | 5 | 2 | 2 | 2.9 | NCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187073 | 12620 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 337 | 5 | 2 | 2 | 2.9 | NCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL489032 | 12620 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 337 | 5 | 2 | 2 | 2.9 | NCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 15951517 | 12631 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 414 | 8 | 1 | 2 | 4.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)C2 | 10.1021/jm801601v | |||
| CHEMBL1187094 | 12631 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 414 | 8 | 1 | 2 | 4.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)C2 | 10.1021/jm801601v | |||
| CHEMBL490243 | 12631 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 414 | 8 | 1 | 2 | 4.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)C2 | 10.1021/jm801601v | |||
| 11512119 | 12758 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 453 | 8 | 1 | 3 | 5.0 | N#Cc1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL1187838 | 12758 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 453 | 8 | 1 | 3 | 5.0 | N#Cc1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| CHEMBL523598 | 12758 | None | 0 | Human | Functional | pKd | = | 9.4 | 9.4 | - | 0 | ChEMBL | 453 | 8 | 1 | 3 | 5.0 | N#Cc1ccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)cc1 | 10.1021/jm801601v | |||
| 69058946 | 106531 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 336 | 4 | 1 | 1 | 4.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084658 | 106531 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 336 | 4 | 1 | 1 | 4.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140110 | 106531 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 336 | 4 | 1 | 1 | 4.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 69058946 | 106531 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 336 | 4 | 1 | 1 | 4.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084658 | 106531 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 336 | 4 | 1 | 1 | 4.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3140110 | 106531 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 336 | 4 | 1 | 1 | 4.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 42625944 | 12609 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 426 | 8 | 1 | 1 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1186964 | 12609 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 426 | 8 | 1 | 1 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL484475 | 12609 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 426 | 8 | 1 | 1 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 16041939 | 12632 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 423 | 8 | 0 | 2 | 5.3 | N#CC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)C2 | 10.1021/jm801601v | |||
| CHEMBL1187095 | 12632 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 423 | 8 | 0 | 2 | 5.3 | N#CC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)C2 | 10.1021/jm801601v | |||
| CHEMBL490244 | 12632 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 423 | 8 | 0 | 2 | 5.3 | N#CC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)C2 | 10.1021/jm801601v | |||
| 57758617 | 106517 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 389 | 7 | 0 | 2 | 4.9 | COCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084462 | 106517 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 389 | 7 | 0 | 2 | 4.9 | COCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140093 | 106517 | None | 0 | Human | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 389 | 7 | 0 | 2 | 4.9 | COCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11636578 | 193186 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 514 | 8 | 2 | 4 | 5.2 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCCCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL522495 | 193186 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 514 | 8 | 2 | 4 | 5.2 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCCCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 44589582 | 171744 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 577 | 12 | 4 | 5 | 4.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](CC3CC3)(CC3CC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL446587 | 171744 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 577 | 12 | 4 | 5 | 4.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](CC3CC3)(CC3CC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL550885 | 171744 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 577 | 12 | 4 | 5 | 4.6 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](CC3CC3)(CC3CC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44589576 | 189164 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 588 | 10 | 6 | 5 | 3.9 | CC(C)NC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL509520 | 189164 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 588 | 10 | 6 | 5 | 3.9 | CC(C)NC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL555706 | 189164 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 588 | 10 | 6 | 5 | 3.9 | CC(C)NC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3ccc(O)cc3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 57758613 | 106556 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 433 | 10 | 0 | 3 | 4.9 | COCCOCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084468 | 106556 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 433 | 10 | 0 | 3 | 4.9 | COCCOCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140184 | 106556 | None | 0 | Human | Functional | pKd | = | 9.2 | 9.2 | - | 0 | ChEMBL | 433 | 10 | 0 | 3 | 4.9 | COCCOCC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 11705920 | 12753 | None | 0 | Human | Functional | pKd | = | 9.1 | 9.1 | - | 0 | ChEMBL | 414 | 7 | 1 | 2 | 5.0 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187810 | 12753 | None | 0 | Human | Functional | pKd | = | 9.1 | 9.1 | - | 0 | ChEMBL | 414 | 7 | 1 | 2 | 5.0 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL522418 | 12753 | None | 0 | Human | Functional | pKd | = | 9.1 | 9.1 | - | 0 | ChEMBL | 414 | 7 | 1 | 2 | 5.0 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 11633226 | 106584 | None | 0 | Human | Functional | pKd | = | 9 | 9.0 | - | 0 | ChEMBL | 344 | 3 | 0 | 2 | 5.6 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084418 | 106584 | None | 0 | Human | Functional | pKd | = | 9 | 9.0 | - | 0 | ChEMBL | 344 | 3 | 0 | 2 | 5.6 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140267 | 106584 | None | 0 | Human | Functional | pKd | = | 9 | 9.0 | - | 0 | ChEMBL | 344 | 3 | 0 | 2 | 5.6 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| 11223598 | 106581 | None | 0 | Human | Functional | pKd | = | 9 | 9.0 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 5.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084413 | 106581 | None | 0 | Human | Functional | pKd | = | 9 | 9.0 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 5.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140264 | 106581 | None | 0 | Human | Functional | pKd | = | 9 | 9.0 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 5.3 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| 11691950 | 12766 | None | 0 | Human | Functional | pKd | = | 8.9 | 8.9 | - | 0 | ChEMBL | 428 | 8 | 1 | 2 | 5.4 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187853 | 12766 | None | 0 | Human | Functional | pKd | = | 8.9 | 8.9 | - | 0 | ChEMBL | 428 | 8 | 1 | 2 | 5.4 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL524097 | 12766 | None | 0 | Human | Functional | pKd | = | 8.9 | 8.9 | - | 0 | ChEMBL | 428 | 8 | 1 | 2 | 5.4 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 57758623 | 106554 | None | 0 | Human | Functional | pKd | = | 8.9 | 8.9 | - | 0 | ChEMBL | 371 | 6 | 0 | 1 | 5.5 | C=CC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3084461 | 106554 | None | 0 | Human | Functional | pKd | = | 8.9 | 8.9 | - | 0 | ChEMBL | 371 | 6 | 0 | 1 | 5.5 | C=CC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| CHEMBL3140182 | 106554 | None | 0 | Human | Functional | pKd | = | 8.9 | 8.9 | - | 0 | ChEMBL | 371 | 6 | 0 | 1 | 5.5 | C=CC[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2012.02.015 | |||
| 44234690 | 106583 | None | 0 | Human | Functional | pKd | = | 8.8 | 8.8 | - | 0 | ChEMBL | 350 | 4 | 1 | 1 | 4.7 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084417 | 106583 | None | 0 | Human | Functional | pKd | = | 8.8 | 8.8 | - | 0 | ChEMBL | 350 | 4 | 1 | 1 | 4.7 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140266 | 106583 | None | 0 | Human | Functional | pKd | = | 8.8 | 8.8 | - | 0 | ChEMBL | 350 | 4 | 1 | 1 | 4.7 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44232949 | 106582 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 362 | 4 | 1 | 3 | 4.8 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084415 | 106582 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 362 | 4 | 1 | 3 | 4.8 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140265 | 106582 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 362 | 4 | 1 | 3 | 4.8 | C[N+]1(C)[C@H]2CCC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| 11635210 | 12740 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 458 | 9 | 1 | 3 | 5.1 | COc1cccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| CHEMBL1187765 | 12740 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 458 | 9 | 1 | 3 | 5.1 | COc1cccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| CHEMBL519652 | 12740 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 458 | 9 | 1 | 3 | 5.1 | COc1cccc(COCC[N+]23CCC(C(O)(c4ccccc4)c4ccccc4)(CC2)CC3)c1 | 10.1021/jm801601v | |||
| 44589578 | 173273 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 585 | 9 | 5 | 7 | 4.1 | Cc1nc(-c2ccc(NC(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@H]3CCC[N+](C)(Cc4ccc(O)cc4)C3)cc2)no1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL452193 | 173273 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 585 | 9 | 5 | 7 | 4.1 | Cc1nc(-c2ccc(NC(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@H]3CCC[N+](C)(Cc4ccc(O)cc4)C3)cc2)no1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540401 | 173273 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 585 | 9 | 5 | 7 | 4.1 | Cc1nc(-c2ccc(NC(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@H]3CCC[N+](C)(Cc4ccc(O)cc4)C3)cc2)no1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44589577 | 189076 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 585 | 9 | 5 | 7 | 4.1 | Cc1noc(-c2ccc(NC(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@H]3CCC[N+](C)(Cc4ccc(O)cc4)C3)cc2)n1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL508343 | 189076 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 585 | 9 | 5 | 7 | 4.1 | Cc1noc(-c2ccc(NC(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@H]3CCC[N+](C)(Cc4ccc(O)cc4)C3)cc2)n1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL540146 | 189076 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 585 | 9 | 5 | 7 | 4.1 | Cc1noc(-c2ccc(NC(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@H]3CCC[N+](C)(Cc4ccc(O)cc4)C3)cc2)n1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44232702 | 106559 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 1 | ChEMBL | 372 | 4 | 1 | 1 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(F)c1)c1cccc(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084401 | 106559 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 1 | ChEMBL | 372 | 4 | 1 | 1 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(F)c1)c1cccc(F)c1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140203 | 106559 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 1 | ChEMBL | 372 | 4 | 1 | 1 | 4.6 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccc(F)c1)c1cccc(F)c1)C2 | 10.1021/jm900736e | |||
| 11692150 | 12634 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 1 | ChEMBL | 442 | 9 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187107 | 12634 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 1 | ChEMBL | 442 | 9 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL490651 | 12634 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 1 | ChEMBL | 442 | 9 | 1 | 2 | 5.8 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCCCOc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 25034182 | 172687 | None | 0 | Human | Functional | pKd | = | 7.8 | 7.8 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL448870 | 172687 | None | 0 | Human | Functional | pKd | = | 7.8 | 7.8 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1021/jm800634k | |||
| CHEMBL540359 | 172687 | None | 0 | Human | Functional | pKd | = | 7.8 | 7.8 | - | 0 | ChEMBL | 589 | 10 | 5 | 6 | 4.3 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1 | 10.1021/jm800634k | |||
| 76327869 | 103306 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 0 | ChEMBL | 333 | 4 | 1 | 4 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084396 | 103306 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 0 | ChEMBL | 333 | 4 | 1 | 4 | 4.3 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| 66875589 | 103445 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 1 | ChEMBL | 321 | 4 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084662 | 103445 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 1 | ChEMBL | 321 | 4 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 11235700 | 106523 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 0 | ChEMBL | 348 | 4 | 1 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084410 | 106523 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 0 | ChEMBL | 348 | 4 | 1 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140099 | 106523 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 0 | ChEMBL | 348 | 4 | 1 | 3 | 4.5 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900736e | |||
| 66875589 | 103445 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 1 | ChEMBL | 321 | 4 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084662 | 103445 | None | 0 | Human | Functional | pKd | = | 8.6 | 8.6 | - | 1 | ChEMBL | 321 | 4 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(O)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 44233192 | 106538 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 350 | 5 | 1 | 1 | 4.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084643 | 106538 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 350 | 5 | 1 | 1 | 4.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3140141 | 106538 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 350 | 5 | 1 | 1 | 4.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 42626088 | 12628 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 1 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3Br)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187091 | 12628 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 1 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3Br)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL490236 | 12628 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 1 | ChEMBL | 506 | 8 | 1 | 2 | 5.9 | OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3Br)(CC1)CC2 | 10.1021/jm801601v | |||
| 42626013 | 12630 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 437 | 8 | 0 | 2 | 5.7 | N#CC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187093 | 12630 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 437 | 8 | 0 | 2 | 5.7 | N#CC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL490242 | 12630 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 437 | 8 | 0 | 2 | 5.7 | N#CC(c1ccccc1)(c1ccccc1)C12CC[N+](CCOCc3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 11722039 | 187470 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 530 | 8 | 3 | 4 | 3.8 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(C[N+]5(C)CCNCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL493330 | 187470 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 530 | 8 | 3 | 4 | 3.8 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(C[N+]5(C)CCNCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL558605 | 187470 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 530 | 8 | 3 | 4 | 3.8 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(C[N+]5(C)CCNCC5)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 11650778 | 187578 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 474 | 8 | 2 | 4 | 4.3 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN(C)C)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| CHEMBL494022 | 187578 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 474 | 8 | 2 | 4 | 4.3 | C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN(C)C)c4)ccc3F)c2)CCN1 | 10.1016/j.bmcl.2009.01.098 | |||
| 16042745 | 185407 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 551 | 8 | 4 | 5 | 4.4 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+]3(CCCCCC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL485932 | 185407 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 551 | 8 | 4 | 5 | 4.4 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+]3(CCCCCC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| CHEMBL538360 | 185407 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 551 | 8 | 4 | 5 | 4.4 | CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+]3(CCCCCC3)C2)cc1 | 10.1016/j.bmcl.2008.09.020 | |||
| 44233190 | 103457 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 335 | 5 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084679 | 103457 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 335 | 5 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44233192 | 106538 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 350 | 5 | 1 | 1 | 4.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084643 | 106538 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 350 | 5 | 1 | 1 | 4.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140141 | 106538 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 350 | 5 | 1 | 1 | 4.4 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44233190 | 103457 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 335 | 5 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| CHEMBL3084679 | 103457 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 335 | 5 | 1 | 2 | 4.2 | CN1[C@H]2CC[C@@H]1C[C@H](CC(CO)(c1ccccc1)c1ccccc1)C2 | 10.1016/j.bmcl.2009.07.006 | |||
| 42626092 | 12639 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 1 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccccc1COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL1187132 | 12639 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 1 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccccc1COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| CHEMBL491246 | 12639 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 1 | ChEMBL | 442 | 8 | 1 | 2 | 5.4 | Cc1ccccc1COCC[N+]12CCC(C(O)(c3ccccc3)c3ccccc3)(CC1)CC2 | 10.1021/jm801601v | |||
| 66604762 | 106566 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 318 | 3 | 0 | 0 | 5.1 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3084398 | 106566 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 318 | 3 | 0 | 0 | 5.1 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| CHEMBL3140217 | 106566 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 318 | 3 | 0 | 0 | 5.1 | C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](C=C(c1ccccc1)c1ccccc1)C2 | 10.1021/jm900736e | |||
| 44232700 | 106567 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 1 | ChEMBL | 364 | 4 | 1 | 1 | 4.9 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3084399 | 106567 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 1 | ChEMBL | 364 | 4 | 1 | 1 | 4.9 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| CHEMBL3140218 | 106567 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 1 | ChEMBL | 364 | 4 | 1 | 1 | 4.9 | Cc1ccccc1C(O)(C[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)c1ccccc1C | 10.1021/jm900736e | |||
| 16065402 | 67949 | None | 0 | Human | Functional | pKi | = | 10.3 | 10.3 | - | 0 | ChEMBL | 428 | 9 | 1 | 3 | 4.8 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2ccccc2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910848 | 67949 | None | 0 | Human | Functional | pKi | = | 10.3 | 10.3 | - | 0 | ChEMBL | 428 | 9 | 1 | 3 | 4.8 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2ccccc2)C1 | 10.1021/jm200884j | |||
| 367 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| 5487427 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| 5487427.0 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| 8592 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| CHEMBL1900528 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| CHEMBL3305968 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| CHEMBL4650755 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| DB01409 | 3824 | None | 10 | Human | Functional | pKi | = | 10.3 | 10.3 | -3 | 8 | 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 | 10.1021/jm200884j | |||
| 54757541 | 67953 | None | 0 | Human | Functional | pKi | = | 9.8 | 9.8 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccccc2O)C1 | 10.1021/jm200884j | |||
| CHEMBL1910852 | 67953 | None | 0 | Human | Functional | pKi | = | 9.8 | 9.8 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccccc2O)C1 | 10.1021/jm200884j | |||
| 54757856 | 67958 | None | 0 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 458 | 10 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(OCc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910857 | 67958 | None | 0 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 458 | 10 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(OCc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| 325 | 2062 | None | 10 | Human | Functional | pKi | = | 9.7 | 9.7 | 1 | 3 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1021/jm200884j | |||
| 3746 | 2062 | None | 10 | Human | Functional | pKi | = | 9.7 | 9.7 | 1 | 3 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1021/jm200884j | |||
| 657308 | 2062 | None | 10 | Human | Functional | pKi | = | 9.7 | 9.7 | 1 | 3 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1021/jm200884j | |||
| CHEMBL1615433 | 2062 | None | 10 | Human | Functional | pKi | = | 9.7 | 9.7 | 1 | 3 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1021/jm200884j | |||
| DB00332 | 2062 | None | 10 | Human | Functional | pKi | = | 9.7 | 9.7 | 1 | 3 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1021/jm200884j | |||
| 16065403 | 67957 | None | 24 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 444 | 9 | 2 | 4 | 4.5 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910856 | 67957 | None | 24 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 444 | 9 | 2 | 4 | 4.5 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| 16034837 | 67952 | None | 0 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910851 | 67952 | None | 0 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| 16065543 | 67963 | None | 0 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.1 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)cc(Cl)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910862 | 67963 | None | 0 | Human | Functional | pKi | = | 9.7 | 9.7 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.1 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)cc(Cl)c2)C1 | 10.1021/jm200884j | |||
| 16065135 | 67947 | None | 0 | Human | Functional | pKi | = | 9.6 | 9.6 | - | 0 | ChEMBL | 442 | 9 | 1 | 3 | 5.2 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccccc2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910846 | 67947 | None | 0 | Human | Functional | pKi | = | 9.6 | 9.6 | - | 0 | ChEMBL | 442 | 9 | 1 | 3 | 5.2 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccccc2)C1 | 10.1021/jm200884j | |||
| 16065407 | 67966 | None | 0 | Human | Functional | pKi | = | 9.6 | 9.6 | - | 0 | ChEMBL | 462 | 9 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cccc(O)c2F)C1 | 10.1021/jm200884j | |||
| CHEMBL1910865 | 67966 | None | 0 | Human | Functional | pKi | = | 9.6 | 9.6 | - | 0 | ChEMBL | 462 | 9 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cccc(O)c2F)C1 | 10.1021/jm200884j | |||
| 16065268 | 67950 | None | 0 | Human | Functional | pKi | = | 9.6 | 9.6 | - | 0 | ChEMBL | 456 | 9 | 1 | 3 | 5.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CCC(Oc2ccccc2)CC1 | 10.1021/jm200884j | |||
| CHEMBL1910849 | 67950 | None | 0 | Human | Functional | pKi | = | 9.6 | 9.6 | - | 0 | ChEMBL | 456 | 9 | 1 | 3 | 5.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CCC(Oc2ccccc2)CC1 | 10.1021/jm200884j | |||
| 16065137 | 67951 | None | 0 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@@H](Oc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910850 | 67951 | None | 0 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@@H](Oc2cccc(O)c2)C1 | 10.1021/jm200884j | |||
| 54757544 | 67961 | None | 0 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 476 | 9 | 2 | 4 | 5.0 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@@H](Oc2cc(O)cc(F)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910860 | 67961 | None | 0 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 476 | 9 | 2 | 4 | 5.0 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@@H](Oc2cc(O)cc(F)c2)C1 | 10.1021/jm200884j | |||
| 16065405 | 67964 | None | 0 | Human | Functional | pKi | = | 9.2 | 9.2 | - | 0 | ChEMBL | 462 | 9 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)cc(F)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910863 | 67964 | None | 0 | Human | Functional | pKi | = | 9.2 | 9.2 | - | 0 | ChEMBL | 462 | 9 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)cc(F)c2)C1 | 10.1021/jm200884j | |||
| 16065541 | 67967 | None | 0 | Human | Functional | pKi | = | 9.2 | 9.2 | - | 0 | ChEMBL | 462 | 9 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)ccc2F)C1 | 10.1021/jm200884j | |||
| CHEMBL1910866 | 67967 | None | 0 | Human | Functional | pKi | = | 9.2 | 9.2 | - | 0 | ChEMBL | 462 | 9 | 2 | 4 | 4.6 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)ccc2F)C1 | 10.1021/jm200884j | |||
| 16065406 | 67959 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 470 | 9 | 2 | 4 | 5.0 | NC(=O)C(CCC1(N2CC(Oc3cccc(O)c3)C2)CCCC1)(c1ccccc1)c1ccccc1 | 10.1021/jm200884j | |||
| CHEMBL1910858 | 67959 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 470 | 9 | 2 | 4 | 5.0 | NC(=O)C(CCC1(N2CC(Oc3cccc(O)c3)C2)CCCC1)(c1ccccc1)c1ccccc1 | 10.1021/jm200884j | |||
| 54757543 | 67954 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccc(O)cc2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910853 | 67954 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 458 | 9 | 2 | 4 | 4.9 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccc(O)cc2)C1 | 10.1021/jm200884j | |||
| 16065136 | 67948 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 442 | 9 | 1 | 3 | 5.2 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@@H](Oc2ccccc2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910847 | 67948 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 442 | 9 | 1 | 3 | 5.2 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@@H](Oc2ccccc2)C1 | 10.1021/jm200884j | |||
| 16065404 | 67962 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.1 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2ccc(Cl)c(O)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910861 | 67962 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.1 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2ccc(Cl)c(O)c2)C1 | 10.1021/jm200884j | |||
| 126534204 | 138519 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 504 | 7 | 1 | 7 | 3.9 | Cn1c(SCCCN2CC3CCN(c4ccc(C(F)(F)F)cc4)C3C2)nnc1-c1cc[nH]c(=O)c1 | 10.1016/j.bmc.2016.02.031 | |||
| CHEMBL3774411 | 138519 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 504 | 7 | 1 | 7 | 3.9 | Cn1c(SCCCN2CC3CCN(c4ccc(C(F)(F)F)cc4)C3C2)nnc1-c1cc[nH]c(=O)c1 | 10.1016/j.bmc.2016.02.031 | |||
| 54757653 | 67956 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 444 | 9 | 2 | 4 | 4.5 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2ccccc2O)C1 | 10.1021/jm200884j | |||
| CHEMBL1910855 | 67956 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 444 | 9 | 2 | 4 | 4.5 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2ccccc2O)C1 | 10.1021/jm200884j | |||
| 121304590 | 145446 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 477 | 7 | 0 | 7 | 5.2 | Cc1ncoc1-c1nnc(SCCCN2CC[C@]3(C[C@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3913607 | 145446 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 477 | 7 | 0 | 7 | 5.2 | Cc1ncoc1-c1nnc(SCCCN2CC[C@]3(C[C@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 121304477 | 152260 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 487 | 7 | 0 | 6 | 5.6 | Cc1ncccc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3968272 | 152260 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 487 | 7 | 0 | 6 | 5.6 | Cc1ncccc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 126534771 | 138680 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 424 | 7 | 0 | 8 | 3.5 | Cc1ncoc1-c1nnc(SCCCN2CC3CCN(c4ccccc4)C3C2)n1C | 10.1016/j.bmc.2016.02.031 | |||
| CHEMBL3775589 | 138680 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 424 | 7 | 0 | 8 | 3.5 | Cc1ncoc1-c1nnc(SCCCN2CC3CCN(c4ccccc4)C3C2)n1C | 10.1016/j.bmc.2016.02.031 | |||
| 126533969 | 138555 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 427 | 7 | 0 | 7 | 3.4 | Cn1c(SCCCN2CC3CCN(c4ccccc4)C3C2)nnc1C1CCOCC1 | 10.1016/j.bmc.2016.02.031 | |||
| CHEMBL3774649 | 138555 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 427 | 7 | 0 | 7 | 3.4 | Cn1c(SCCCN2CC3CCN(c4ccccc4)C3C2)nnc1C1CCOCC1 | 10.1016/j.bmc.2016.02.031 | |||
| 121304609 | 153050 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@H]3c3ccc(F)cc3C(F)(F)F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3975147 | 153050 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@H]3c3ccc(F)cc3C(F)(F)F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 121304654 | 148965 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 530 | 8 | 1 | 7 | 4.7 | Cc1nc(C(N)=O)ccc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3941520 | 148965 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 530 | 8 | 1 | 7 | 4.7 | Cc1nc(C(N)=O)ccc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 121304538 | 150093 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 516 | 8 | 1 | 7 | 4.4 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccc(C(N)=O)nc1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3950254 | 150093 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 516 | 8 | 1 | 7 | 4.4 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccc(C(N)=O)nc1 | 10.1021/acs.jmedchem.6b00972 | |||
| 54757542 | 67960 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 492 | 9 | 2 | 4 | 5.5 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccc(Cl)c(O)c2)C1 | 10.1021/jm200884j | |||
| CHEMBL1910859 | 67960 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 492 | 9 | 2 | 4 | 5.5 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](Oc2ccc(Cl)c(O)c2)C1 | 10.1021/jm200884j | |||
| 16065269 | 67955 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 472 | 9 | 2 | 4 | 5.3 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CCC(Oc2cccc(O)c2)CC1 | 10.1021/jm200884j | |||
| CHEMBL1910854 | 67955 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 472 | 9 | 2 | 4 | 5.3 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CCC(Oc2cccc(O)c2)CC1 | 10.1021/jm200884j | |||
| 54757332 | 67946 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 414 | 9 | 1 | 3 | 4.4 | NC(=O)C(CCCN1CC[C@H](Oc2ccccc2)C1)(c1ccccc1)c1ccccc1 | 10.1021/jm200884j | |||
| CHEMBL1910845 | 67946 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 414 | 9 | 1 | 3 | 4.4 | NC(=O)C(CCCN1CC[C@H](Oc2ccccc2)C1)(c1ccccc1)c1ccccc1 | 10.1021/jm200884j | |||
| 121304458 | 154078 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 409 | 7 | 0 | 7 | 4.1 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@H]3c3ccccc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3983937 | 154078 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 409 | 7 | 0 | 7 | 4.1 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@H]3c3ccccc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 121304867 | 154288 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@]3(C[C@H]3c3ccc(F)cc3C(F)(F)F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3985877 | 154288 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@]3(C[C@H]3c3ccc(F)cc3C(F)(F)F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 126534291 | 138628 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 488 | 7 | 0 | 7 | 4.6 | Cn1c(SCCCN2CC3CCN(c4ccccc4C(F)(F)F)C3C2)nnc1-c1cccnc1 | 10.1016/j.bmc.2016.02.031 | |||
| CHEMBL3775197 | 138628 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 488 | 7 | 0 | 7 | 4.6 | Cn1c(SCCCN2CC3CCN(c4ccccc4C(F)(F)F)C3C2)nnc1-c1cccnc1 | 10.1016/j.bmc.2016.02.031 | |||
| 121304598 | 145334 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 535 | 8 | 1 | 6 | 5.4 | CC(=O)NC1CCC(c2nnc(SCCCN3CC[C@]4(C[C@@H]4c4ccc(C(F)(F)F)cc4)C3)n2C)CC1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3912801 | 145334 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 535 | 8 | 1 | 6 | 5.4 | CC(=O)NC1CCC(c2nnc(SCCCN3CC[C@]4(C[C@@H]4c4ccc(C(F)(F)F)cc4)C3)n2C)CC1 | 10.1021/acs.jmedchem.6b00972 | |||
| 126534373 | 138633 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 510 | 7 | 0 | 8 | 4.6 | Cc1ncoc1-c1nnc(SCCCN2CC3CCN(c4ccc(C(F)(F)F)cc4F)C3C2)n1C | 10.1016/j.bmc.2016.02.031 | |||
| CHEMBL3775226 | 138633 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 510 | 7 | 0 | 8 | 4.6 | Cc1ncoc1-c1nnc(SCCCN2CC3CCN(c4ccc(C(F)(F)F)cc4F)C3C2)n1C | 10.1016/j.bmc.2016.02.031 | |||
| 121304464 | 144432 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 480 | 7 | 0 | 8 | 4.7 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1csnn1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3905582 | 144432 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 480 | 7 | 0 | 8 | 4.7 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1csnn1 | 10.1021/acs.jmedchem.6b00972 | |||
| 121304485 | 148263 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 477 | 7 | 0 | 7 | 5.2 | Cc1ncoc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3935692 | 148263 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 477 | 7 | 0 | 7 | 5.2 | Cc1ncoc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 10125445 | 76055 | None | 0 | Human | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 286 | 4 | 1 | 4 | 3.6 | Cc1c(NC2CC2)nc(C2CC2)nc1N1CCCCCC1 | 10.1021/jm800582j | |||
| CHEMBL205654 | 76055 | None | 0 | Human | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 286 | 4 | 1 | 4 | 3.6 | Cc1c(NC2CC2)nc(C2CC2)nc1N1CCCCCC1 | 10.1021/jm800582j | |||
| 121304452 | 149006 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 539 | 8 | 0 | 7 | 6.5 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccc(-c2ncco2)cc1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3941818 | 149006 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 539 | 8 | 0 | 7 | 6.5 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccc(-c2ncco2)cc1 | 10.1021/acs.jmedchem.6b00972 | |||
| 121304574 | 143120 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 503 | 7 | 0 | 7 | 4.6 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccn(C)c(=O)c1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3894853 | 143120 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 503 | 7 | 0 | 7 | 4.6 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccn(C)c(=O)c1 | 10.1021/acs.jmedchem.6b00972 | |||
| 121304441 | 152473 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 515 | 8 | 1 | 6 | 5.0 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1cccc(C(N)=O)c1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3970323 | 152473 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 515 | 8 | 1 | 6 | 5.0 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1cccc(C(N)=O)c1 | 10.1021/acs.jmedchem.6b00972 | |||
| 121304408 | 143641 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 515 | 8 | 1 | 6 | 5.0 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccc(C(N)=O)cc1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3899125 | 143641 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 515 | 8 | 1 | 6 | 5.0 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1-c1ccc(C(N)=O)cc1 | 10.1021/acs.jmedchem.6b00972 | |||
| 121304649 | 150733 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@H]3c3ccc(C(F)(F)F)cc3F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3955505 | 150733 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@H]3c3ccc(C(F)(F)F)cc3F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 126535075 | 138566 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 518 | 7 | 0 | 8 | 3.9 | Cn1c(SCCCN2CC3CCN(c4ccc(C(F)(F)F)cc4)C3C2)nnc1-c1ccc(=O)n(C)c1 | 10.1016/j.bmc.2016.02.031 | |||
| CHEMBL3774769 | 138566 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 518 | 7 | 0 | 8 | 3.9 | Cn1c(SCCCN2CC3CCN(c4ccc(C(F)(F)F)cc4)C3C2)nnc1-c1ccc(=O)n(C)c1 | 10.1016/j.bmc.2016.02.031 | |||
| 121304424 | 143931 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3901587 | 143931 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 495 | 7 | 0 | 7 | 5.3 | Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3F)C2)n1C | 10.1021/acs.jmedchem.6b00972 | |||
| 134150754 | 151818 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 489 | 7 | 0 | 6 | 4.6 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1=CCC(=O)N=C1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3964512 | 151818 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 489 | 7 | 0 | 6 | 4.6 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1=CCC(=O)N=C1 | 10.1021/acs.jmedchem.6b00972 | |||
| 134134147 | 143461 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 489 | 7 | 0 | 6 | 4.6 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1=CC=NC(=O)C1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3897772 | 143461 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 489 | 7 | 0 | 6 | 4.6 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1=CC=NC(=O)C1 | 10.1021/acs.jmedchem.6b00972 | |||
| 134150637 | 151654 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 522 | 7 | 1 | 6 | 4.5 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1CCN(C(N)=O)CC1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3963243 | 151654 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 522 | 7 | 1 | 6 | 4.5 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1CCN(C(N)=O)CC1 | 10.1021/acs.jmedchem.6b00972 | |||
| 54757766 | 67965 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 512 | 9 | 2 | 4 | 5.8 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)c(Cl)cc2Cl)C1 | 10.1021/jm200884j | |||
| CHEMBL1910864 | 67965 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 512 | 9 | 2 | 4 | 5.8 | CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cc(O)c(Cl)cc2Cl)C1 | 10.1021/jm200884j | |||
| 483747 | 105465 | None | 1 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 503 | 4 | 0 | 5 | 4.9 | Cc1ncnc(C)c1C(=O)N1CCC(C)(N2CCN([C@@H](C)c3ccc(C(F)(F)F)cc3)[C@@H](C)C2)CC1 | 10.1021/jm0304515 | |||
| CHEMBL311795 | 105465 | None | 1 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 503 | 4 | 0 | 5 | 4.9 | Cc1ncnc(C)c1C(=O)N1CCC(C)(N2CCN([C@@H](C)c3ccc(C(F)(F)F)cc3)[C@@H](C)C2)CC1 | 10.1021/jm0304515 | |||
| 121304500 | 149842 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 480 | 7 | 0 | 6 | 5.1 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1CCOCC1 | 10.1021/acs.jmedchem.6b00972 | |||
| CHEMBL3948167 | 149842 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 480 | 7 | 0 | 6 | 5.1 | Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)nnc1C1CCOCC1 | 10.1021/acs.jmedchem.6b00972 | |||
| 3009352 | 96692 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 517 | 5 | 0 | 5 | 5.3 | CC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCN(C2(C)CCN(C(=O)c3c(C)ncnc3C)CC2)C[C@@H]1C | 10.1021/jm0304515 | |||
| CHEMBL263555 | 96692 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 517 | 5 | 0 | 5 | 5.3 | CC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCN(C2(C)CCN(C(=O)c3c(C)ncnc3C)CC2)C[C@@H]1C | 10.1021/jm0304515 | |||
| 23724781 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| 23724781.0 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| 316 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| 317 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| 71183 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| CHEMBL1354199 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| CHEMBL3140030 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| CHEMBL376897 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| DB00462 | 2835 | None | 13 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | 2 | 8 | Drug Central | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | None | |||
| 1979 | 77355 | None | 47 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -1 | 7 | Drug Central | 169 | 1 | 0 | 3 | 0.6 | CC(=O)OC1CN2CCC1CC2 | None | |||
| CHEMBL20835 | 77355 | None | 47 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -1 | 7 | Drug Central | 169 | 1 | 0 | 3 | 0.6 | CC(=O)OC1CN2CCC1CC2 | None | |||
| 187 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 8 | Drug Central | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | None | |||
| 187.0 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 8 | Drug Central | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | None | |||
| 294 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 8 | Drug Central | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | None | |||
| 65 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 8 | Drug Central | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | None | |||
| 8593 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 8 | Drug Central | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | None | |||
| CHEMBL667 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 8 | Drug Central | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | None | |||
| DB03128 | 255 | None | 24 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 8 | Drug Central | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | None | |||
| 1726 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | -5 | 8 | Drug Central | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | None | |||
| 1993 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | -5 | 8 | Drug Central | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | None | |||
| 1993.0 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | -5 | 8 | Drug Central | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | None | |||
| 7438 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | -5 | 8 | Drug Central | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | None | |||
| CHEMBL978 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | -5 | 8 | Drug Central | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | None | |||
| DB06709 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | -5 | 8 | Drug Central | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | None | |||
| 2166 | 3123 | None | 33 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 10 | Drug Central | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | None | |||
| 305 | 3123 | None | 33 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 10 | Drug Central | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | None | |||
| 5910 | 3123 | None | 33 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 10 | Drug Central | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | None | |||
| 5910.0 | 3123 | None | 33 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 10 | Drug Central | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | None | |||
| CHEMBL550 | 3123 | None | 33 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 10 | Drug Central | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | None | |||
| DB01085 | 3123 | None | 33 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -1 | 10 | Drug Central | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | None | |||
| 123603 | 883 | None | 21 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 199 | 0 | 0 | 3 | 1.6 | CC1SCC2(O1)CN1CCC2CC1 | None | |||
| 2684 | 883 | None | 21 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 199 | 0 | 0 | 3 | 1.6 | CC1SCC2(O1)CN1CCC2CC1 | None | |||
| 2684.0 | 883 | None | 21 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 199 | 0 | 0 | 3 | 1.6 | CC1SCC2(O1)CN1CCC2CC1 | None | |||
| 584 | 883 | None | 21 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 199 | 0 | 0 | 3 | 1.6 | CC1SCC2(O1)CN1CCC2CC1 | None | |||
| 9658 | 883 | None | 21 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 199 | 0 | 0 | 3 | 1.6 | CC1SCC2(O1)CN1CCC2CC1 | None | |||
| CHEMBL168815 | 883 | None | 21 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 199 | 0 | 0 | 3 | 1.6 | CC1SCC2(O1)CN1CCC2CC1 | None | |||
| DB00185 | 883 | None | 21 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 199 | 0 | 0 | 3 | 1.6 | CC1SCC2(O1)CN1CCC2CC1 | None | |||
| 5831 | 218453 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 182 | 3 | 1 | 2 | -3.2 | C[N+](C)(C)CCOC(=O)N.[Cl-] | None | |||
| 5831.0 | 218453 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 182 | 3 | 1 | 2 | -3.2 | C[N+](C)(C)CCOC(=O)N.[Cl-] | None | |||
| CHEMBL965 | 218453 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 182 | 3 | 1 | 2 | -3.2 | C[N+](C)(C)CCOC(=O)N.[Cl-] | None | |||
| DB00411 | 218453 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 5 | Drug Central | 182 | 3 | 1 | 2 | -3.2 | C[N+](C)(C)CCOC(=O)N.[Cl-] | None | |||
| 3008304 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | Guide to Pharmacology | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 19438238 | |||
| 7632 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | Guide to Pharmacology | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 19438238 | |||
| CHEMBL523685 | 4023 | None | 46 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -1 | 4 | Guide to Pharmacology | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 19438238 | |||
| 1726 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 7620715 | |||
| 1726 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 9622546 | |||
| 1993 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 7620715 | |||
| 1993 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 9622546 | |||
| 1993.0 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 7620715 | |||
| 1993.0 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 9622546 | |||
| 7438 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 7620715 | |||
| 7438 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 9622546 | |||
| CHEMBL978 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 7620715 | |||
| CHEMBL978 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 9622546 | |||
| DB06709 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 7620715 | |||
| DB06709 | 2497 | None | 8 | Rat | Functional | pEC50 | = | 6.9 | 6.9 | -5 | 8 | Guide to Pharmacology | 160 | 3 | 0 | 2 | 0.6 | CC(C[N+](C)(C)C)OC(=O)C | 9622546 | |||
| 288 | 252 | None | 0 | Human | Functional | pEC50 | None | 5.1 | 5.1 | -3 | 5 | Guide to Pharmacology | 170 | 1 | 1 | 2 | -0.8 | CC(=O)O[C@H]1C[NH+]2CCC1CC2 | 8968358 | |||
| 6979053 | 252 | None | 0 | Human | Functional | pEC50 | None | 5.1 | 5.1 | -3 | 5 | Guide to Pharmacology | 170 | 1 | 1 | 2 | -0.8 | CC(=O)O[C@H]1C[NH+]2CCC1CC2 | 8968358 | |||
| 286 | 251 | None | 0 | Human | Functional | pEC50 | None | 5.7 | 5.7 | -3 | 5 | Guide to Pharmacology | 170 | 1 | 1 | 2 | -0.8 | CC(=O)O[C@@H]1C[NH+]2CCC1CC2 | 8968358 | |||
| 6954180 | 251 | None | 0 | Human | Functional | pEC50 | None | 5.7 | 5.7 | -3 | 5 | Guide to Pharmacology | 170 | 1 | 1 | 2 | -0.8 | CC(=O)O[C@@H]1C[NH+]2CCC1CC2 | 8968358 | |||
| 20824 | 220186 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 1 | 2 | Drug Central | 378 | 5 | 3 | 5 | 0.5 | CC1(C)S[C@@H]2[C@H](NC(=O)C(C(O)=O)C3=CC=CC=C3)C(=O)N2[C@H]1C(O)=O | None | |||
| 18381 | 220193 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -1 | 4 | Drug Central | 469 | 4 | 2 | 6 | 3.2 | CC1=C(C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(O)=O)C(=NO1)C1=C(Cl)C=CC=C1Cl | None | |||
| 11693 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| 11693 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| 3494 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| 3494 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| 3494.0 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| 3494.0 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| 4302 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| 4302 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| 7459 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| 7459 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| 9933193 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| 9933193 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| 9933193.0 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| 9933193.0 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| CHEMBL1201335 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| CHEMBL1201335 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| DB00986 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 21036043 | |||
| DB00986 | 1827 | None | 12 | Human | Functional | pIC50 | = | 9.7 | 9.7 | 1 | 7 | Guide to Pharmacology | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 22854200 | |||
| 154059 | 3637 | None | 37 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | Guide to Pharmacology | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 21524581 | |||
| 154059.0 | 3637 | None | 37 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | Guide to Pharmacology | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 21524581 | |||
| 2457 | 3637 | None | 37 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | Guide to Pharmacology | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 21524581 | |||
| 7483 | 3637 | None | 37 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | Guide to Pharmacology | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 21524581 | |||
| CHEMBL1734 | 3637 | None | 37 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | Guide to Pharmacology | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 21524581 | |||
| DB01591 | 3637 | None | 37 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | Guide to Pharmacology | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 21524581 | |||
| 6433090 | 220228 | None | 0 | Human | Functional | pKb | = | 8.0 | 8.0 | -1 | 2 | Drug Central | 319 | 6 | 1 | 3 | 3.1 | CC1=NC=CN1CCC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1 | None | |||
| 6433090.0 | 220228 | None | 0 | Human | Functional | pKb | = | 8.0 | 8.0 | -1 | 2 | Drug Central | 319 | 6 | 1 | 3 | 3.1 | CC1=NC=CN1CCC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1 | None | |||
| CHEMBL53366 | 220228 | None | 0 | Human | Functional | pKb | = | 8.0 | 8.0 | -1 | 2 | Drug Central | 319 | 6 | 1 | 3 | 3.1 | CC1=NC=CN1CCC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1 | None | |||
| DB09262 | 220228 | None | 0 | Human | Functional | pKb | = | 8.0 | 8.0 | -1 | 2 | Drug Central | 319 | 6 | 1 | 3 | 3.1 | CC1=NC=CN1CCC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1 | None | |||
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Activity | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
Reference ligand |
Vendors |
Species |
Assay Type |
Activity Type |
Activity Relation |
Activity Value |
p-value (-log) |
Fold selectivity |
Tested GPCRs |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
|
| 367 | 3824 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | |||
| 5487427.0 | 3824 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | None | 10 | Human | Binding | pAC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | |||
| 25897919 | 55668 | None | 12 | Human | Binding | pAC50 | = | 8.8 | 8.8 | -1 | 8 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| 657308 | 55668 | None | 12 | Human | Binding | pAC50 | = | 8.8 | 8.8 | -1 | 8 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| 657309 | 55668 | None | 12 | Human | Binding | pAC50 | = | 8.8 | 8.8 | -1 | 8 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1621597 | 55668 | None | 12 | Human | Binding | pAC50 | = | 8.8 | 8.8 | -1 | 8 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| DB00332 | 55668 | None | 12 | Human | Binding | pAC50 | = | 8.8 | 8.8 | -1 | 8 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 | 10.1038/s41467-023-40064-9 | |||
| 11693 | 1827 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | 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 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 3494.0 | 1827 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | 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 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | 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 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 9933193 | 1827 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 9933193.0 | 1827 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | 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 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | 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 | None | 12 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1038/s41467-023-40064-9 | |||
| 2784 | 952 | None | 9 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -6 | 3 | ChEMBL | 352 | 4 | 1 | 3 | 2.7 | O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 2784.0 | 952 | None | 9 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -6 | 3 | ChEMBL | 352 | 4 | 1 | 3 | 2.7 | O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 351 | 952 | None | 9 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -6 | 3 | ChEMBL | 352 | 4 | 1 | 3 | 2.7 | O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 366 | 952 | None | 9 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -6 | 3 | ChEMBL | 352 | 4 | 1 | 3 | 2.7 | O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 676 | 952 | None | 9 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -6 | 3 | ChEMBL | 352 | 4 | 1 | 3 | 2.7 | O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL620 | 952 | None | 9 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -6 | 3 | ChEMBL | 352 | 4 | 1 | 3 | 2.7 | O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| DB00771 | 952 | None | 9 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -6 | 3 | ChEMBL | 352 | 4 | 1 | 3 | 2.7 | O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 3000322 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| 3000322.0 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| 330 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL569713 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| DB00747 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.7 | 8.7 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| 2247 | 505 | None | 55 | Human | Binding | pAC50 | = | 5 | 5.0 | -19 | 41 | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 249 | 505 | None | 55 | Human | Binding | pAC50 | = | 5 | 5.0 | -19 | 41 | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2603 | 505 | None | 55 | Human | Binding | pAC50 | = | 5 | 5.0 | -19 | 41 | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL296419 | 505 | None | 55 | Human | Binding | pAC50 | = | 5 | 5.0 | -19 | 41 | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00637 | 505 | None | 55 | Human | Binding | pAC50 | = | 5 | 5.0 | -19 | 41 | ChEMBL | 458 | 8 | 1 | 5 | 5.4 | COc1ccc(cc1)CCN1CCC(CC1)Nc1nc2c(n1Cc1ccc(cc1)F)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 3658 | 4107 | None | 38 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 8 | ChEMBL | 244 | 2 | 1 | 2 | 3.1 | Cc1cc(cc(c1CC1=NCCN1)C)C(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| 517 | 4107 | None | 38 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 8 | ChEMBL | 244 | 2 | 1 | 2 | 3.1 | Cc1cc(cc(c1CC1=NCCN1)C)C(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| 5709 | 4107 | None | 38 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 8 | ChEMBL | 244 | 2 | 1 | 2 | 3.1 | Cc1cc(cc(c1CC1=NCCN1)C)C(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| 5709.0 | 4107 | None | 38 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 8 | ChEMBL | 244 | 2 | 1 | 2 | 3.1 | Cc1cc(cc(c1CC1=NCCN1)C)C(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL312448 | 4107 | None | 38 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 8 | ChEMBL | 244 | 2 | 1 | 2 | 3.1 | Cc1cc(cc(c1CC1=NCCN1)C)C(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| DB06694 | 4107 | None | 38 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 8 | ChEMBL | 244 | 2 | 1 | 2 | 3.1 | Cc1cc(cc(c1CC1=NCCN1)C)C(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| 135398735 | 137055 | None | 20 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 0 | 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 | 137055 | None | 20 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 0 | 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 | 137055 | None | 20 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 0 | 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 | |||
| 2136 | 3095 | None | 24 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 5 | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 4768 | 3095 | None | 24 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 5 | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 4768.0 | 3095 | None | 24 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 5 | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 7268 | 3095 | None | 24 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 5 | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL753 | 3095 | None | 24 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 5 | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00925 | 3095 | None | 24 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 5 | ChEMBL | 303 | 8 | 0 | 2 | 4.2 | ClCCN(C(COc1ccccc1)C)Cc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 5318 | 15583 | None | 40 | Human | Binding | pAC50 | = | 5.0 | 5.0 | -1 | 13 | ChEMBL | 396 | 6 | 0 | 3 | 6.5 | Clc1ccc(CSC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1200348 | 15583 | None | 40 | Human | Binding | pAC50 | = | 5.0 | 5.0 | -1 | 13 | ChEMBL | 396 | 6 | 0 | 3 | 6.5 | Clc1ccc(CSC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1221 | 15583 | None | 40 | Human | Binding | pAC50 | = | 5.0 | 5.0 | -1 | 13 | ChEMBL | 396 | 6 | 0 | 3 | 6.5 | Clc1ccc(CSC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 216416 | 111644 | None | 40 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | 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 | 111644 | None | 40 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 413 | 6 | 1 | 3 | 5.7 | Oc1ccc2c(c1)CC[C@H](c1ccccc1)[C@@H]2c1ccc(OCCN2CCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 68617 | 207985 | None | 33 | Human | Binding | pAC50 | = | 5.0 | 5.0 | -12 | 25 | 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 | 207985 | None | 33 | Human | Binding | pAC50 | = | 5.0 | 5.0 | -12 | 25 | 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 | 207985 | None | 33 | Human | Binding | pAC50 | = | 5.0 | 5.0 | -12 | 25 | 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 | |||
| 2131 | 57423 | None | 16 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 536 | 14 | 2 | 2 | 4.6 | CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)Cc1ccccc1Cl)Cc1ccccc1Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1652 | 57423 | None | 16 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 536 | 14 | 2 | 2 | 4.6 | CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)Cc1ccccc1Cl)Cc1ccccc1Cl | 10.1038/s41467-023-40064-9 | |||
| 23480 | 124157 | None | 21 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 281 | 5 | 1 | 1 | 5.0 | CC(CC(c1ccccc1)c1ccccc1)NC(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL363295 | 124157 | None | 21 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 281 | 5 | 1 | 1 | 5.0 | CC(CC(c1ccccc1)c1ccccc1)NC(C)(C)C | 10.1038/s41467-023-40064-9 | |||
| 3042 | 1414 | None | 26 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -1 | 15 | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| 3042.0 | 1414 | None | 26 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -1 | 15 | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| 355 | 1414 | None | 26 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -1 | 15 | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| 868 | 1414 | None | 26 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -1 | 15 | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1123 | 1414 | None | 26 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -1 | 15 | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| DB00804 | 1414 | None | 26 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -1 | 15 | ChEMBL | 309 | 7 | 0 | 3 | 4.4 | CCN(CCOC(=O)C1(CCCCC1)C1CCCCC1)CC | 10.1038/s41467-023-40064-9 | |||
| 26987 | 949 | None | 27 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -56 | 21 | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| 26987.0 | 949 | None | 27 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -56 | 21 | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| 6063 | 949 | None | 27 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -56 | 21 | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| 671 | 949 | None | 27 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -56 | 21 | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1626 | 949 | None | 27 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -56 | 21 | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| DB00283 | 949 | None | 27 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -56 | 21 | ChEMBL | 343 | 6 | 0 | 2 | 5.1 | Clc1ccc(cc1)[C@@](c1ccccc1)(OCC[C@H]1CCCN1C)C | 10.1038/s41467-023-40064-9 | |||
| 2284 | 3182 | None | 26 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -10 | 28 | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 4926 | 3182 | None | 26 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -10 | 28 | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 7281 | 3182 | None | 26 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -10 | 28 | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL564 | 3182 | None | 26 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -10 | 28 | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00420 | 3182 | None | 26 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -10 | 28 | ChEMBL | 284 | 4 | 0 | 3 | 4.2 | CN(CCCN1c2ccccc2Sc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 16363 | 596 | None | 33 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 6 | ChEMBL | 381 | 6 | 1 | 4 | 3.8 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 16363.0 | 596 | None | 33 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 6 | 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 | None | 33 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 6 | 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 | None | 33 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 6 | 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 | None | 33 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 6 | 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 | None | 33 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 6 | ChEMBL | 381 | 6 | 1 | 4 | 3.8 | Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2274 | 3173 | None | 38 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -21 | 32 | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 4917 | 3173 | None | 38 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -21 | 32 | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 4917.0 | 3173 | None | 38 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -21 | 32 | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 7279 | 3173 | None | 38 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -21 | 32 | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL728 | 3173 | None | 38 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -21 | 32 | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| DB00433 | 3173 | None | 38 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -21 | 32 | ChEMBL | 373 | 4 | 0 | 4 | 4.6 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 2448 | 99377 | None | 50 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -134 | 17 | ChEMBL | 419 | 6 | 1 | 3 | 4.5 | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2448.0 | 99377 | None | 50 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -134 | 17 | 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 | 99377 | None | 50 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -134 | 17 | ChEMBL | 419 | 6 | 1 | 3 | 4.5 | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 | 10.1038/s41467-023-40064-9 | |||
| DB12401 | 99377 | None | 50 | Human | Binding | pAC50 | = | 4.9 | 4.9 | -134 | 17 | ChEMBL | 419 | 6 | 1 | 3 | 4.5 | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 | 10.1038/s41467-023-40064-9 | |||
| 135564886 | 14499 | None | 5 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 14499 | None | 5 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 14499 | None | 5 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 14499 | None | 5 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 14499 | None | 5 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 14499 | None | 5 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | |||
| 41684 | 31229 | None | 62 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 307 | 4 | 1 | 7 | 2.2 | CC(=O)Oc1ccccc1C(=O)Nc1ncc([N+](=O)[O-])s1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1401 | 31229 | None | 62 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 307 | 4 | 1 | 7 | 2.2 | CC(=O)Oc1ccccc1C(=O)Nc1ncc([N+](=O)[O-])s1 | 10.1038/s41467-023-40064-9 | |||
| 30323 | 62505 | None | 35 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 62505 | None | 35 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 62505 | None | 35 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | |||
| 68867 | 78202 | None | 29 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | |||
| 68867.0 | 78202 | None | 29 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 78202 | None | 29 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | |||
| DB08810 | 78202 | None | 29 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | |||
| 3926 | 209699 | None | 30 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 209699 | None | 30 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | |||
| 4919 | 208692 | None | 16 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -2 | 9 | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 4919.0 | 208692 | None | 16 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -2 | 9 | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL86715 | 208692 | None | 16 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -2 | 9 | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| DB00387 | 208692 | None | 16 | Human | Binding | pAC50 | = | 6.9 | 6.9 | -2 | 9 | ChEMBL | 287 | 5 | 1 | 2 | 3.9 | OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 3121 | 7887 | None | 64 | Human | Binding | pAC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 144 | 5 | 1 | 1 | 2.3 | CCCC(CCC)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL109 | 7887 | None | 64 | Human | Binding | pAC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 144 | 5 | 1 | 1 | 2.3 | CCCC(CCC)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL433 | 7887 | None | 64 | Human | Binding | pAC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 144 | 5 | 1 | 1 | 2.3 | CCCC(CCC)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 2540 | 4402 | None | 68 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 4 | 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 | 4402 | None | 68 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 4 | 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 | |||
| 1613 | 2348 | None | 42 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -15 | 44 | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 205 | 2348 | None | 42 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -15 | 44 | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 3964 | 2348 | None | 42 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -15 | 44 | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 3964.0 | 2348 | None | 42 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -15 | 44 | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL831 | 2348 | None | 42 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -15 | 44 | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| DB00408 | 2348 | None | 42 | Human | Binding | pAC50 | = | 5.9 | 5.9 | -15 | 44 | ChEMBL | 327 | 0 | 0 | 4 | 3.8 | CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2 | 10.1038/s41467-023-40064-9 | |||
| 21772 | 78430 | None | 26 | Human | Binding | pAC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 293 | 4 | 0 | 1 | 4.5 | CC(CC1c2ccccc2CCc2ccccc21)CN(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2110816 | 78430 | None | 26 | Human | Binding | pAC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 293 | 4 | 0 | 1 | 4.5 | CC(CC1c2ccccc2CCc2ccccc21)CN(C)C | 10.1038/s41467-023-40064-9 | |||
| 156419 | 938 | None | 48 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 15 | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 156419.0 | 938 | None | 48 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 15 | 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 | None | 48 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 15 | 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 | None | 48 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 15 | 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 | None | 48 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 15 | 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 | None | 48 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 15 | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 42890 | 9427 | None | 34 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | 9427 | None | 34 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 0 | 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 | |||
| 4011 | 82440 | None | 34 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -14 | 23 | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL21731 | 82440 | None | 34 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -14 | 23 | ChEMBL | 277 | 4 | 1 | 1 | 4.2 | CNCCCC12CCC(c3ccccc31)c1ccccc12 | 10.1038/s41467-023-40064-9 | |||
| 4413 | 98126 | None | 43 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 347 | 4 | 5 | 4 | 2.6 | N=C(N)Nc1ccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL273264 | 98126 | None | 43 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 347 | 4 | 5 | 4 | 2.6 | N=C(N)Nc1ccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2726 | 919 | None | 48 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -18 | 72 | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 2726.0 | 919 | None | 48 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -18 | 72 | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 621 | 919 | None | 48 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -18 | 72 | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 83 | 919 | None | 48 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -18 | 72 | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL71 | 919 | None | 48 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -18 | 72 | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00477 | 919 | None | 48 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -18 | 72 | ChEMBL | 318 | 4 | 0 | 3 | 4.9 | CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 10100 | 15300 | None | 4 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 339 | 8 | 0 | 3 | 4.3 | CCC(=O)O[C@](Cc1ccccc1)(c1ccccc1)[C@H](C)CN(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1213351 | 15300 | None | 4 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 339 | 8 | 0 | 3 | 4.3 | CCC(=O)O[C@](Cc1ccccc1)(c1ccccc1)[C@H](C)CN(C)C | 10.1038/s41467-023-40064-9 | |||
| 1549120 | 198942 | None | 55 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | 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 | 198942 | None | 55 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | 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 | |||
| 5329102 | 194838 | None | 50 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 0 | 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 | 194838 | None | 50 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 0 | 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 | |||
| 2398 | 954 | None | 43 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -1 | 28 | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 2801 | 954 | None | 43 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -1 | 28 | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 2801.0 | 954 | None | 43 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -1 | 28 | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 701 | 954 | None | 43 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -1 | 28 | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL415 | 954 | None | 43 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -1 | 28 | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| DB01242 | 954 | None | 43 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -1 | 28 | ChEMBL | 314 | 4 | 0 | 2 | 4.5 | CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 1164 | 1630 | None | 10 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 12 | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 1626 | 1630 | None | 10 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 12 | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3345 | 1630 | None | 10 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 12 | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3345.0 | 1630 | None | 10 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 12 | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL596 | 1630 | None | 10 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 12 | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00813 | 1630 | None | 10 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 12 | ChEMBL | 336 | 6 | 0 | 2 | 4.1 | CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 72093 | 35070 | None | 5 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 0 | 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 | 35070 | None | 5 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 0 | 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 | 35070 | None | 5 | Human | Binding | pAC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 483 | 16 | 1 | 4 | 6.3 | CCCCCCCCOc1ccccc1C(=O)Nc1ccc(C(=O)OCC[N+](C)(CC)CC)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2351 | 4301 | None | 35 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 366 | 10 | 0 | 3 | 4.8 | CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1008 | 4301 | None | 35 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 366 | 10 | 0 | 3 | 4.8 | CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1257078 | 4301 | None | 35 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 366 | 10 | 0 | 3 | 4.8 | CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1 | 10.1038/s41467-023-40064-9 | |||
| 3826 | 178897 | None | 57 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 255 | 3 | 1 | 3 | 2.3 | O=C(c1ccccc1)c1ccc2n1CCC2C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL469 | 178897 | None | 57 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 255 | 3 | 1 | 3 | 2.3 | O=C(c1ccccc1)c1ccc2n1CCC2C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 8612 | 11264 | None | 26 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 270 | 6 | 1 | 4 | 2.4 | CCN(CC)CCOC(=O)c1ccc(N)cc1Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1179047 | 11264 | None | 26 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 270 | 6 | 1 | 4 | 2.4 | CCN(CC)CCOC(=O)c1ccc(N)cc1Cl | 10.1038/s41467-023-40064-9 | |||
| 9429 | 204590 | None | 44 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 5 | ChEMBL | 446 | 6 | 0 | 6 | 3.2 | CN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 9429.0 | 204590 | None | 44 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 5 | ChEMBL | 446 | 6 | 0 | 6 | 3.2 | CN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL609109 | 204590 | None | 44 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 5 | ChEMBL | 446 | 6 | 0 | 6 | 3.2 | CN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB01622 | 204590 | None | 44 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 5 | ChEMBL | 446 | 6 | 0 | 6 | 3.2 | CN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 319 | 1324 | None | 32 | Human | Binding | pAC50 | = | 7.8 | 7.8 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1038/s41467-023-40064-9 | |||
| 321 | 1324 | None | 32 | Human | Binding | pAC50 | = | 7.8 | 7.8 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1038/s41467-023-40064-9 | |||
| 444031 | 1324 | None | 32 | Human | Binding | pAC50 | = | 7.8 | 7.8 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1038/s41467-023-40064-9 | |||
| 444031.0 | 1324 | None | 32 | Human | Binding | pAC50 | = | 7.8 | 7.8 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1038/s41467-023-40064-9 | |||
| 784 | 1324 | None | 32 | Human | Binding | pAC50 | = | 7.8 | 7.8 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1346 | 1324 | None | 32 | Human | Binding | pAC50 | = | 7.8 | 7.8 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1038/s41467-023-40064-9 | |||
| DB00496 | 1324 | None | 32 | Human | Binding | pAC50 | = | 7.8 | 7.8 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1038/s41467-023-40064-9 | |||
| 1530 | 2182 | None | 36 | Human | Binding | pAC50 | = | 7.8 | 7.8 | -147 | 24 | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1038/s41467-023-40064-9 | |||
| 3827 | 2182 | None | 36 | Human | Binding | pAC50 | = | 7.8 | 7.8 | -147 | 24 | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1038/s41467-023-40064-9 | |||
| 3827.0 | 2182 | None | 36 | Human | Binding | pAC50 | = | 7.8 | 7.8 | -147 | 24 | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1038/s41467-023-40064-9 | |||
| 7206 | 2182 | None | 36 | Human | Binding | pAC50 | = | 7.8 | 7.8 | -147 | 24 | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL534 | 2182 | None | 36 | Human | Binding | pAC50 | = | 7.8 | 7.8 | -147 | 24 | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB00920 | 2182 | None | 36 | Human | Binding | pAC50 | = | 7.8 | 7.8 | -147 | 24 | ChEMBL | 309 | 0 | 0 | 3 | 4.0 | CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1 | 10.1038/s41467-023-40064-9 | |||
| 4940 | 14476 | None | 26 | Human | Binding | pAC50 | = | 6.8 | 6.8 | - | 0 | 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 | 14476 | None | 26 | Human | Binding | pAC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 340 | 5 | 0 | 4 | 4.8 | CCC(=O)c1ccc2c(c1)N(CC(C)N(C)C)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| 1224 | 1432 | None | 51 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -5 | 13 | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 3100 | 1432 | None | 51 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -5 | 13 | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 3100.0 | 1432 | None | 51 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -5 | 13 | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 8980 | 1432 | None | 51 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -5 | 13 | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 916 | 1432 | None | 51 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -5 | 13 | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL657 | 1432 | None | 51 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -5 | 13 | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| DB01075 | 1432 | None | 51 | Human | Binding | pAC50 | = | 5.8 | 5.8 | -5 | 13 | ChEMBL | 255 | 6 | 0 | 2 | 3.4 | CN(CCOC(c1ccccc1)c1ccccc1)C | 10.1038/s41467-023-40064-9 | |||
| 5280453 | 208429 | None | 49 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 416 | 6 | 3 | 3 | 5.7 | C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]([C@H](C)CCCC(C)(C)O)CC[C@@H]23)C[C@@H](O)C[C@@H]1O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL846 | 208429 | None | 49 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 416 | 6 | 3 | 3 | 5.7 | C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]([C@H](C)CCCC(C)(C)O)CC[C@@H]23)C[C@@H](O)C[C@@H]1O | 10.1038/s41467-023-40064-9 | |||
| 1605 | 2342 | None | 72 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 4 | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| 3957 | 2342 | None | 72 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 4 | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| 3957.0 | 2342 | None | 72 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 4 | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| 7216 | 2342 | None | 72 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 4 | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL998 | 2342 | None | 72 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 4 | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB00455 | 2342 | None | 72 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 4 | ChEMBL | 382 | 1 | 0 | 3 | 4.9 | CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1 | 10.1038/s41467-023-40064-9 | |||
| 20628 | 96601 | None | 25 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 324 | 6 | 1 | 5 | 3.7 | CN(C)CCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL26291 | 96601 | None | 25 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 324 | 6 | 1 | 5 | 3.7 | CN(C)CCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12 | 10.1038/s41467-023-40064-9 | |||
| 4832 | 55436 | None | 14 | Human | Binding | pAC50 | = | 7.7 | 7.7 | - | 0 | 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 | 55436 | None | 14 | Human | Binding | pAC50 | = | 7.7 | 7.7 | - | 0 | 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 | |||
| 2705 | 3842 | None | 44 | Human | Binding | pAC50 | = | 7.7 | 7.7 | -1 | 11 | 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 | None | 44 | Human | Binding | pAC50 | = | 7.7 | 7.7 | -1 | 11 | 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 | None | 44 | Human | Binding | pAC50 | = | 7.7 | 7.7 | -1 | 11 | 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 | |||
| 443879.0 | 3842 | None | 44 | Human | Binding | pAC50 | = | 7.7 | 7.7 | -1 | 11 | 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 | None | 44 | Human | Binding | pAC50 | = | 7.7 | 7.7 | -1 | 11 | 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 | None | 44 | Human | Binding | pAC50 | = | 7.7 | 7.7 | -1 | 11 | 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 | |||
| 6127 | 14505 | None | 4 | Human | Binding | pAC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 278 | 2 | 0 | 0 | 4.4 | C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 6127.0 | 14505 | None | 4 | Human | Binding | pAC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 278 | 2 | 0 | 0 | 4.4 | C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201340 | 14505 | None | 4 | Human | Binding | pAC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 278 | 2 | 0 | 0 | 4.4 | C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB13720 | 14505 | None | 4 | Human | Binding | pAC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 278 | 2 | 0 | 0 | 4.4 | C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 135 | 2532 | None | 33 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -22 | 57 | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| 1796 | 2532 | None | 33 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -22 | 57 | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| 4184 | 2532 | None | 33 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -22 | 57 | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| 4184.0 | 2532 | None | 33 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -22 | 57 | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL6437 | 2532 | None | 33 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -22 | 57 | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| DB06148 | 2532 | None | 33 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -22 | 57 | ChEMBL | 264 | 0 | 0 | 2 | 3.1 | CN1CCN2C(C1)c1ccccc1Cc1c2cccc1 | 10.1038/s41467-023-40064-9 | |||
| 2200 | 3131 | None | 31 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -7 | 12 | ChEMBL | 351 | 2 | 1 | 5 | 1.6 | CN1CCN(CC1)CC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2 | 10.1038/s41467-023-40064-9 | |||
| 328 | 3131 | None | 31 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -7 | 12 | ChEMBL | 351 | 2 | 1 | 5 | 1.6 | CN1CCN(CC1)CC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2 | 10.1038/s41467-023-40064-9 | |||
| 4848 | 3131 | None | 31 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -7 | 12 | ChEMBL | 351 | 2 | 1 | 5 | 1.6 | CN1CCN(CC1)CC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2 | 10.1038/s41467-023-40064-9 | |||
| 4848.0 | 3131 | None | 31 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -7 | 12 | ChEMBL | 351 | 2 | 1 | 5 | 1.6 | CN1CCN(CC1)CC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL9967 | 3131 | None | 31 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -7 | 12 | ChEMBL | 351 | 2 | 1 | 5 | 1.6 | CN1CCN(CC1)CC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00670 | 3131 | None | 31 | Human | Binding | pAC50 | = | 5.7 | 5.7 | -7 | 12 | ChEMBL | 351 | 2 | 1 | 5 | 1.6 | CN1CCN(CC1)CC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2 | 10.1038/s41467-023-40064-9 | |||
| 11434515 | 261 | None | 6 | Human | Binding | pAC50 | = | 8.6 | 8.6 | -4 | 5 | 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 | |||
| 11434515.0 | 261 | None | 6 | Human | Binding | pAC50 | = | 8.6 | 8.6 | -4 | 5 | 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 | None | 6 | Human | Binding | pAC50 | = | 8.6 | 8.6 | -4 | 5 | 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 | None | 6 | Human | Binding | pAC50 | = | 8.6 | 8.6 | -4 | 5 | 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 | None | 6 | Human | Binding | pAC50 | = | 8.6 | 8.6 | -4 | 5 | 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 | None | 6 | Human | Binding | pAC50 | = | 8.6 | 8.6 | -4 | 5 | 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 | None | 6 | Human | Binding | pAC50 | = | 8.6 | 8.6 | -4 | 5 | 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 | |||
| 16351 | 102785 | None | 36 | Human | Binding | pAC50 | = | 5.7 | 5.7 | - | 5 | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 16351.0 | 102785 | None | 36 | Human | Binding | pAC50 | = | 5.7 | 5.7 | - | 5 | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL304902 | 102785 | None | 36 | Human | Binding | pAC50 | = | 5.7 | 5.7 | - | 5 | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB13256 | 102785 | None | 36 | Human | Binding | pAC50 | = | 5.7 | 5.7 | - | 5 | ChEMBL | 343 | 0 | 0 | 4 | 4.1 | CN1CCN(C2=Nc3ccccc3Sc3ccc(Cl)cc32)CC1 | 10.1038/s41467-023-40064-9 | |||
| 1210 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 1213 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 2725 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 33036 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 33036.0 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 4411 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 616 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 6976 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 716121 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201353 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1554789 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL505 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| DB01114 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| DB13679 | 918 | None | 42 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -125 | 20 | ChEMBL | 274 | 5 | 0 | 2 | 3.8 | CN(CC[C@H](c1ccccn1)c1ccc(cc1)Cl)C | 10.1038/s41467-023-40064-9 | |||
| 47472 | 19444 | None | 41 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 410 | 7 | 0 | 3 | 6.6 | Clc1ccc(CCC(Cn2ccnc2)Sc2c(Cl)cccc2Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1295 | 19444 | None | 41 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 410 | 7 | 0 | 3 | 6.6 | Clc1ccc(CCC(Cn2ccnc2)Sc2c(Cl)cccc2Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 51755 | 57422 | None | 40 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 454 | 8 | 0 | 4 | 7.3 | Clc1ccc(C(Cn2ccnc2)OCc2ccc(Sc3ccccc3)cc2)c(Cl)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1651990 | 57422 | None | 40 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 454 | 8 | 0 | 4 | 7.3 | Clc1ccc(C(Cn2ccnc2)OCc2ccc(Sc3ccccc3)cc2)c(Cl)c1 | 10.1038/s41467-023-40064-9 | |||
| 60753 | 194796 | None | 31 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 384 | 14 | 2 | 4 | 4.2 | CCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL533 | 194796 | None | 31 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 384 | 14 | 2 | 4 | 4.2 | CCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2435 | 3590 | None | 59 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -239 | 48 | 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 | None | 59 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -239 | 48 | 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 | None | 59 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -239 | 48 | 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 | None | 59 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -239 | 48 | 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 | None | 59 | Human | Binding | pAC50 | = | 4.7 | 4.7 | -239 | 48 | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1038/s41467-023-40064-9 | |||
| 4846 | 27995 | None | 38 | Human | Binding | pAC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 308 | 1 | 2 | 6 | 2.2 | O=C(O)c1cc(O)c2c3nc4ccccc4oc-3cc(=O)c2n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1372341 | 27995 | None | 38 | Human | Binding | pAC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 308 | 1 | 2 | 6 | 2.2 | O=C(O)c1cc(O)c2c3nc4ccccc4oc-3cc(=O)c2n1 | 10.1038/s41467-023-40064-9 | |||
| 3081361 | 93987 | None | 66 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | 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 | 93987 | None | 66 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 474 | 5 | 1 | 5 | 4.4 | COc1cc2/c(=N/c3ccc(Br)cc3F)nc[nH]c2cc1OCC1CCN(C)CC1 | 10.1038/s41467-023-40064-9 | |||
| 4976 | 206037 | None | 20 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -1 | 11 | ChEMBL | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL668 | 206037 | None | 20 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -1 | 11 | ChEMBL | 263 | 4 | 1 | 1 | 4.3 | CNCCCC1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 107771 | 120312 | None | 42 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | 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 | 120312 | None | 42 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 517 | 7 | 2 | 7 | 6.1 | COc1ccc2nc3cc(Cl)ccc3c(Nc3cc(CN4CCCC4)c(O)c(CN4CCCC4)c3)c2n1 | 10.1038/s41467-023-40064-9 | |||
| 5482 | 14425 | None | 55 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 386 | 6 | 0 | 4 | 5.9 | Clc1ccc(C(Cn2ccnc2)OCc2ccsc2Cl)c(Cl)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1200438 | 14425 | None | 55 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 386 | 6 | 0 | 4 | 5.9 | Clc1ccc(C(Cn2ccnc2)OCc2ccsc2Cl)c(Cl)c1 | 10.1038/s41467-023-40064-9 | |||
| 1201549 | 597 | None | 17 | Human | Binding | pAC50 | = | 7.6 | 7.6 | -1 | 20 | 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 | |||
| 1201549.0 | 597 | None | 17 | Human | Binding | pAC50 | = | 7.6 | 7.6 | -1 | 20 | 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 | None | 17 | Human | Binding | pAC50 | = | 7.6 | 7.6 | -1 | 20 | 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 | None | 17 | Human | Binding | pAC50 | = | 7.6 | 7.6 | -1 | 20 | 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 | None | 17 | Human | Binding | pAC50 | = | 7.6 | 7.6 | -1 | 20 | 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 | None | 17 | Human | Binding | pAC50 | = | 7.6 | 7.6 | -1 | 20 | 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 | None | 17 | Human | Binding | pAC50 | = | 7.6 | 7.6 | -1 | 20 | 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 | |||
| 180 | 401 | None | 38 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -23 | 39 | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 200 | 401 | None | 38 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -23 | 39 | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 2160 | 401 | None | 38 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -23 | 39 | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 2160.0 | 401 | None | 38 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -23 | 39 | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL629 | 401 | None | 38 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -23 | 39 | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00321 | 401 | None | 38 | Human | Binding | pAC50 | = | 6.6 | 6.6 | -23 | 39 | ChEMBL | 277 | 3 | 0 | 1 | 4.2 | CN(CCC=C1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 3191 | 102913 | None | 65 | Human | Binding | pAC50 | = | 5.6 | 5.6 | -6 | 25 | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 3191.0 | 102913 | None | 65 | Human | Binding | pAC50 | = | 5.6 | 5.6 | -6 | 25 | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL305660 | 102913 | None | 65 | Human | Binding | pAC50 | = | 5.6 | 5.6 | -6 | 25 | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| DB11742 | 102913 | None | 65 | Human | Binding | pAC50 | = | 5.6 | 5.6 | -6 | 25 | ChEMBL | 469 | 9 | 0 | 3 | 7.2 | CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2318 | 154946 | None | 18 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 351 | 7 | 1 | 3 | 4.1 | CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL400599 | 154946 | None | 18 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 351 | 7 | 1 | 3 | 4.1 | CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 4452 | 2762 | None | 13 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 18 | ChEMBL | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 983 | 2762 | None | 13 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 18 | ChEMBL | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL20734 | 2762 | None | 13 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 18 | ChEMBL | 387 | 6 | 2 | 4 | 3.8 | COc1cc(NC)c(cc1C(=O)NC1CCN(C1C)Cc1ccccc1)Cl | 10.1038/s41467-023-40064-9 | |||
| 6337614 | 13001 | None | 38 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 296 | 1 | 0 | 2 | 2.7 | O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1189679 | 13001 | None | 38 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 296 | 1 | 0 | 2 | 2.7 | O=C1c2cccc3c2[C@H](CCC3)CN1[C@@H]1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 127151 | 35339 | None | 12 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 10 | ChEMBL | 313 | 6 | 1 | 4 | 3.2 | CCOc1ccccc1OC(c1ccccc1)C1CNCCO1 | 10.1038/s41467-023-40064-9 | |||
| 3022645 | 35339 | None | 12 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 10 | ChEMBL | 313 | 6 | 1 | 4 | 3.2 | CCOc1ccccc1OC(c1ccccc1)C1CNCCO1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL14370 | 35339 | None | 12 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 10 | ChEMBL | 313 | 6 | 1 | 4 | 3.2 | CCOc1ccccc1OC(c1ccccc1)C1CNCCO1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2103737 | 78169 | None | 0 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 2995 | 206863 | None | 31 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -5 | 22 | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 2995.0 | 206863 | None | 31 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -5 | 22 | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1696 | 206863 | None | 31 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -5 | 22 | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL72 | 206863 | None | 31 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -5 | 22 | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| DB01151 | 206863 | None | 31 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -5 | 22 | ChEMBL | 266 | 4 | 1 | 2 | 3.5 | CNCCCN1c2ccccc2CCc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 656603 | 194645 | None | 3 | Human | Binding | pAC50 | = | 8.5 | 8.5 | - | 0 | 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 | |||
| CHEMBL5292015 | 194645 | None | 3 | Human | Binding | pAC50 | = | 8.5 | 8.5 | - | 0 | 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 | |||
| 191 | 403 | None | 60 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -37 | 28 | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 201 | 403 | None | 60 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -37 | 28 | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 2170 | 403 | None | 60 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -37 | 28 | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 2170.0 | 403 | None | 60 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -37 | 28 | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1113 | 403 | None | 60 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -37 | 28 | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| DB00543 | 403 | None | 60 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -37 | 28 | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 11980903 | 14498 | None | 13 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 0 | 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 | 14498 | None | 13 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 0 | 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 | 14498 | None | 13 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 0 | 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 | 14498 | None | 13 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 0 | 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 | |||
| 2286 | 3183 | None | 36 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -2 | 29 | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| 4927 | 3183 | None | 36 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -2 | 29 | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| 4927.0 | 3183 | None | 36 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -2 | 29 | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| 7282 | 3183 | None | 36 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -2 | 29 | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL643 | 3183 | None | 36 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -2 | 29 | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| DB01069 | 3183 | None | 36 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -2 | 29 | ChEMBL | 284 | 3 | 0 | 3 | 4.2 | CN(C(CN1c2ccccc2Sc2c1cccc2)C)C | 10.1038/s41467-023-40064-9 | |||
| 103 | 4153 | None | 44 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -144 | 53 | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 2875 | 4153 | None | 44 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -144 | 53 | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 5736 | 4153 | None | 44 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -144 | 53 | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL285802 | 4153 | None | 44 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -144 | 53 | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| DB09225 | 4153 | None | 44 | Human | Binding | pAC50 | = | 5.5 | 5.5 | -144 | 53 | ChEMBL | 331 | 4 | 0 | 3 | 4.9 | CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C | 10.1038/s41467-023-40064-9 | |||
| 2895 | 206050 | None | 27 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 2895.0 | 206050 | None | 27 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL669 | 206050 | None | 27 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| DB00924 | 206050 | None | 27 | Human | Binding | pAC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 275 | 3 | 0 | 1 | 4.6 | CN(C)CCC=C1c2ccccc2C=Cc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 1385580 | 29284 | None | 49 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 5 | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 4615 | 29284 | None | 49 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 5 | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 4615.0 | 29284 | None | 49 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 5 | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL13828 | 29284 | None | 49 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 5 | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| DB12877 | 29284 | None | 49 | Human | Binding | pAC50 | = | 5.5 | 5.5 | - | 5 | ChEMBL | 426 | 7 | 1 | 4 | 4.1 | O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 | 10.1038/s41467-023-40064-9 | |||
| 657202 | 12534 | None | 3 | Human | Binding | pAC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 282 | 6 | 0 | 2 | 3.5 | CCCC(CCC)C(=O)O[C@H]1C[C@H]2CC[C@@H](C1)[N+]2(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1186610 | 12534 | None | 3 | Human | Binding | pAC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 282 | 6 | 0 | 2 | 3.5 | CCCC(CCC)C(=O)O[C@H]1C[C@H]2CC[C@@H](C1)[N+]2(C)C | 10.1038/s41467-023-40064-9 | |||
| 4756 | 16656 | None | 34 | Human | Binding | pAC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 213 | 2 | 2 | 5 | 2.7 | Nc1ccc(/N=N/c2ccccc2)c(N)n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201022 | 16656 | None | 34 | Human | Binding | pAC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 213 | 2 | 2 | 5 | 2.7 | Nc1ccc(/N=N/c2ccccc2)c(N)n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1242 | 16656 | None | 34 | Human | Binding | pAC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 213 | 2 | 2 | 5 | 2.7 | Nc1ccc(/N=N/c2ccccc2)c(N)n1 | 10.1038/s41467-023-40064-9 | |||
| 135398745 | 2914 | None | 65 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -27 | 65 | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 135398745.0 | 2914 | None | 65 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -27 | 65 | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 47 | 2914 | None | 65 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -27 | 65 | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL715 | 2914 | None | 65 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -27 | 65 | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00334 | 2914 | None | 65 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -27 | 65 | ChEMBL | 312 | 1 | 1 | 5 | 1.7 | CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 2774 | 3868 | None | 59 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -2 | 10 | ChEMBL | 284 | 6 | 1 | 3 | 2.2 | CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1 | 10.1038/s41467-023-40064-9 | |||
| 5593 | 3868 | None | 59 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -2 | 10 | ChEMBL | 284 | 6 | 1 | 3 | 2.2 | CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1 | 10.1038/s41467-023-40064-9 | |||
| 5593.0 | 3868 | None | 59 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -2 | 10 | ChEMBL | 284 | 6 | 1 | 3 | 2.2 | CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1 | 10.1038/s41467-023-40064-9 | |||
| 7319 | 3868 | None | 59 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -2 | 10 | ChEMBL | 284 | 6 | 1 | 3 | 2.2 | CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1200604 | 3868 | None | 59 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -2 | 10 | ChEMBL | 284 | 6 | 1 | 3 | 2.2 | CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1 | 10.1038/s41467-023-40064-9 | |||
| DB00809 | 3868 | None | 59 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -2 | 10 | ChEMBL | 284 | 6 | 1 | 3 | 2.2 | CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1 | 10.1038/s41467-023-40064-9 | |||
| DB01199 | 3868 | None | 59 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -2 | 10 | ChEMBL | 284 | 6 | 1 | 3 | 2.2 | CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1 | 10.1038/s41467-023-40064-9 | |||
| 3158 | 56283 | None | 21 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -104 | 20 | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 3158.0 | 56283 | None | 21 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -104 | 20 | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1628227 | 56283 | None | 21 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -104 | 20 | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| DB01142 | 56283 | None | 21 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -104 | 20 | ChEMBL | 279 | 3 | 0 | 2 | 4.0 | CN(C)CCC=C1c2ccccc2COc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 25382 | 9159 | None | 27 | Human | Binding | pAC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 291 | 3 | 0 | 1 | 4.7 | CN(C)CCC=C1c2ccccc2C(C)(C)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL110094 | 9159 | None | 27 | Human | Binding | pAC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 291 | 3 | 0 | 1 | 4.7 | CN(C)CCC=C1c2ccccc2C(C)(C)c2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 154417 | 23189 | None | 39 | Human | Binding | pAC50 | = | 8.4 | 8.4 | -1 | 5 | 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 | 23189 | None | 39 | Human | Binding | pAC50 | = | 8.4 | 8.4 | -1 | 5 | 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 | |||
| 2905 | 14504 | None | 36 | Human | Binding | pAC50 | = | 7.4 | 7.4 | - | 5 | ChEMBL | 291 | 6 | 1 | 4 | 2.2 | CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1 | 10.1038/s41467-023-40064-9 | |||
| 2905.0 | 14504 | None | 36 | Human | Binding | pAC50 | = | 7.4 | 7.4 | - | 5 | ChEMBL | 291 | 6 | 1 | 4 | 2.2 | CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201338 | 14504 | None | 36 | Human | Binding | pAC50 | = | 7.4 | 7.4 | - | 5 | ChEMBL | 291 | 6 | 1 | 4 | 2.2 | CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1 | 10.1038/s41467-023-40064-9 | |||
| DB00979 | 14504 | None | 36 | Human | Binding | pAC50 | = | 7.4 | 7.4 | - | 5 | ChEMBL | 291 | 6 | 1 | 4 | 2.2 | CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1 | 10.1038/s41467-023-40064-9 | |||
| 5284550 | 41735 | None | 12 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -1 | 9 | ChEMBL | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 5284550.0 | 41735 | None | 12 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -1 | 9 | ChEMBL | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL108947 | 41735 | None | 12 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -1 | 9 | ChEMBL | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1492500 | 41735 | None | 12 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -1 | 9 | ChEMBL | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| DB09167 | 41735 | None | 12 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -1 | 9 | ChEMBL | 295 | 3 | 0 | 2 | 4.7 | CN(C)CC/C=C1\c2ccccc2CSc2ccccc21 | 10.1038/s41467-023-40064-9 | |||
| 2335 | 11852 | None | 18 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -1 | 12 | 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 | 11852 | None | 18 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -1 | 12 | 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 | 11852 | None | 18 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -1 | 12 | 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 | 11852 | None | 18 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -1 | 12 | 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 | |||
| 43815 | 187026 | None | 38 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -5 | 24 | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1708 | 187026 | None | 38 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -5 | 24 | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL490 | 187026 | None | 38 | Human | Binding | pAC50 | = | 6.4 | 6.4 | -5 | 24 | ChEMBL | 329 | 4 | 1 | 4 | 3.3 | Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 | 10.1038/s41467-023-40064-9 | |||
| 3947 | 208853 | None | 39 | Human | Binding | pAC50 | = | 5.3 | 5.3 | -4 | 15 | ChEMBL | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL87708 | 208853 | None | 39 | Human | Binding | pAC50 | = | 5.3 | 5.3 | -4 | 15 | ChEMBL | 418 | 7 | 0 | 3 | 5.8 | CN(CCCN1c2ccccc2CCc2ccccc21)CC(=O)c1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 3775 | 14481 | None | 19 | Human | Binding | pAC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 353 | 8 | 1 | 1 | 4.1 | CC(C)[N+](C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)C(C)C | 10.1038/s41467-023-40064-9 | |||
| 3775.0 | 14481 | None | 19 | Human | Binding | pAC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 353 | 8 | 1 | 1 | 4.1 | CC(C)[N+](C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)C(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201232 | 14481 | None | 19 | Human | Binding | pAC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 353 | 8 | 1 | 1 | 4.1 | CC(C)[N+](C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)C(C)C | 10.1038/s41467-023-40064-9 | |||
| DB01625 | 14481 | None | 19 | Human | Binding | pAC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 353 | 8 | 1 | 1 | 4.1 | CC(C)[N+](C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)C(C)C | 10.1038/s41467-023-40064-9 | |||
| 135398737 | 958 | None | 57 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -10 | 91 | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 135398737.0 | 958 | None | 57 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -10 | 91 | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 38 | 958 | None | 57 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -10 | 91 | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 722 | 958 | None | 57 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -10 | 91 | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL42 | 958 | None | 57 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -10 | 91 | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00363 | 958 | None | 57 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -10 | 91 | ChEMBL | 326 | 0 | 1 | 4 | 3.7 | CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 3394 | 198891 | None | 76 | Human | Binding | pAC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 244 | 3 | 1 | 1 | 3.7 | CC(C(=O)O)c1ccc(-c2ccccc2)c(F)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL563 | 198891 | None | 76 | Human | Binding | pAC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 244 | 3 | 1 | 1 | 3.7 | CC(C(=O)O)c1ccc(-c2ccccc2)c(F)c1 | 10.1038/s41467-023-40064-9 | |||
| 260 | 3869 | None | 33 | Human | Binding | pAC50 | = | 5.3 | 5.3 | - | 5 | 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 | None | 33 | Human | Binding | pAC50 | = | 5.3 | 5.3 | - | 5 | 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 | None | 33 | Human | Binding | pAC50 | = | 5.3 | 5.3 | - | 5 | 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 | None | 33 | Human | Binding | pAC50 | = | 5.3 | 5.3 | - | 5 | 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 | None | 33 | Human | Binding | pAC50 | = | 5.3 | 5.3 | - | 5 | 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 | |||
| 1971 | 2866 | None | 32 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -3 | 29 | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2404 | 2866 | None | 32 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -3 | 29 | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 4543 | 2866 | None | 32 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -3 | 29 | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 4543.0 | 2866 | None | 32 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -3 | 29 | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL445 | 2866 | None | 32 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -3 | 29 | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB00540 | 2866 | None | 32 | Human | Binding | pAC50 | = | 6.3 | 6.3 | -3 | 29 | ChEMBL | 263 | 3 | 1 | 1 | 3.8 | CNCCC=C1c2ccccc2CCc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 19003 | 14416 | None | 24 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 341 | 3 | 3 | 5 | 0.3 | CC1(C)S[C@@H]2[C@H](NC(=O)C3(N)CCCCC3)C(=O)N2[C@H]1C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1200356 | 14416 | None | 24 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 341 | 3 | 3 | 5 | 0.3 | CC1(C)S[C@@H]2[C@H](NC(=O)C3(N)CCCCC3)C(=O)N2[C@H]1C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 16722836 | 18992 | None | 63 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 524 | 10 | 3 | 8 | 4.8 | Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1287853 | 18992 | None | 63 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 524 | 10 | 3 | 8 | 4.8 | Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 | 10.1038/s41467-023-40064-9 | |||
| 4031 | 99367 | None | 27 | Human | Binding | pAC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 429 | 13 | 0 | 6 | 4.6 | CCN(CCCCOC(=O)c1ccc(OC)c(OC)c1)C(C)Cc1ccc(OC)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL282121 | 99367 | None | 27 | Human | Binding | pAC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 429 | 13 | 0 | 6 | 4.6 | CCN(CCCCOC(=O)c1ccc(OC)c(OC)c1)C(C)Cc1ccc(OC)cc1 | 10.1038/s41467-023-40064-9 | |||
| 1209 | 1658 | None | 52 | Human | Binding | pAC50 | = | 5.2 | 5.2 | -30 | 31 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 203 | 1658 | None | 52 | Human | Binding | pAC50 | = | 5.2 | 5.2 | -30 | 31 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3386 | 1658 | None | 52 | Human | Binding | pAC50 | = | 5.2 | 5.2 | -30 | 31 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL41 | 1658 | None | 52 | Human | Binding | pAC50 | = | 5.2 | 5.2 | -30 | 31 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB00472 | 1658 | None | 52 | Human | Binding | pAC50 | = | 5.2 | 5.2 | -30 | 31 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 10096344 | 89628 | None | 56 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 472 | 4 | 1 | 10 | 1.1 | CC#CCn1c(N2CCC[C@@H](N)C2)nc2c1c(=O)n(Cc1nc(C)c3ccccc3n1)c(=O)n2C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL237500 | 89628 | None | 56 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 472 | 4 | 1 | 10 | 1.1 | CC#CCn1c(N2CCC[C@@H](N)C2)nc2c1c(=O)n(Cc1nc(C)c3ccccc3n1)c(=O)n2C | 10.1038/s41467-023-40064-9 | |||
| 3236 | 67630 | None | 28 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 2 | ChEMBL | 259 | 5 | 0 | 2 | 3.6 | CCc1ccc(C(=O)C(C)CN2CCCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1902981 | 67630 | None | 28 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 2 | ChEMBL | 259 | 5 | 0 | 2 | 3.6 | CCc1ccc(C(=O)C(C)CN2CCCCC2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 3000322 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.1 | 8.1 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| 3000322.0 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.1 | 8.1 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| 330 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.1 | 8.1 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL569713 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.1 | 8.1 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| DB00747 | 3562 | None | 29 | Human | Binding | pAC50 | = | 8.1 | 8.1 | -2 | 8 | ChEMBL | 303 | 4 | 1 | 5 | 0.9 | OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C | 10.1038/s41467-023-40064-9 | |||
| 21722 | 17999 | None | 26 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 5 | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL126224 | 17999 | None | 26 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 5 | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | |||
| 19910 | 37419 | None | 62 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 190 | 1 | 1 | 4 | 1.8 | O=[N+]([O-])c1ccc(O)c2ncccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1454910 | 37419 | None | 62 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 190 | 1 | 1 | 4 | 1.8 | O=[N+]([O-])c1ccc(O)c2ncccc12 | 10.1038/s41467-023-40064-9 | |||
| 124087 | 1389 | None | 72 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 15 | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| 124087.0 | 1389 | None | 72 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 15 | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| 7157 | 1389 | None | 72 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 15 | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| 814 | 1389 | None | 72 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 15 | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1172 | 1389 | None | 72 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 15 | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00967 | 1389 | None | 72 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 15 | ChEMBL | 310 | 0 | 1 | 2 | 4.0 | Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1 | 10.1038/s41467-023-40064-9 | |||
| 214 | 3860 | None | 43 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -93 | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 2740 | 3860 | None | 43 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -93 | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 5566 | 3860 | None | 43 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -93 | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 5566.0 | 3860 | None | 43 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -93 | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 66064 | 3860 | None | 43 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -93 | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL422 | 3860 | None | 43 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -93 | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB00831 | 3860 | None | 43 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -93 | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3074 | 17965 | None | 17 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 604 | 16 | 0 | 12 | 3.5 | COc1cc(C(=O)OCCCN2CCCN(CCCOC(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1OC | 10.1038/s41467-023-40064-9 | |||
| CHEMBL126075 | 17965 | None | 17 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 604 | 16 | 0 | 12 | 3.5 | COc1cc(C(=O)OCCCN2CCCN(CCCOC(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1OC | 10.1038/s41467-023-40064-9 | |||
| 2713 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 504 | 9 | 10 | 4 | 4.2 | N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 5353524 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 504 | 9 | 10 | 4 | 4.2 | N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 5360566 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 504 | 9 | 10 | 4 | 4.2 | N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 88536661 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 504 | 9 | 10 | 4 | 4.2 | N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 9552079 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 504 | 9 | 10 | 4 | 4.2 | N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1330113 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 504 | 9 | 10 | 4 | 4.2 | N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL790 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 504 | 9 | 10 | 4 | 4.2 | N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 | 10.1038/s41467-023-40064-9 | |||
| 1427 | 2013 | None | 42 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -2 | 26 | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 357 | 2013 | None | 42 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -2 | 26 | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 3696 | 2013 | None | 42 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -2 | 26 | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL11 | 2013 | None | 42 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -2 | 26 | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| DB00458 | 2013 | None | 42 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -2 | 26 | ChEMBL | 280 | 4 | 0 | 2 | 3.9 | CN(CCCN1c2ccccc2CCc2c1cccc2)C | 10.1038/s41467-023-40064-9 | |||
| 5284632 | 67423 | None | 10 | Human | Binding | pAC50 | = | 8.1 | 8.1 | 1 | 5 | 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 | |||
| 5284632.0 | 67423 | None | 10 | Human | Binding | pAC50 | = | 8.1 | 8.1 | 1 | 5 | 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 | 67423 | None | 10 | Human | Binding | pAC50 | = | 8.1 | 8.1 | 1 | 5 | 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 | 67423 | None | 10 | Human | Binding | pAC50 | = | 8.1 | 8.1 | 1 | 5 | 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 | |||
| DB00209 | 67423 | None | 10 | Human | Binding | pAC50 | = | 8.1 | 8.1 | 1 | 5 | 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 | |||
| 4450 | 178333 | None | 41 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 3 | ChEMBL | 253 | 1 | 0 | 2 | 3.2 | CN1CCOC(c2ccccc2)c2ccccc2C1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL465026 | 178333 | None | 41 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 3 | ChEMBL | 253 | 1 | 0 | 2 | 3.2 | CN1CCOC(c2ccccc2)c2ccccc2C1 | 10.1038/s41467-023-40064-9 | |||
| 1222 | 1664 | None | 37 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 32 | 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 | None | 37 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 32 | ChEMBL | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3396.0 | 1664 | None | 37 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 32 | 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 | None | 37 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 32 | 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 | None | 37 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 32 | 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 | None | 37 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 32 | ChEMBL | 475 | 7 | 1 | 3 | 5.3 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 4942 | 5720 | None | 27 | Human | Binding | pAC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 367 | 7 | 0 | 4 | 4.0 | CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 4942.0 | 5720 | None | 27 | Human | Binding | pAC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 367 | 7 | 0 | 4 | 4.0 | CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1078261 | 5720 | None | 27 | Human | Binding | pAC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 367 | 7 | 0 | 4 | 4.0 | CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| DB12278 | 5720 | None | 27 | Human | Binding | pAC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 367 | 7 | 0 | 4 | 4.0 | CCCOC(C(=O)OC1CCN(C)CC1)(c1ccccc1)c1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 3149 | 12618 | None | 11 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 334 | 15 | 0 | 1 | 6.1 | CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1187011 | 12618 | None | 11 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 334 | 15 | 0 | 1 | 6.1 | CCCCCCCCCCCC[N+](C)(C)CCOc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 100 | 3805 | None | 44 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -8 | 55 | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| 2637 | 3805 | None | 44 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -8 | 55 | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| 5452 | 3805 | None | 44 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -8 | 55 | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL479 | 3805 | None | 44 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -8 | 55 | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| DB00679 | 3805 | None | 44 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -8 | 55 | ChEMBL | 370 | 4 | 0 | 4 | 5.9 | CSc1ccc2c(c1)N(CCC1CCCCN1C)c1c(S2)cccc1 | 10.1038/s41467-023-40064-9 | |||
| 5330286 | 67592 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 447 | 5 | 2 | 9 | 3.0 | CC(=O)c1c(C)c2cnc(Nc3ccc(N4CCNCC4)cn3)nc2n(C2CCCC2)c1=O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL189963 | 67592 | None | 57 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 447 | 5 | 2 | 9 | 3.0 | CC(=O)c1c(C)c2cnc(Nc3ccc(N4CCNCC4)cn3)nc2n(C2CCCC2)c1=O | 10.1038/s41467-023-40064-9 | |||
| 2337 | 3256 | None | 51 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -81 | 62 | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 50 | 3256 | None | 51 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -81 | 62 | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 5002 | 3256 | None | 51 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -81 | 62 | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 5002.0 | 3256 | None | 51 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -81 | 62 | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL716 | 3256 | None | 51 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -81 | 62 | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB01224 | 3256 | None | 51 | Human | Binding | pAC50 | = | 5.1 | 5.1 | -81 | 62 | ChEMBL | 383 | 5 | 1 | 6 | 2.9 | OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 5039 | 63203 | None | 12 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 314 | 10 | 2 | 7 | 1.5 | CNC(=C[N+](=O)[O-])NCCSCc1ccc(CN(C)C)o1 | 10.1038/s41467-023-40064-9 | |||
| 5039.0 | 63203 | None | 12 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 314 | 10 | 2 | 7 | 1.5 | CNC(=C[N+](=O)[O-])NCCSCc1ccc(CN(C)C)o1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1790041 | 63203 | None | 12 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 314 | 10 | 2 | 7 | 1.5 | CNC(=C[N+](=O)[O-])NCCSCc1ccc(CN(C)C)o1 | 10.1038/s41467-023-40064-9 | |||
| DB00863 | 63203 | None | 12 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 314 | 10 | 2 | 7 | 1.5 | CNC(=C[N+](=O)[O-])NCCSCc1ccc(CN(C)C)o1 | 10.1038/s41467-023-40064-9 | |||
| 2179 | 167616 | None | 49 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 393 | 5 | 2 | 5 | 4.5 | COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1256655 | 167616 | None | 49 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 393 | 5 | 2 | 5 | 4.5 | COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL43 | 167616 | None | 49 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 393 | 5 | 2 | 5 | 4.5 | COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12 | 10.1038/s41467-023-40064-9 | |||
| 4066 | 207084 | None | 54 | Human | Binding | pAC50 | = | 7.1 | 7.1 | -1 | 7 | ChEMBL | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 4066.0 | 207084 | None | 54 | Human | Binding | pAC50 | = | 7.1 | 7.1 | -1 | 7 | ChEMBL | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL73451 | 207084 | None | 54 | Human | Binding | pAC50 | = | 7.1 | 7.1 | -1 | 7 | ChEMBL | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| DB01071 | 207084 | None | 54 | Human | Binding | pAC50 | = | 7.1 | 7.1 | -1 | 7 | ChEMBL | 322 | 2 | 0 | 3 | 4.6 | c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2 | 10.1038/s41467-023-40064-9 | |||
| 50922675 | 112647 | None | 47 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 539 | 9 | 3 | 9 | 3.9 | COC(=O)N[C@@H](C)CNc1nccc(-c2cn(C(C)C)nc2-c2cc(Cl)cc(NS(C)(=O)=O)c2F)n1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3301612 | 112647 | None | 47 | Human | Binding | pAC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 539 | 9 | 3 | 9 | 3.9 | COC(=O)N[C@@H](C)CNc1nccc(-c2cn(C(C)C)nc2-c2cc(Cl)cc(NS(C)(=O)=O)c2F)n1 | 10.1038/s41467-023-40064-9 | |||
| 2381 | 663 | None | 30 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 9 | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 2381.0 | 663 | None | 30 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 9 | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 374 | 663 | None | 30 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 9 | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 7128 | 663 | None | 30 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 9 | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1101 | 663 | None | 30 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 9 | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| DB00810 | 663 | None | 30 | Human | Binding | pAC50 | = | 6.1 | 6.1 | -9 | 9 | ChEMBL | 311 | 5 | 1 | 2 | 4.0 | OC(C1CC2CC1C=C2)(c1ccccc1)CCN1CCCCC1 | 10.1038/s41467-023-40064-9 | |||
| 1193 | 1656 | None | 64 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 2447 | 1656 | None | 64 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 3371 | 1656 | None | 64 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| CHEMBL23588 | 1656 | None | 64 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| DB02266 | 1656 | None | 64 | Human | Binding | pAC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 281 | 3 | 2 | 2 | 4.1 | OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 5453 | 206077 | None | 58 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 189 | 3 | 0 | 1 | 0.2 | S=P(N1CC1)(N1CC1)N1CC1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL671 | 206077 | None | 58 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 189 | 3 | 0 | 1 | 0.2 | S=P(N1CC1)(N1CC1)N1CC1 | 10.1038/s41467-023-40064-9 | |||
| 19675 | 51685 | None | 37 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 410 | 7 | 1 | 5 | 5.0 | CC(=O)c1ccc2c(c1)N(CCCN1CCC(CCO)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1584 | 51685 | None | 37 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 410 | 7 | 1 | 5 | 5.0 | CC(=O)c1ccc2c(c1)N(CCCN1CCC(CCO)CC1)c1ccccc1S2 | 10.1038/s41467-023-40064-9 | |||
| 23724781 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 23724781.0 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 316 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 317 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 71183 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| CHEMBL1354199 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| CHEMBL3140030 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| CHEMBL376897 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| DB00462 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 10.3 | 10.3 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 23724781 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 23724781.0 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 316 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 317 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 71183 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| CHEMBL1354199 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| CHEMBL3140030 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| CHEMBL376897 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| DB00462 | 2835 | None | 13 | Rat | Binding | pEC50 | = | 9.7 | 9.7 | 1 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1074/jbc.m704875200 | |||
| 367 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 5487427 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 5487427.0 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 8592 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL1900528 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL3305968 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4650755 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| DB01409 | 3824 | None | 10 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1021/acs.jmedchem.0c00297 | |||
| 2230 | 465 | None | 43 | Human | Binding | pEC50 | = | 7 | 7.0 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00156a018 | |||
| 296 | 465 | None | 43 | Human | Binding | pEC50 | = | 7 | 7.0 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00156a018 | |||
| CHEMBL7303 | 465 | None | 43 | Human | Binding | pEC50 | = | 7 | 7.0 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00156a018 | |||
| DB04365 | 465 | None | 43 | Human | Binding | pEC50 | = | 7 | 7.0 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00156a018 | |||
| 9308 | 17761 | None | 16 | Human | Binding | pEC50 | = | 6 | 6.0 | - | 7 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1016/j.bmc.2010.07.060 | |||
| CHEMBL1255785 | 17761 | None | 16 | Human | Binding | pEC50 | = | 6 | 6.0 | - | 7 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1016/j.bmc.2010.07.060 | |||
| CHEMBL12587 | 17761 | None | 16 | Human | Binding | pEC50 | = | 6 | 6.0 | - | 7 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1016/j.bmc.2010.07.060 | |||
| CHEMBL292911 | 17761 | None | 16 | Human | Binding | pEC50 | = | 6 | 6.0 | - | 7 | ChEMBL | 174 | 2 | 1 | 2 | 0.2 | C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O | 10.1016/j.bmc.2010.07.060 | |||
| 170332 | 161070 | None | 0 | Human | Binding | pEC50 | = | 5 | 5.0 | -7 | 3 | ChEMBL | 194 | 4 | 0 | 1 | 1.9 | COc1cccc(CC[N+](C)(C)C)c1 | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL4091934 | 161070 | None | 0 | Human | Binding | pEC50 | = | 5 | 5.0 | -7 | 3 | ChEMBL | 194 | 4 | 0 | 1 | 1.9 | COc1cccc(CC[N+](C)(C)C)c1 | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL4115997 | 161070 | None | 0 | Human | Binding | pEC50 | = | 5 | 5.0 | -7 | 3 | ChEMBL | 194 | 4 | 0 | 1 | 1.9 | COc1cccc(CC[N+](C)(C)C)c1 | 10.1021/acs.jmedchem.7b01113 | |||
| 91468 | 209522 | None | 10 | Human | Binding | pEC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL91776 | 209522 | None | 10 | Human | Binding | pEC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 170332 | 161070 | None | 0 | Human | Binding | pEC50 | = | 5.0 | 5.0 | -7 | 3 | ChEMBL | 194 | 4 | 0 | 1 | 1.9 | COc1cccc(CC[N+](C)(C)C)c1 | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL4091934 | 161070 | None | 0 | Human | Binding | pEC50 | = | 5.0 | 5.0 | -7 | 3 | ChEMBL | 194 | 4 | 0 | 1 | 1.9 | COc1cccc(CC[N+](C)(C)C)c1 | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL4115997 | 161070 | None | 0 | Human | Binding | pEC50 | = | 5.0 | 5.0 | -7 | 3 | ChEMBL | 194 | 4 | 0 | 1 | 1.9 | COc1cccc(CC[N+](C)(C)C)c1 | 10.1021/acs.jmedchem.7b01113 | |||
| 319 | 1324 | None | 32 | Human | Binding | pEC50 | = | 8.0 | 8.0 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 321 | 1324 | None | 32 | Human | Binding | pEC50 | = | 8.0 | 8.0 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 444031 | 1324 | None | 32 | Human | Binding | pEC50 | = | 8.0 | 8.0 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 444031.0 | 1324 | None | 32 | Human | Binding | pEC50 | = | 8.0 | 8.0 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 784 | 1324 | None | 32 | Human | Binding | pEC50 | = | 8.0 | 8.0 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL1346 | 1324 | None | 32 | Human | Binding | pEC50 | = | 8.0 | 8.0 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| DB00496 | 1324 | None | 32 | Human | Binding | pEC50 | = | 8.0 | 8.0 | 2 | 9 | ChEMBL | 426 | 7 | 1 | 3 | 4.0 | NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(C1)CCc1ccc2c(c1)CCO2 | 10.1021/acs.jmedchem.0c00297 | |||
| 13621561 | 11075 | None | 1 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 178 | 2 | 1 | 4 | 0.3 | C#CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL1177918 | 11075 | None | 1 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 178 | 2 | 1 | 4 | 0.3 | C#CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL6767 | 11075 | None | 1 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 178 | 2 | 1 | 4 | 0.3 | C#CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| 10261985 | 206407 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 192 | 2 | 1 | 4 | 0.7 | C#CCOc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| CHEMBL69306 | 206407 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 192 | 2 | 1 | 4 | 0.7 | C#CCOc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| 13621555 | 11948 | None | 1 | Human | Binding | pEC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 180 | 3 | 1 | 4 | 0.9 | C=CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL1182820 | 11948 | None | 1 | Human | Binding | pEC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 180 | 3 | 1 | 4 | 0.9 | C=CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL268175 | 11948 | None | 1 | Human | Binding | pEC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 180 | 3 | 1 | 4 | 0.9 | C=CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| 10465280 | 102840 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 196 | 2 | 1 | 4 | 1.5 | CC(C)Oc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| CHEMBL305264 | 102840 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 196 | 2 | 1 | 4 | 1.5 | CC(C)Oc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| 2166 | 3123 | None | 33 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -6 | 7 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 305 | 3123 | None | 33 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -6 | 7 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 5910 | 3123 | None | 33 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -6 | 7 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 5910.0 | 3123 | None | 33 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -6 | 7 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL550 | 3123 | None | 33 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -6 | 7 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| DB01085 | 3123 | None | 33 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -6 | 7 | ChEMBL | 208 | 3 | 0 | 4 | 1.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 13621569 | 11957 | None | 1 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 182 | 2 | 0 | 4 | 1.1 | CCOc1noc2c1CN(C)CC2 | 10.1021/jm00156a018 | |||
| CHEMBL1182850 | 11957 | None | 1 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 182 | 2 | 0 | 4 | 1.1 | CCOc1noc2c1CN(C)CC2 | 10.1021/jm00156a018 | |||
| CHEMBL269706 | 11957 | None | 1 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 182 | 2 | 0 | 4 | 1.1 | CCOc1noc2c1CN(C)CC2 | 10.1021/jm00156a018 | |||
| 171345098 | 194724 | None | 0 | Human | Binding | pEC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 602 | 14 | 0 | 5 | 5.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL5287096 | 194724 | None | 0 | Human | Binding | pEC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 602 | 14 | 0 | 5 | 5.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL5315302 | 194724 | None | 0 | Human | Binding | pEC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 602 | 14 | 0 | 5 | 5.2 | CC[C@@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 163282064 | 194368 | None | 0 | Human | Binding | pEC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 380 | 2 | 0 | 3 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)N1CCc2ccccc2[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2022.129048 | |||
| CHEMBL5284728 | 194368 | None | 0 | Human | Binding | pEC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 380 | 2 | 0 | 3 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)N1CCc2ccccc2[C@@H]1c1ccc(F)cc1 | 10.1016/j.bmcl.2022.129048 | |||
| 303 | 2978 | None | 15 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -89 | 6 | ChEMBL | 195 | 2 | 0 | 1 | 0.3 | O=C1CCCN1CC#CC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 4629 | 2978 | None | 15 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -89 | 6 | ChEMBL | 195 | 2 | 0 | 1 | 0.3 | O=C1CCCN1CC#CC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 8595 | 2978 | None | 15 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -89 | 6 | ChEMBL | 195 | 2 | 0 | 1 | 0.3 | O=C1CCCN1CC#CC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| CHEMBL44674 | 2978 | None | 15 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -89 | 6 | ChEMBL | 195 | 2 | 0 | 1 | 0.3 | O=C1CCCN1CC#CC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 125603 | 11070 | None | 3 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 154 | 1 | 1 | 4 | 0.3 | COc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL1177907 | 11070 | None | 3 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 154 | 1 | 1 | 4 | 0.3 | COc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL6451 | 11070 | None | 3 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 154 | 1 | 1 | 4 | 0.3 | COc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| 2551 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00012a019 | |||
| 2551.0 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00012a019 | |||
| 298 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00012a019 | |||
| 488 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00012a019 | |||
| CHEMBL965 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00012a019 | |||
| DB00411 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.8 | 5.8 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00012a019 | |||
| 2551 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.7 | 5.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 2551.0 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.7 | 5.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 298 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.7 | 5.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 488 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.7 | 5.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| CHEMBL965 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.7 | 5.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| DB00411 | 794 | None | 13 | Human | Binding | pEC50 | = | 5.7 | 5.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 156009673 | 178359 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 407 | 3 | 1 | 2 | 5.1 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4633816 | 178359 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 407 | 3 | 1 | 2 | 5.1 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4650683 | 178359 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 407 | 3 | 1 | 2 | 5.1 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| 156014812 | 178367 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 389 | 3 | 1 | 2 | 4.9 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1cccc(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4647437 | 178367 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 389 | 3 | 1 | 2 | 4.9 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1cccc(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4650736 | 178367 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | 1 | 3 | ChEMBL | 389 | 3 | 1 | 2 | 4.9 | C[N+]12CCC(CC1)[C@@H](OC(=O)Nc1ccc(F)cc1-c1cccc(Cl)c1)C2 | 10.1021/acs.jmedchem.0c00297 | |||
| 13621572 | 11072 | None | 0 | Human | Binding | pEC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 182 | 2 | 0 | 4 | 1.1 | CCN1CCc2onc(OC)c2C1 | 10.1021/jm00156a018 | |||
| CHEMBL1177910 | 11072 | None | 0 | Human | Binding | pEC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 182 | 2 | 0 | 4 | 1.1 | CCN1CCc2onc(OC)c2C1 | 10.1021/jm00156a018 | |||
| CHEMBL6568 | 11072 | None | 0 | Human | Binding | pEC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 182 | 2 | 0 | 4 | 1.1 | CCN1CCc2onc(OC)c2C1 | 10.1021/jm00156a018 | |||
| 171347905 | 193848 | None | 0 | Human | Binding | pEC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 166 | 2 | 1 | 3 | 0.5 | O=C1C[C@@H](Cc2cnc[nH]2)CO1 | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL5272950 | 193848 | None | 0 | Human | Binding | pEC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 166 | 2 | 1 | 3 | 0.5 | O=C1C[C@@H](Cc2cnc[nH]2)CO1 | 10.1021/acs.jnatprod.2c01079 | |||
| 2551 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 2551.0 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 298 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 488 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| CHEMBL965 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| DB00411 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 302 | 2977 | None | 15 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -309 | 7 | ChEMBL | 206 | 2 | 0 | 2 | 0.7 | O=C1CCCN1CC#CCN1CCCC1 | 10.1021/jm00012a019 | |||
| 4630 | 2977 | None | 15 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -309 | 7 | ChEMBL | 206 | 2 | 0 | 2 | 0.7 | O=C1CCCN1CC#CCN1CCCC1 | 10.1021/jm00012a019 | |||
| CHEMBL7634 | 2977 | None | 15 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -309 | 7 | ChEMBL | 206 | 2 | 0 | 2 | 0.7 | O=C1CCCN1CC#CCN1CCCC1 | 10.1021/jm00012a019 | |||
| 2551 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 2551.0 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 298 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 488 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL965 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| DB00411 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.7 | 7.7 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.0c00297 | |||
| 187 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 187.0 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 294 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 65 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 8593 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL667 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| DB03128 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 187 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 187.0 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 294 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 65 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 8593 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| CHEMBL667 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| DB03128 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.7 | 6.7 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1016/j.bmc.2010.07.060 | |||
| 187 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 187.0 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 294 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 65 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 8593 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL667 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| DB03128 | 255 | None | 24 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 187 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 187.0 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 294 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 65 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 8593 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL667 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| DB03128 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 2551 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 2551.0 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 298 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 488 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| CHEMBL965 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| DB00411 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.2c01376 | |||
| 154059 | 3637 | None | 37 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -1 | 8 | ChEMBL | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2022.129048 | |||
| 154059.0 | 3637 | None | 37 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -1 | 8 | ChEMBL | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2022.129048 | |||
| 2457 | 3637 | None | 37 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -1 | 8 | ChEMBL | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2022.129048 | |||
| 7483 | 3637 | None | 37 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -1 | 8 | ChEMBL | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2022.129048 | |||
| CHEMBL1734 | 3637 | None | 37 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -1 | 8 | ChEMBL | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2022.129048 | |||
| DB01591 | 3637 | None | 37 | Human | Binding | pEC50 | = | 7.6 | 7.6 | -1 | 8 | ChEMBL | 362 | 2 | 0 | 3 | 3.9 | O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2 | 10.1016/j.bmcl.2022.129048 | |||
| 187 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 187.0 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 294 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 65 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 8593 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL667 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| DB03128 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.6 | 6.6 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jmedchem.7b01113 | |||
| 156015097 | 177657 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 392 | 3 | 1 | 3 | 4.9 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4640324 | 177657 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 392 | 3 | 1 | 3 | 4.9 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| 156015300 | 177697 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | 4 | 3 | ChEMBL | 362 | 4 | 2 | 3 | 4.7 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4640703 | 177697 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | 4 | 3 | ChEMBL | 362 | 4 | 2 | 3 | 4.7 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| 156021744 | 178219 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 374 | 3 | 1 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4648071 | 178219 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 374 | 3 | 1 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1cccc(Cl)c1)O[C@H]1CN2CCC1CC2 | 10.1021/acs.jmedchem.0c00297 | |||
| 171348452 | 194741 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 602 | 14 | 0 | 5 | 5.2 | CC[C@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL5285668 | 194741 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 602 | 14 | 0 | 5 | 5.2 | CC[C@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL5315497 | 194741 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 602 | 14 | 0 | 5 | 5.2 | CC[C@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 160492 | 97310 | None | 26 | Human | Binding | pEC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 141 | 1 | 1 | 3 | 0.1 | COC(=O)C1=CCCNC1 | 10.1021/jm00156a018 | |||
| CHEMBL268808 | 97310 | None | 26 | Human | Binding | pEC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 141 | 1 | 1 | 3 | 0.1 | COC(=O)C1=CCCNC1 | 10.1021/jm00156a018 | |||
| 171346325 | 194774 | None | 0 | Human | Binding | pEC50 | = | 4.5 | 4.5 | - | 0 | ChEMBL | 630 | 16 | 0 | 5 | 5.9 | CC[C@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL5277944 | 194774 | None | 0 | Human | Binding | pEC50 | = | 4.5 | 4.5 | - | 0 | ChEMBL | 630 | 16 | 0 | 5 | 5.9 | CC[C@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL5316061 | 194774 | None | 0 | Human | Binding | pEC50 | = | 4.5 | 4.5 | - | 0 | ChEMBL | 630 | 16 | 0 | 5 | 5.9 | CC[C@H]1C(=O)OC[C@@H]1Cc1c[n+](CCCCCCCC[N+](C)(C)CC(C)(C)CN2C(=O)c3cccc4cccc(c34)C2=O)cn1C | 10.1021/acs.jnatprod.2c01079 | |||
| 2230 | 465 | None | 43 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00012a019 | |||
| 296 | 465 | None | 43 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00012a019 | |||
| CHEMBL7303 | 465 | None | 43 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00012a019 | |||
| DB04365 | 465 | None | 43 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -588 | 10 | ChEMBL | 155 | 1 | 0 | 3 | 0.4 | COC(=O)C1=CCCN(C1)C | 10.1021/jm00012a019 | |||
| 13621545 | 11073 | None | 3 | Human | Binding | pEC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 168 | 2 | 1 | 4 | 0.7 | CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL1177913 | 11073 | None | 3 | Human | Binding | pEC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 168 | 2 | 1 | 4 | 0.7 | CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL6680 | 11073 | None | 3 | Human | Binding | pEC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 168 | 2 | 1 | 4 | 0.7 | CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| 137629935 | 161114 | None | 0 | Human | Binding | pEC50 | = | 5.4 | 5.4 | -1 | 3 | ChEMBL | 206 | 3 | 0 | 1 | 1.9 | C[N+](C)(C)CCc1ccc2c(c1)OCC2 | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL4060823 | 161114 | None | 0 | Human | Binding | pEC50 | = | 5.4 | 5.4 | -1 | 3 | ChEMBL | 206 | 3 | 0 | 1 | 1.9 | C[N+](C)(C)CCc1ccc2c(c1)OCC2 | 10.1021/acs.jmedchem.7b01113 | |||
| CHEMBL4116342 | 161114 | None | 0 | Human | Binding | pEC50 | = | 5.4 | 5.4 | -1 | 3 | ChEMBL | 206 | 3 | 0 | 1 | 1.9 | C[N+](C)(C)CCc1ccc2c(c1)OCC2 | 10.1021/acs.jmedchem.7b01113 | |||
| 156011965 | 177397 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | 3 | 3 | ChEMBL | 380 | 4 | 2 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| CHEMBL4636528 | 177397 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | 3 | 3 | ChEMBL | 380 | 4 | 2 | 3 | 4.8 | O=C(Nc1ccc(F)cc1-c1ccc(F)c(Cl)c1)OCC1CCNCC1 | 10.1021/acs.jmedchem.0c00297 | |||
| 13621565 | 11079 | None | 1 | Human | Binding | pEC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 192 | 2 | 1 | 4 | 0.7 | CC#CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL1177927 | 11079 | None | 1 | Human | Binding | pEC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 192 | 2 | 1 | 4 | 0.7 | CC#CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| CHEMBL7018 | 11079 | None | 1 | Human | Binding | pEC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 192 | 2 | 1 | 4 | 0.7 | CC#CCOc1noc2c1CNCC2 | 10.1021/jm00156a018 | |||
| 10442337 | 206406 | None | 1 | Human | Binding | pEC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 182 | 2 | 1 | 4 | 1.1 | CCOc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| CHEMBL69305 | 206406 | None | 1 | Human | Binding | pEC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 182 | 2 | 1 | 4 | 1.1 | CCOc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| 187 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.3 | 6.3 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jnatprod.2c01079 | |||
| 187.0 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.3 | 6.3 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jnatprod.2c01079 | |||
| 294 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.3 | 6.3 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jnatprod.2c01079 | |||
| 65 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.3 | 6.3 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jnatprod.2c01079 | |||
| 8593 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.3 | 6.3 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jnatprod.2c01079 | |||
| CHEMBL667 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.3 | 6.3 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jnatprod.2c01079 | |||
| DB03128 | 255 | None | 24 | Human | Binding | pEC50 | = | 6.3 | 6.3 | -26 | 9 | ChEMBL | 146 | 3 | 0 | 2 | 0.3 | CC(=O)OCC[N+](C)(C)C | 10.1021/acs.jnatprod.2c01079 | |||
| 10442081 | 102663 | None | 6 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 168 | 1 | 1 | 4 | 0.7 | COc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| CHEMBL304142 | 102663 | None | 6 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 168 | 1 | 1 | 4 | 0.7 | COc1noc2c1CNCCC2 | 10.1021/jm00012a019 | |||
| 3008304 | 4023 | None | 46 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1021/jm201139r | |||
| 7632 | 4023 | None | 46 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1021/jm201139r | |||
| CHEMBL523685 | 4023 | None | 46 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 315 | 2 | 0 | 2 | 3.2 | Brc1ccc(cc1)CN1c2ccccc2C(=O)C1=O | 10.1021/jm201139r | |||
| 2551 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.2 | 7.2 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00156a018 | |||
| 2551.0 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.2 | 7.2 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00156a018 | |||
| 298 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.2 | 7.2 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00156a018 | |||
| 488 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.2 | 7.2 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00156a018 | |||
| CHEMBL965 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.2 | 7.2 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00156a018 | |||
| DB00411 | 794 | None | 13 | Human | Binding | pEC50 | = | 7.2 | 7.2 | -346 | 11 | ChEMBL | 147 | 3 | 1 | 2 | -0.2 | NC(=O)OCC[N+](C)(C)C | 10.1021/jm00156a018 | |||
| 13621567 | 98213 | None | 4 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 168 | 1 | 0 | 4 | 0.7 | COc1noc2c1CN(C)CC2 | 10.1021/jm00156a018 | |||
| CHEMBL27384 | 98213 | None | 4 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 168 | 1 | 0 | 4 | 0.7 | COc1noc2c1CN(C)CC2 | 10.1021/jm00156a018 | |||
| CHEMBL440085 | 98213 | None | 4 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 168 | 1 | 0 | 4 | 0.7 | COc1noc2c1CN(C)CC2 | 10.1021/jm00156a018 | |||
| 57400422 | 71655 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 3.9 | C[C@@](C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924027 | 71655 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 3.9 | C[C@@](C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1963462 | 71655 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 3.9 | C[C@@](C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 24758141 | 103782 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 3.9 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087959 | 103782 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 0 | ChEMBL | 330 | 4 | 0 | 2 | 3.9 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 367 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| 5487427 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| 5487427.0 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| 8592 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| CHEMBL1900528 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| CHEMBL3305968 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| CHEMBL4650755 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| DB01409 | 3824 | None | 10 | Human | Binding | pIC50 | = | 10.3 | 10.3 | 2 | 9 | 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 | 10.1016/j.bmcl.2010.10.016 | |||
| 57392578 | 68769 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 487 | 7 | 0 | 4 | 5.5 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccc(Cl)s3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921908 | 68769 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 487 | 7 | 0 | 4 | 5.5 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccc(Cl)s3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57395222 | 69170 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 477 | 9 | 0 | 4 | 5.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924040 | 69170 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 477 | 9 | 0 | 4 | 5.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72545528 | 103690 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 453 | 7 | 0 | 4 | 5.5 | O=C(O[C@H]1C[N+]2(CCCc3ccncc3)CCC1CC2)C1(c2cccs2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087230 | 103690 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 453 | 7 | 0 | 4 | 5.5 | O=C(O[C@H]1C[N+]2(CCCc3ccncc3)CCC1CC2)C1(c2cccs2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72545784 | 103694 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 475 | 7 | 0 | 4 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3nc4ccccc4o3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087235 | 103694 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | 475 | 7 | 0 | 4 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3nc4ccccc4o3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 57401273 | 68768 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 525 | 7 | 0 | 3 | 5.5 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3cccc(Br)c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921907 | 68768 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 525 | 7 | 0 | 3 | 5.5 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3cccc(Br)c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57394170 | 68783 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 517 | 8 | 0 | 4 | 6.4 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3cc4ccccc4s3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921925 | 68783 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 517 | 8 | 0 | 4 | 6.4 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3cc4ccccc4s3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57394234 | 68793 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 483 | 9 | 0 | 5 | 5.1 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921935 | 68793 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 483 | 9 | 0 | 5 | 5.1 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 59179619 | 103784 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 327 | 3 | 0 | 3 | 3.9 | O=C(O[C@H]1CN2CCC1CC2)C1(c2ccccc2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087961 | 103784 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 327 | 3 | 0 | 3 | 3.9 | O=C(O[C@H]1CN2CCC1CC2)C1(c2ccccc2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72545282 | 103791 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 440 | 6 | 0 | 3 | 6.0 | Cc1ccc(CC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)s1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3088081 | 103791 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 440 | 6 | 0 | 3 | 6.0 | Cc1ccc(CC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)s1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72545526 | 103795 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 450 | 8 | 0 | 3 | 5.8 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3088086 | 103795 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 450 | 8 | 0 | 3 | 5.8 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 57390665 | 68775 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 462 | 8 | 0 | 4 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3ccncc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921917 | 68775 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 462 | 8 | 0 | 4 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3ccncc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57395990 | 68795 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 501 | 9 | 0 | 5 | 5.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccc(F)cc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921937 | 68795 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 501 | 9 | 0 | 5 | 5.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccc(F)cc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72546493 | 103780 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 473 | 6 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)on3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087957 | 103780 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 473 | 6 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)on3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 58348375 | 103785 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 333 | 3 | 0 | 4 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)C1(c2cccs2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3088075 | 103785 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 333 | 3 | 0 | 4 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)C1(c2cccs2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72545281 | 103790 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 420 | 6 | 0 | 2 | 5.6 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3088080 | 103790 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 420 | 6 | 0 | 2 | 5.6 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 57395991 | 68803 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 500 | 7 | 1 | 5 | 4.4 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cccc(F)c3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921945 | 68803 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 500 | 7 | 1 | 5 | 4.4 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cccc(F)c3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57391636 | 68858 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 518 | 7 | 1 | 7 | 3.7 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cncc(Cl)n3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922053 | 68858 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 518 | 7 | 1 | 7 | 3.7 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cncc(Cl)n3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 24988645 | 69166 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 351 | 4 | 0 | 4 | 3.2 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924036 | 69166 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 351 | 4 | 0 | 4 | 3.2 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72546026 | 103700 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 439 | 6 | 2 | 4 | 3.7 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cc[nH]n1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087242 | 103700 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 439 | 6 | 2 | 4 | 3.7 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cc[nH]n1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72543916 | 103772 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 485 | 6 | 1 | 5 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cncc(Cl)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087949 | 103772 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 485 | 6 | 1 | 5 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cncc(Cl)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546261 | 103775 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 447 | 5 | 0 | 4 | 5.7 | O=C(O[C@H]1C[N+]2(Cc3nc4ccccc4o3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087952 | 103775 | None | 0 | Human | Binding | pIC50 | = | 10 | 10.0 | - | 0 | ChEMBL | 447 | 5 | 0 | 4 | 5.7 | O=C(O[C@H]1C[N+]2(Cc3nc4ccccc4o3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 11434515 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1016/j.bmcl.2010.10.016 | |||
| 11434515.0 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1016/j.bmcl.2010.10.016 | |||
| 11519741 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1016/j.bmcl.2010.10.016 | |||
| 4484 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1016/j.bmcl.2010.10.016 | |||
| 7449 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1016/j.bmcl.2010.10.016 | |||
| CHEMBL1194325 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1016/j.bmcl.2010.10.016 | |||
| DB08897 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1016/j.bmcl.2010.10.016 | |||
| 44552684 | 68777 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 476 | 8 | 0 | 4 | 4.9 | Cc1cc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)ccn1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921919 | 68777 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 476 | 8 | 0 | 4 | 4.9 | Cc1cc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)ccn1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57397792 | 68799 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 406 | 6 | 1 | 5 | 2.1 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(N)=O)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921941 | 68799 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 406 | 6 | 1 | 5 | 2.1 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(N)=O)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57401219 | 68804 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 477 | 7 | 1 | 5 | 3.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccccn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921946 | 68804 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 477 | 7 | 1 | 5 | 3.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccccn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57391775 | 69177 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 465 | 7 | 0 | 3 | 4.9 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccccc3F)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924049 | 69177 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 465 | 7 | 0 | 3 | 4.9 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccccc3F)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 11693 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| 3494 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| 3494.0 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| 4302 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| 7459 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| 9933193 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| 9933193.0 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL1201335 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| DB00986 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.9 | 9.9 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2013.09.092 | |||
| 72545787 | 103697 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 467 | 6 | 1 | 3 | 5.1 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cccc(F)c1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087238 | 103697 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 467 | 6 | 1 | 3 | 5.1 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cccc(F)c1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72545525 | 103794 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 450 | 8 | 0 | 3 | 5.6 | O=C(O[C@H]1C[N+]2(CCOCc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3088085 | 103794 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 450 | 8 | 0 | 3 | 5.6 | O=C(O[C@H]1C[N+]2(CCOCc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 44517831 | 68767 | None | 4 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 465 | 7 | 0 | 3 | 4.9 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccc(F)cc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921904 | 68767 | None | 4 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 465 | 7 | 0 | 3 | 4.9 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccc(F)cc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57395952 | 68771 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 491 | 7 | 0 | 4 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCC3=CC4CCOC4C=C3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921911 | 68771 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 491 | 7 | 0 | 4 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCC3=CC4CCOC4C=C3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57397744 | 68776 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 468 | 8 | 0 | 5 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3ccncc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921918 | 68776 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 468 | 8 | 0 | 5 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3ccncc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57390720 | 68856 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 467 | 7 | 1 | 6 | 3.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccon3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922051 | 68856 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 467 | 7 | 1 | 6 | 3.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccon3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57403853 | 68859 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 488 | 6 | 0 | 5 | 5.2 | Cc1ccc2nc(C[N+]34CCC(CC3)[C@@H](OC(=O)[C@](C)(c3ccccc3)N3CCCCC3)C4)oc2c1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922054 | 68859 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 488 | 6 | 0 | 5 | 5.2 | Cc1ccc2nc(C[N+]34CCC(CC3)[C@@H](OC(=O)[C@](C)(c3ccccc3)N3CCCCC3)C4)oc2c1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57398751 | 69157 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 471 | 7 | 0 | 4 | 5.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccccc3F)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924025 | 69157 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 471 | 7 | 0 | 4 | 5.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccccc3F)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72545530 | 103691 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 449 | 7 | 0 | 3 | 5.7 | Cc1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087232 | 103691 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 449 | 7 | 0 | 3 | 5.7 | Cc1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546025 | 103699 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 454 | 6 | 1 | 5 | 4.3 | Cc1cc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)no1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087241 | 103699 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 454 | 6 | 1 | 5 | 4.3 | Cc1cc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)no1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546496 | 103713 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 450 | 6 | 1 | 4 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccccn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087362 | 103713 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 450 | 6 | 1 | 4 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccccn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546739 | 103718 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 451 | 6 | 1 | 5 | 3.8 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccncn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087367 | 103718 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 451 | 6 | 1 | 5 | 3.8 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccncn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546991 | 103719 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 451 | 6 | 1 | 5 | 3.8 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cccnn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087368 | 103719 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 451 | 6 | 1 | 5 | 3.8 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cccnn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546262 | 103776 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 474 | 6 | 0 | 5 | 5.6 | O=C(O[C@H]1C[N+]2(Cc3nc(-c4ccccc4)no3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087953 | 103776 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 474 | 6 | 0 | 5 | 5.6 | O=C(O[C@H]1C[N+]2(Cc3nc(-c4ccccc4)no3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72545285 | 103793 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 436 | 7 | 0 | 3 | 5.4 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3088084 | 103793 | None | 0 | Human | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | 436 | 7 | 0 | 3 | 5.4 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 11434515 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.8 | 9.8 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1021/jm900132z | |||
| 11434515.0 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.8 | 9.8 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1021/jm900132z | |||
| 11519741 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.8 | 9.8 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1021/jm900132z | |||
| 4484 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.8 | 9.8 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1021/jm900132z | |||
| 7449 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.8 | 9.8 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1021/jm900132z | |||
| CHEMBL1194325 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.8 | 9.8 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1021/jm900132z | |||
| DB08897 | 261 | None | 6 | Human | Binding | pIC50 | = | 9.8 | 9.8 | -4 | 5 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(C(c1cccs1)(c1cccs1)O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2 | 10.1021/jm900132z | |||
| 10143956 | 13916 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 3 | ChEMBL | 470 | 9 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| CHEMBL1196359 | 13916 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 3 | ChEMBL | 470 | 9 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| CHEMBL556635 | 13916 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 3 | ChEMBL | 470 | 9 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| 57390766 | 68770 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 497 | 7 | 0 | 3 | 5.9 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccc4ccccc4c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921910 | 68770 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 497 | 7 | 0 | 3 | 5.9 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3ccc4ccccc4c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57402931 | 68774 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 459 | 7 | 0 | 4 | 5.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCC3CCCCC3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921914 | 68774 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 459 | 7 | 0 | 4 | 5.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCC3CCCCC3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57399407 | 68785 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 475 | 9 | 0 | 3 | 5.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCCc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921927 | 68785 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 475 | 9 | 0 | 3 | 5.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCCc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57401217 | 68798 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 400 | 6 | 1 | 4 | 2.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(N)=O)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921940 | 68798 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 400 | 6 | 1 | 4 | 2.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(N)=O)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57397793 | 68800 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 476 | 7 | 1 | 4 | 4.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921942 | 68800 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 476 | 7 | 1 | 4 | 4.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57401218 | 68801 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 482 | 7 | 1 | 5 | 4.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccccc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921943 | 68801 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 482 | 7 | 1 | 5 | 4.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccccc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57397794 | 68802 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 494 | 7 | 1 | 4 | 4.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cccc(F)c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921944 | 68802 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 494 | 7 | 1 | 4 | 4.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cccc(F)c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57392520 | 68855 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 478 | 7 | 1 | 6 | 3.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cnccn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922050 | 68855 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 478 | 7 | 1 | 6 | 3.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cnccn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57392521 | 68857 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 473 | 7 | 1 | 7 | 3.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccon3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922052 | 68857 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 473 | 7 | 1 | 7 | 3.2 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccon3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57395096 | 68860 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 500 | 7 | 0 | 5 | 5.4 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)on3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922055 | 68860 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 500 | 7 | 0 | 5 | 5.4 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)on3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72545785 | 103695 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 373 | 5 | 1 | 3 | 2.9 | NC(=O)C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087236 | 103695 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 373 | 5 | 1 | 3 | 2.9 | NC(=O)C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546736 | 103715 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 450 | 6 | 1 | 4 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cccnc1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087364 | 103715 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 450 | 6 | 1 | 4 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cccnc1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72547500 | 103769 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 485 | 6 | 1 | 5 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccc(Cl)nn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087946 | 103769 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 485 | 6 | 1 | 5 | 4.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccc(Cl)nn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 10165877 | 63150 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 5.6 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779133 | 63150 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 5.6 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789396 | 63150 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 5.6 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 11852298 | 14031 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 3 | ChEMBL | 454 | 7 | 1 | 5 | 4.4 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL1197251 | 14031 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 3 | ChEMBL | 454 | 7 | 1 | 5 | 4.4 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL564057 | 14031 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 3 | ChEMBL | 454 | 7 | 1 | 5 | 4.4 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| 71524764 | 144528 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 833 | 16 | 5 | 14 | 6.5 | COc1cc(-c2noc(CCCN(C)[C@H]3CC[C@H](OC(=O)C(O)(c4cccs4)c4cccs4)CC3)n2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3906438 | 144528 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 833 | 16 | 5 | 14 | 6.5 | COc1cc(-c2noc(CCCN(C)[C@H]3CC[C@H](OC(=O)C(O)(c4cccs4)c4cccs4)CC3)n2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 54592025 | 148083 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 695 | 18 | 5 | 10 | 6.4 | CN(CCCCCCCCCNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12)C1CCC(OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3934254 | 148083 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 695 | 18 | 5 | 10 | 6.4 | CN(CCCCCCCCCNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12)C1CCC(OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 44232927 | 197793 | None | 8 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 349 | 4 | 1 | 6 | 2.7 | O=C(O[C@H]1CN2CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL551729 | 197793 | None | 8 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 349 | 4 | 1 | 6 | 2.7 | O=C(O[C@H]1CN2CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| 86765983 | 145902 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 342 | 4 | 0 | 2 | 4.1 | C[C@@](C(=O)O[C@@H]1CC2CCC1[N+]2(C)C)(c1ccccc1)C1CCCC1 | nan | |||
| CHEMBL3917058 | 145902 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 342 | 4 | 0 | 2 | 4.1 | C[C@@](C(=O)O[C@@H]1CC2CCC1[N+]2(C)C)(c1ccccc1)C1CCCC1 | nan | |||
| 44233401 | 13629 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1ccsc1)c1ccsc1 | 10.1021/jm900132z | |||
| CHEMBL1194321 | 13629 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1ccsc1)c1ccsc1 | 10.1021/jm900132z | |||
| CHEMBL551327 | 13629 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 484 | 9 | 1 | 6 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1ccsc1)c1ccsc1 | 10.1021/jm900132z | |||
| 44233177 | 13905 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 484 | 7 | 0 | 4 | 5.7 | CC1(C(=O)O[C@H]2C[N+]3(CCCOc4ccccc4)CCC2CC3)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL1196246 | 13905 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 484 | 7 | 0 | 4 | 5.7 | CC1(C(=O)O[C@H]2C[N+]3(CCCOc4ccccc4)CCC2CC3)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL556221 | 13905 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 484 | 7 | 0 | 4 | 5.7 | CC1(C(=O)O[C@H]2C[N+]3(CCCOc4ccccc4)CCC2CC3)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| 44233403 | 13906 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 478 | 9 | 1 | 5 | 4.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL1196247 | 13906 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 478 | 9 | 1 | 5 | 4.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL556222 | 13906 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 478 | 9 | 1 | 5 | 4.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| 53372934 | 129368 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 344 | 4 | 1 | 3 | 3.0 | C[N+]1(C)C2CCC1[C@H](OC(=O)[C@@](O)(c1ccccc1)C1CCCC1)C2 | nan | |||
| CHEMBL3670826 | 129368 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 344 | 4 | 1 | 3 | 3.0 | C[N+]1(C)C2CCC1[C@H](OC(=O)[C@@](O)(c1ccccc1)C1CCCC1)C2 | nan | |||
| 53372936 | 129369 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 344 | 4 | 1 | 3 | 3.0 | C[N+]1(C)C2CCC1[C@@H](OC(=O)[C@@](O)(c1ccccc1)C1CCCC1)C2 | nan | |||
| CHEMBL3670827 | 129369 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 344 | 4 | 1 | 3 | 3.0 | C[N+]1(C)C2CCC1[C@@H](OC(=O)[C@@](O)(c1ccccc1)C1CCCC1)C2 | nan | |||
| 11693 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| 3494 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| 3494.0 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| 4302 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| 7459 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| 9933193 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| 9933193.0 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| CHEMBL1201335 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| DB00986 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2010.10.016 | |||
| 11693 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| 3494 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| 3494.0 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| 4302 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| 7459 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| 9933193 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| 9933193.0 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1201335 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| DB00986 | 1827 | None | 12 | Human | Binding | pIC50 | = | 9.6 | 9.6 | -1 | 5 | ChEMBL | 318 | 4 | 1 | 3 | 2.5 | O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C | 10.1016/j.bmcl.2011.10.002 | |||
| 57392462 | 68786 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 481 | 9 | 0 | 4 | 5.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCCc3ccccc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921928 | 68786 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 481 | 9 | 0 | 4 | 5.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCCc3ccccc3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57400294 | 68863 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 507 | 7 | 0 | 7 | 4.9 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3noc(-c4ccccc4)n3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922058 | 68863 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 507 | 7 | 0 | 7 | 4.9 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3noc(-c4ccccc4)n3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 24988644 | 69159 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 345 | 4 | 0 | 3 | 3.2 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924029 | 69159 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 345 | 4 | 0 | 3 | 3.2 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72545786 | 103696 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 449 | 6 | 1 | 3 | 5.0 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccccc1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087237 | 103696 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 449 | 6 | 1 | 3 | 5.0 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccccc1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546993 | 103720 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 468 | 6 | 1 | 4 | 4.5 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ncccc1F | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087370 | 103720 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 468 | 6 | 1 | 4 | 4.5 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ncccc1F | 10.1016/j.bmcl.2013.09.092 | |||
| 72547254 | 103725 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 518 | 6 | 1 | 4 | 5.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccc(C(F)(F)F)nc1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087375 | 103725 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 518 | 6 | 1 | 4 | 5.4 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccc(C(F)(F)F)nc1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546263 | 103777 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 473 | 6 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)no3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087954 | 103777 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 473 | 6 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)no3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 69167248 | 103783 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 4.1 | C[N+]1(C)CCC(OC(=O)C2(c3ccccc3)CCCCCC2)CC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087960 | 103783 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 330 | 3 | 0 | 2 | 4.1 | C[N+]1(C)CCC(OC(=O)C2(c3ccccc3)CCCCCC2)CC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 44236101 | 14033 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 456 | 5 | 1 | 4 | 4.4 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(O)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL1197261 | 14033 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 456 | 5 | 1 | 4 | 4.4 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(O)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL564515 | 14033 | None | 0 | Human | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | 456 | 5 | 1 | 4 | 4.4 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(O)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| 10208897 | 63147 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 455 | 8 | 0 | 2 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779049 | 63147 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 455 | 8 | 0 | 2 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789387 | 63147 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 455 | 8 | 0 | 2 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10143718 | 63154 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 5.6 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779131 | 63154 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 5.6 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789435 | 63154 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 5.6 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 71558563 | 143867 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 758 | 14 | 5 | 13 | 5.2 | CN(CCCn1c(=O)oc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3900995 | 143867 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 758 | 14 | 5 | 13 | 5.2 | CN(CCCn1c(=O)oc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 54673357 | 145701 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 795 | 17 | 5 | 12 | 6.7 | COc1cc(OCCCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3915601 | 145701 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 795 | 17 | 5 | 12 | 6.7 | COc1cc(OCCCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 53372938 | 129370 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 344 | 4 | 1 | 3 | 3.0 | C[N+]1(C)C2CCC1[C@@H](OC(=O)[C@](O)(c1ccccc1)C1CCCC1)C2 | nan | |||
| CHEMBL3670828 | 129370 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 344 | 4 | 1 | 3 | 3.0 | C[N+]1(C)C2CCC1[C@@H](OC(=O)[C@](O)(c1ccccc1)C1CCCC1)C2 | nan | |||
| 1734 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 307 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| CHEMBL168067 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1021/acs.jmedchem.6b01422 | |||
| 11569908 | 14006 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 440 | 5 | 0 | 3 | 5.3 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL1197028 | 14006 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 440 | 5 | 0 | 3 | 5.3 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL559106 | 14006 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 440 | 5 | 0 | 3 | 5.3 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| 44232930 | 199149 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 343 | 4 | 1 | 5 | 2.6 | O=C(O[C@H]1CN2CCC1CC2)[C@@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL564747 | 199149 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 343 | 4 | 1 | 5 | 2.6 | O=C(O[C@H]1CN2CCC1CC2)[C@@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| 57399406 | 68779 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 462 | 8 | 0 | 4 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3cccnc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921921 | 68779 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 462 | 8 | 0 | 4 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3cccnc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57397746 | 68782 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 502 | 8 | 0 | 5 | 5.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3nc4ccccc4o3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921924 | 68782 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 502 | 8 | 0 | 5 | 5.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3nc4ccccc4o3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57394233 | 68790 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 477 | 8 | 0 | 4 | 4.9 | Cc1ccc(OCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)cc1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921932 | 68790 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 477 | 8 | 0 | 4 | 4.9 | Cc1ccc(OCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)cc1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57395097 | 68861 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 501 | 7 | 0 | 6 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3nc(-c4ccccc4)no3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922056 | 68861 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 501 | 7 | 0 | 6 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3nc(-c4ccccc4)no3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72546494 | 103781 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 474 | 6 | 0 | 5 | 5.6 | O=C(O[C@H]1C[N+]2(Cc3nnc(-c4ccccc4)o3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087958 | 103781 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 474 | 6 | 0 | 5 | 5.6 | O=C(O[C@H]1C[N+]2(Cc3nnc(-c4ccccc4)o3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 367 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| 5487427 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| 5487427.0 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| 8592 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| CHEMBL1900528 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| CHEMBL3305968 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| CHEMBL4650755 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| DB01409 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 2 | 9 | 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 | 10.1021/jm900132z | |||
| 20735153 | 13628 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 468 | 9 | 0 | 5 | 5.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL1194314 | 13628 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 468 | 9 | 0 | 5 | 5.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL551063 | 13628 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 468 | 9 | 0 | 5 | 5.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| 11489419 | 13623 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 448 | 10 | 1 | 5 | 5.2 | CCCCCCC[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900132z | |||
| CHEMBL1194274 | 13623 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 448 | 10 | 1 | 5 | 5.2 | CCCCCCC[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900132z | |||
| CHEMBL549784 | 13623 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 448 | 10 | 1 | 5 | 5.2 | CCCCCCC[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900132z | |||
| 44232931 | 198837 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 335 | 4 | 1 | 5 | 2.8 | O=C(O[C@H]1CN2CCC1CC2)[C@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| CHEMBL562642 | 198837 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 335 | 4 | 1 | 5 | 2.8 | O=C(O[C@H]1CN2CCC1CC2)[C@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| 57390666 | 68784 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 518 | 8 | 0 | 5 | 5.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3ccc4ncsc4c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921926 | 68784 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 518 | 8 | 0 | 5 | 5.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCc3ccc4ncsc4c3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57396866 | 68862 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 506 | 7 | 0 | 6 | 5.5 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)no3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922057 | 68862 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 506 | 7 | 0 | 6 | 5.5 | C[C@@](C(=O)O[C@H]1C[N+]2(Cc3cc(-c4ccccc4)no3)CCC1CC2)(c1cccs1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72546028 | 103702 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 457 | 6 | 1 | 6 | 3.9 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ncns1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087244 | 103702 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 457 | 6 | 1 | 6 | 3.9 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ncns1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72547256 | 103727 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1nccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087377 | 103727 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1nccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546264 | 103778 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 472 | 6 | 0 | 4 | 5.8 | O=C(O[C@H]1C[N+]2(Cc3ccn(-c4ccccc4)n3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087955 | 103778 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 472 | 6 | 0 | 4 | 5.8 | O=C(O[C@H]1C[N+]2(Cc3ccn(-c4ccccc4)n3)CCC1CC2)C1(C2=CC=CC2)CCCCCC1 | 10.1016/j.bmcl.2013.09.092 | |||
| 367 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| 5487427 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| 5487427.0 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| 8592 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL1900528 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3305968 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL4650755 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| DB01409 | 3824 | None | 10 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 2 | 9 | 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 | 10.1016/j.bmcl.2015.02.065 | |||
| 71556977 | 142631 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 769 | 15 | 5 | 13 | 5.9 | CN(CCCc1nc(-c2ccc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)cc2)no1)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3890898 | 142631 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 769 | 15 | 5 | 13 | 5.9 | CN(CCCc1nc(-c2ccc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)cc2)no1)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 71566009 | 144395 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 838 | 17 | 5 | 13 | 5.4 | COc1cc(OCC(=O)N(C)CCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3905320 | 144395 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 838 | 17 | 5 | 13 | 5.4 | COc1cc(OCC(=O)N(C)CCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 71558416 | 151416 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 757 | 14 | 6 | 12 | 4.9 | CN(CCCn1c(=O)[nH]c2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3961014 | 151416 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 757 | 14 | 6 | 12 | 4.9 | CN(CCCn1c(=O)[nH]c2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 121347973 | 151717 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 732 | 14 | 5 | 13 | 4.6 | CN(CCCn1nnc2cc(CNC[C@H](O)c3ccc(O)c4c3OCC(=O)N4)ccc21)[C@H]1CC[C@H](OC(=O)[C@](O)(c2cccs2)C2CCCC2)CC1 | nan | |||
| CHEMBL3963770 | 151717 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 732 | 14 | 5 | 13 | 4.6 | CN(CCCn1nnc2cc(CNC[C@H](O)c3ccc(O)c4c3OCC(=O)N4)ccc21)[C@H]1CC[C@H](OC(=O)[C@](O)(c2cccs2)C2CCCC2)CC1 | nan | |||
| 1734 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2016.11.014 | |||
| 307 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2016.11.014 | |||
| CHEMBL168067 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2016.11.014 | |||
| 1734 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2016.03.006 | |||
| 307 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2016.03.006 | |||
| CHEMBL168067 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2016.03.006 | |||
| 44236098 | 198104 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 343 | 4 | 1 | 5 | 2.6 | O=C(O[C@H]1CN2CCC1CC2)[C@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL556426 | 198104 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 343 | 4 | 1 | 5 | 2.6 | O=C(O[C@H]1CN2CCC1CC2)[C@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| 1734 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2013.03.016 | |||
| 307 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2013.03.016 | |||
| CHEMBL168067 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.4 | 9.4 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.bmc.2013.03.016 | |||
| 44236340 | 13797 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 482 | 9 | 1 | 5 | 5.2 | O=C(O[C@H]1C[N+]2(CCCCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL1195513 | 13797 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 482 | 9 | 1 | 5 | 5.2 | O=C(O[C@H]1C[N+]2(CCCCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL554725 | 13797 | None | 0 | Human | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 482 | 9 | 1 | 5 | 5.2 | O=C(O[C@H]1C[N+]2(CCCCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| 44232685 | 14034 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 478 | 9 | 1 | 5 | 4.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL1197273 | 14034 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 478 | 9 | 1 | 5 | 4.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL564765 | 14034 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 478 | 9 | 1 | 5 | 4.6 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@](O)(c1ccccc1)c1cccs1 | 10.1021/jm900132z | |||
| 10119939 | 63148 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 467 | 8 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1777827 | 63148 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 467 | 8 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789388 | 63148 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 467 | 8 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 71558718 | 144810 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 774 | 14 | 5 | 13 | 5.7 | CN(CCCn1c(=O)sc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3908788 | 144810 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 774 | 14 | 5 | 13 | 5.7 | CN(CCCn1c(=O)sc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 57392515 | 68797 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 491 | 10 | 0 | 4 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOCCc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921939 | 68797 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 491 | 10 | 0 | 4 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOCCc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72545783 | 103693 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 438 | 7 | 0 | 4 | 4.7 | Cn1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087234 | 103693 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 438 | 7 | 0 | 4 | 4.7 | Cn1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546994 | 103721 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 464 | 6 | 1 | 4 | 4.7 | Cc1ccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)nc1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087371 | 103721 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 464 | 6 | 1 | 4 | 4.7 | Cc1ccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)nc1 | 10.1016/j.bmcl.2013.09.092 | |||
| 1734 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.3 | 9.3 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 307 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.3 | 9.3 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| CHEMBL168067 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.3 | 9.3 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1016/j.ejmech.2013.01.044 | |||
| 44232681 | 14020 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 482 | 9 | 0 | 5 | 5.7 | CC(C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL1197156 | 14020 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 482 | 9 | 0 | 5 | 5.7 | CC(C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| CHEMBL561187 | 14020 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 482 | 9 | 0 | 5 | 5.7 | CC(C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1cccs1)c1cccs1 | 10.1021/jm900132z | |||
| 1734 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1021/jm8007618 | |||
| 307 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1021/jm8007618 | |||
| CHEMBL168067 | 116 | None | 5 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 12 | ChEMBL | 324 | 4 | 0 | 2 | 3.6 | O=C(C(c1ccccc1)c1ccccc1)OC1CC[N+](CC1)(C)C | 10.1021/jm8007618 | |||
| 9928017 | 62359 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 342 | 4 | 0 | 4 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779033 | 62359 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 342 | 4 | 0 | 4 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1cccs1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10229167 | 63145 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 427 | 9 | 0 | 3 | 5.7 | CCCCN(C(=O)O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779136 | 63145 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 427 | 9 | 0 | 3 | 5.7 | CCCCN(C(=O)O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789385 | 63145 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 427 | 9 | 0 | 3 | 5.7 | CCCCN(C(=O)O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10393952 | 63149 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 529 | 8 | 0 | 3 | 6.1 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1cc(F)c(F)c(F)c1)c1cccc(F)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779140 | 63149 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 529 | 8 | 0 | 3 | 6.1 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1cc(F)c(F)c(F)c1)c1cccc(F)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789389 | 63149 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 529 | 8 | 0 | 3 | 6.1 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1cc(F)c(F)c(F)c1)c1cccc(F)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10187216 | 63158 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 461 | 8 | 0 | 3 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779128 | 63158 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 461 | 8 | 0 | 3 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789452 | 63158 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 461 | 8 | 0 | 3 | 6.1 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10143858 | 63159 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 467 | 8 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779132 | 63159 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 467 | 8 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789454 | 63159 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 467 | 8 | 0 | 4 | 6.2 | O=C(O[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 44236336 | 14018 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 364 | 4 | 1 | 5 | 2.8 | C[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900132z | |||
| CHEMBL1197131 | 14018 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 364 | 4 | 1 | 5 | 2.8 | C[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900132z | |||
| CHEMBL560327 | 14018 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 364 | 4 | 1 | 5 | 2.8 | C[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(c1cccs1)c1cccs1)C2 | 10.1021/jm900132z | |||
| 71558567 | 142768 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 740 | 14 | 5 | 11 | 6.2 | CN(CCCn1ccc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3892021 | 142768 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 740 | 14 | 5 | 11 | 6.2 | CN(CCCn1ccc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 121347950 | 151321 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 728 | 14 | 5 | 12 | 5.1 | CN(CCCn1nnc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)[C@](O)(c2cccs2)C2CCCC2)CC1 | nan | |||
| CHEMBL3960091 | 151321 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 728 | 14 | 5 | 12 | 5.1 | CN(CCCn1nnc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)[C@](O)(c2cccs2)C2CCCC2)CC1 | nan | |||
| 44232683 | 13631 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 472 | 9 | 1 | 4 | 4.5 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1ccccc1)c1ccccc1 | 10.1021/jm900132z | |||
| CHEMBL1194336 | 13631 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 472 | 9 | 1 | 4 | 4.5 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1ccccc1)c1ccccc1 | 10.1021/jm900132z | |||
| CHEMBL551731 | 13631 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 472 | 9 | 1 | 4 | 4.5 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1ccccc1)c1ccccc1 | 10.1021/jm900132z | |||
| 57399408 | 68787 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921929 | 68787 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 463 | 8 | 0 | 4 | 4.6 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57395989 | 68794 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 495 | 9 | 0 | 4 | 5.1 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccc(F)cc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921936 | 68794 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 495 | 9 | 0 | 4 | 5.1 | C[C@@](C(=O)O[C@H]1C[N+]2(CCCOc3ccc(F)cc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57391773 | 69176 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 425 | 7 | 0 | 3 | 4.9 | CC(C)=CCC[N+]12CCC(CC1)[C@@H](OC(=O)[C@](C)(c1ccccc1)N1CCCCC1)C2 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924046 | 69176 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 425 | 7 | 0 | 3 | 4.9 | CC(C)=CCC[N+]12CCC(CC1)[C@@H](OC(=O)[C@](C)(c1ccccc1)N1CCCCC1)C2 | 10.1016/j.bmcl.2011.10.002 | |||
| 72546738 | 103717 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 451 | 6 | 1 | 5 | 3.8 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cncnc1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087366 | 103717 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 451 | 6 | 1 | 5 | 3.8 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1cncnc1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72546995 | 103722 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 468 | 6 | 1 | 4 | 4.5 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccc(F)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087372 | 103722 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 468 | 6 | 1 | 4 | 4.5 | O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C1(C3=CC=CC3)CCCCCC1)C2)Nc1ccc(F)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72543915 | 103771 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1cncc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087948 | 103771 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1cncc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| 10007638 | 120940 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 467 | 8 | 2 | 4 | 4.4 | O=C(N[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3401648 | 120940 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 467 | 8 | 2 | 4 | 4.4 | O=C(N[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3559195 | 120940 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 467 | 8 | 2 | 4 | 4.4 | O=C(N[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| 67548926 | 120942 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 473 | 8 | 2 | 5 | 4.5 | O=C(N[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3401649 | 120942 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 473 | 8 | 2 | 5 | 4.5 | O=C(N[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3559201 | 120942 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 473 | 8 | 2 | 5 | 4.5 | O=C(N[C@H]1C[N+]2(CCCc3cccs3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| 10325942 | 120943 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 469 | 8 | 2 | 5 | 3.9 | O=C(N[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3401650 | 120943 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 469 | 8 | 2 | 5 | 3.9 | O=C(N[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3559202 | 120943 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 469 | 8 | 2 | 5 | 3.9 | O=C(N[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1 | 10.1016/j.bmcl.2015.02.065 | |||
| 44236099 | 198011 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 335 | 4 | 1 | 5 | 2.8 | O=C(O[C@H]1CN2CCC1CC2)[C@@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| CHEMBL554699 | 198011 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 335 | 4 | 1 | 5 | 2.8 | O=C(O[C@H]1CN2CCC1CC2)[C@@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| 54673354 | 148814 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 808 | 16 | 6 | 12 | 5.9 | COc1cc(NC(=O)CCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CCNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3940214 | 148814 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 808 | 16 | 6 | 12 | 5.9 | COc1cc(NC(=O)CCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CCNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 44236332 | 14022 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 470 | 7 | 1 | 4 | 4.5 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL1197183 | 14022 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 470 | 7 | 1 | 4 | 4.5 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL561870 | 14022 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 470 | 7 | 1 | 4 | 4.5 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| 72548703 | 161661 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | 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 | 161661 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | 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 | |||
| 939077 | 197315 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 335 | 2 | 0 | 4 | 3.6 | O=C(O[C@H]1CN2CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL549577 | 197315 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 335 | 2 | 0 | 4 | 3.6 | O=C(O[C@H]1CN2CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| 57397791 | 68796 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 477 | 9 | 0 | 4 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOCc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921938 | 68796 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 477 | 9 | 0 | 4 | 4.8 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOCc3ccccc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57402222 | 69160 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 353 | 4 | 0 | 3 | 3.6 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1C=CC=CC=C1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924030 | 69160 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 353 | 4 | 0 | 3 | 3.6 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1C=CC=CC=C1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57397002 | 69161 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 363 | 4 | 0 | 4 | 2.7 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1CCSCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924031 | 69161 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 363 | 4 | 0 | 4 | 2.7 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1CCSCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 72547252 | 103723 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 464 | 6 | 1 | 4 | 4.7 | Cc1ccnc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)c1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087373 | 103723 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 464 | 6 | 1 | 4 | 4.7 | Cc1ccnc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)c1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72547255 | 103726 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 464 | 6 | 1 | 4 | 4.7 | Cc1ccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087376 | 103726 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 464 | 6 | 1 | 4 | 4.7 | Cc1ccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72547498 | 103729 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1ccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)nn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087379 | 103729 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1ccc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)nn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72547501 | 103770 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1cnc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087947 | 103770 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1cnc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)cn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 11678378 | 120950 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 469 | 7 | 1 | 3 | 5.1 | O=C(N[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3401654 | 120950 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 469 | 7 | 1 | 3 | 5.1 | O=C(N[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3559211 | 120950 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 469 | 7 | 1 | 3 | 5.1 | O=C(N[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1c2ccccc2Oc2ccccc21 | 10.1016/j.bmcl.2015.02.065 | |||
| 10164137 | 63146 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 423 | 9 | 0 | 3 | 5.1 | CCCCN(C(=O)O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779137 | 63146 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 423 | 9 | 0 | 3 | 5.1 | CCCCN(C(=O)O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789386 | 63146 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 423 | 9 | 0 | 3 | 5.1 | CCCCN(C(=O)O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10300661 | 63157 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 421 | 9 | 0 | 2 | 5.7 | CCCCN(C(=O)O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779135 | 63157 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 421 | 9 | 0 | 2 | 5.7 | CCCCN(C(=O)O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789451 | 63157 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 421 | 9 | 0 | 2 | 5.7 | CCCCN(C(=O)O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 117628769 | 145114 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 772 | 15 | 5 | 13 | 5.2 | CN(CCCn1c(=O)oc2cc(CCNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3911114 | 145114 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 772 | 15 | 5 | 13 | 5.2 | CN(CCCn1c(=O)oc2cc(CCNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 54586745 | 63160 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 523 | 8 | 0 | 2 | 6.8 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2C[N+]3(CCCc4ccccc4)CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779138 | 63160 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 523 | 8 | 0 | 2 | 6.8 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2C[N+]3(CCCc4ccccc4)CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789461 | 63160 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 523 | 8 | 0 | 2 | 6.8 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2C[N+]3(CCCc4ccccc4)CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| 688566 | 198339 | None | 17 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 3 | ChEMBL | 337 | 4 | 1 | 4 | 2.6 | O=C(O[C@H]1CN2CCC1CC2)C(O)(c1ccccc1)c1ccccc1 | 10.1021/jm900132z | |||
| CHEMBL558910 | 198339 | None | 17 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 3 | ChEMBL | 337 | 4 | 1 | 4 | 2.6 | O=C(O[C@H]1CN2CCC1CC2)C(O)(c1ccccc1)c1ccccc1 | 10.1021/jm900132z | |||
| 44235871 | 199028 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 335 | 2 | 1 | 4 | 2.5 | O=C(O[C@H]1CN2CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL563887 | 199028 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 335 | 2 | 1 | 4 | 2.5 | O=C(O[C@H]1CN2CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| 44236334 | 14017 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 468 | 7 | 0 | 3 | 5.6 | CC1(C(=O)O[C@H]2C[N+]3(CCCOc4ccccc4)CCC2CC3)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL1197117 | 14017 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 468 | 7 | 0 | 3 | 5.6 | CC1(C(=O)O[C@H]2C[N+]3(CCCOc4ccccc4)CCC2CC3)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL559931 | 14017 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 468 | 7 | 0 | 3 | 5.6 | CC1(C(=O)O[C@H]2C[N+]3(CCCOc4ccccc4)CCC2CC3)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| 9946010 | 62360 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 342 | 4 | 0 | 4 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779034 | 62360 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 342 | 4 | 0 | 4 | 4.0 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1ccsc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10208972 | 63152 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 457 | 8 | 0 | 3 | 5.5 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779129 | 63152 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 457 | 8 | 0 | 3 | 5.5 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789429 | 63152 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 457 | 8 | 0 | 3 | 5.5 | O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 57390714 | 68791 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 477 | 8 | 0 | 4 | 4.9 | Cc1cccc(OCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)c1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921933 | 68791 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 477 | 8 | 0 | 4 | 4.9 | Cc1cccc(OCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)c1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57395997 | 68854 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 478 | 7 | 1 | 6 | 3.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cccnn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922049 | 68854 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 478 | 7 | 1 | 6 | 3.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3cccnn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 24988641 | 69163 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 359 | 4 | 0 | 3 | 3.4 | CC1CCN(C(C)(C(=O)OC2CC[N+](C)(C)CC2)c2ccccc2)CC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924033 | 69163 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 359 | 4 | 0 | 3 | 3.4 | CC1CCN(C(C)(C(=O)OC2CC[N+](C)(C)CC2)c2ccccc2)CC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57403964 | 69172 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 385 | 5 | 0 | 3 | 3.9 | CC(C)[N+]12CCC(CC1)[C@@H](OC(=O)[C@](C)(c1ccccc1)N1CCCCC1)C2 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924042 | 69172 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 385 | 5 | 0 | 3 | 3.9 | CC(C)[N+]12CCC(CC1)[C@@H](OC(=O)[C@](C)(c1ccccc1)N1CCCCC1)C2 | 10.1016/j.bmcl.2011.10.002 | |||
| 72545782 | 103692 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 463 | 7 | 0 | 3 | 6.0 | Cc1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)c(C)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087233 | 103692 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 463 | 7 | 0 | 3 | 6.0 | Cc1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)c(C)n1 | 10.1016/j.bmcl.2013.09.092 | |||
| 72547497 | 103728 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1cc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)ncn1 | 10.1016/j.bmcl.2013.09.092 | |||
| CHEMBL3087378 | 103728 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 465 | 6 | 1 | 5 | 4.1 | Cc1cc(NC(=O)C[N+]23CCC(CC2)[C@@H](OC(=O)C2(C4=CC=CC4)CCCCCC2)C3)ncn1 | 10.1016/j.bmcl.2013.09.092 | |||
| 71565927 | 146749 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 758 | 12 | 4 | 11 | 6.3 | CN(CCCn1c(=O)oc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C2(C)c3ccccc3Oc3ccccc32)CC1 | nan | |||
| CHEMBL3923686 | 146749 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 758 | 12 | 4 | 11 | 6.3 | CN(CCCn1c(=O)oc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C2(C)c3ccccc3Oc3ccccc32)CC1 | nan | |||
| 54672858 | 151562 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 794 | 16 | 7 | 12 | 5.9 | COc1cc(NC(=O)CCCN[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3962171 | 151562 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 794 | 16 | 7 | 12 | 5.9 | COc1cc(NC(=O)CCCN[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 44233175 | 14024 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 440 | 5 | 1 | 3 | 4.3 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL1197209 | 14024 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 440 | 5 | 1 | 3 | 4.3 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL562655 | 14024 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 440 | 5 | 1 | 3 | 4.3 | O=C(O[C@H]1C[N+]2(CCc3ccccc3)CCC1CC2)C1(O)c2ccccc2-c2ccccc21 | 10.1021/jm900132z | |||
| 44233173 | 14025 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 486 | 7 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(O)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL1197216 | 14025 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 486 | 7 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(O)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| CHEMBL562890 | 14025 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 486 | 7 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C1(O)c2ccccc2Oc2ccccc21 | 10.1021/jm900132z | |||
| 23724781 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| 23724781.0 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| 316 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| 317 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| 71183 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| CHEMBL1354199 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| CHEMBL3140030 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| CHEMBL376897 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| DB00462 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | 10.1016/s0960-894x(98)00351-5 | |||
| 10246307 | 117842 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 334 | 4 | 2 | 4 | 2.3 | O=C(N[C@H]1CN2CCC1CC2)[C@](O)(c1cccs1)C1CCCC1 | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL3401643 | 117842 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 334 | 4 | 2 | 4 | 2.3 | O=C(N[C@H]1CN2CCC1CC2)[C@](O)(c1cccs1)C1CCCC1 | 10.1016/j.bmcl.2015.02.065 | |||
| 54590925 | 153402 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 794 | 15 | 6 | 12 | 5.9 | COc1cc(NC(=O)CCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3978112 | 153402 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 794 | 15 | 6 | 12 | 5.9 | COc1cc(NC(=O)CCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 23724781 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| 23724781.0 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| 316 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| 317 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| 71183 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| CHEMBL1354199 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| CHEMBL3140030 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| CHEMBL376897 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| DB00462 | 2835 | None | 13 | Human | Binding | pIC50 | = | 9.0 | 9.0 | -2 | 9 | ChEMBL | 318 | 4 | 1 | 4 | 1.1 | OC[C@H](c1ccccc1)C(=O)OC1C[C@@H]2[C@@H]3[C@H]([C@H](C1)[N+]2(C)C)O3 | nan | |||
| 9967590 | 62161 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 336 | 4 | 0 | 3 | 3.9 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1777826 | 62161 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 336 | 4 | 0 | 3 | 3.9 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 54582845 | 63151 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 525 | 8 | 0 | 3 | 6.2 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2C[N+]3(CCOc4ccccc4)CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779139 | 63151 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 525 | 8 | 0 | 3 | 6.2 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2C[N+]3(CCOc4ccccc4)CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1789405 | 63151 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 525 | 8 | 0 | 3 | 6.2 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2C[N+]3(CCOc4ccccc4)CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| 50925542 | 19184 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 405 | 3 | 0 | 5 | 3.6 | Cc1nc(C(=O)N2CCOC3(CCN(Cc4cccc(Cl)c4)CC3)C2)cs1 | 10.1016/j.bmcl.2010.10.016 | |||
| CHEMBL1289653 | 19184 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 405 | 3 | 0 | 5 | 3.6 | Cc1nc(C(=O)N2CCOC3(CCN(Cc4cccc(Cl)c4)CC3)C2)cs1 | 10.1016/j.bmcl.2010.10.016 | |||
| 57401170 | 68780 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 476 | 8 | 0 | 4 | 4.9 | Cc1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)cn1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921922 | 68780 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 476 | 8 | 0 | 4 | 4.9 | Cc1ccc(CCC[N+]23CCC(CC2)[C@@H](OC(=O)[C@](C)(c2ccccc2)N2CCCCC2)C3)cn1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57397790 | 68789 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 497 | 8 | 0 | 4 | 5.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOc3ccc(Cl)cc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921931 | 68789 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 497 | 8 | 0 | 4 | 5.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CCOc3ccc(Cl)cc3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57402970 | 68853 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 478 | 7 | 1 | 6 | 3.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccncn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1922048 | 68853 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 478 | 7 | 1 | 6 | 3.0 | C[C@@](C(=O)O[C@H]1C[N+]2(CC(=O)Nc3ccncn3)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 24988643 | 69162 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 381 | 4 | 0 | 3 | 3.4 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1CCC(F)(F)CC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924032 | 69162 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 381 | 4 | 0 | 3 | 3.4 | CC(C(=O)OC1CC[N+](C)(C)CC1)(c1ccccc1)N1CCC(F)(F)CC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 1201549 | 597 | None | 17 | Human | Binding | pIC50 | = | 8.9 | 8.9 | -1 | 20 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 1201549.0 | 597 | None | 17 | Human | Binding | pIC50 | = | 8.9 | 8.9 | -1 | 20 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 333 | 597 | None | 17 | Human | Binding | pIC50 | = | 8.9 | 8.9 | -1 | 20 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 7601 | 597 | None | 17 | Human | Binding | pIC50 | = | 8.9 | 8.9 | -1 | 20 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL1201203 | 597 | None | 17 | Human | Binding | pIC50 | = | 8.9 | 8.9 | -1 | 20 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| CHEMBL438151 | 597 | None | 17 | Human | Binding | pIC50 | = | 8.9 | 8.9 | -1 | 20 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| DB00245 | 597 | None | 17 | Human | Binding | pIC50 | = | 8.9 | 8.9 | -1 | 20 | ChEMBL | 307 | 4 | 0 | 2 | 4.4 | CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1 | nan | |||
| 54592027 | 144080 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 717 | 15 | 5 | 11 | 5.3 | CN(CCOc1ccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1)C1CCC(OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3902803 | 144080 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 717 | 15 | 5 | 11 | 5.3 | CN(CCOc1ccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1)C1CCC(OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 54583840 | 62371 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 404 | 4 | 0 | 3 | 4.7 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2CN3CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779045 | 62371 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 404 | 4 | 0 | 3 | 4.7 | Cc1cccc(N(Cc2cc(F)c(F)cc2F)C(=O)O[C@H]2CN3CCC2CC3)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| 118638354 | 145675 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 774 | 17 | 5 | 11 | 5.3 | CN(CCN(C)[C@H]1CC[C@H](OC(C(=O)O)(c2cccs2)c2cccs2)CC1)C(=O)COc1ccc(CNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1 | nan | |||
| CHEMBL3915401 | 145675 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 774 | 17 | 5 | 11 | 5.3 | CN(CCN(C)[C@H]1CC[C@H](OC(C(=O)O)(c2cccs2)c2cccs2)CC1)C(=O)COc1ccc(CNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1 | nan | |||
| 54673189 | 149250 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 801 | 15 | 6 | 14 | 5.3 | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(C#N)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3943564 | 149250 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 801 | 15 | 6 | 14 | 5.3 | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(C#N)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 25147683 | 62372 | None | 31 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 408 | 4 | 0 | 3 | 4.5 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1cc(F)c(F)c(F)c1)c1cccc(F)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779046 | 62372 | None | 31 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 408 | 4 | 0 | 3 | 4.5 | O=C(O[C@H]1CN2CCC1CC2)N(Cc1cc(F)c(F)c(F)c1)c1cccc(F)c1 | 10.1016/j.bmcl.2011.03.096 | |||
| 10372836 | 102452 | None | 36 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 739 | 13 | 6 | 9 | 6.4 | COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | 10.1021/acs.jmedchem.8b01520 | |||
| CHEMBL3039518 | 102452 | None | 36 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 739 | 13 | 6 | 9 | 6.4 | COc1cc(NC(=O)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | 10.1021/acs.jmedchem.8b01520 | |||
| 54591014 | 145858 | None | 5 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 810 | 15 | 6 | 13 | 6.1 | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | 10.1021/acs.jmedchem.8b01520 | |||
| CHEMBL3916700 | 145858 | None | 5 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 810 | 15 | 6 | 13 | 6.1 | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | 10.1021/acs.jmedchem.8b01520 | |||
| 71558565 | 167538 | None | 10 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 742 | 14 | 5 | 13 | 5.0 | CN(CCCn1nnc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | 10.1021/acs.jmedchem.8b01520 | |||
| CHEMBL4297483 | 167538 | None | 10 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 742 | 14 | 5 | 13 | 5.0 | CN(CCCn1nnc2cc(CNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)ccc21)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | 10.1021/acs.jmedchem.8b01520 | |||
| 155531077 | 171723 | None | 2 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 669 | 10 | 4 | 10 | 4.4 | CC(C)c1ncc(C(=O)N2CCOC3(CCN(Cc4ccc(F)c(CCNC[C@H](O)c5ccc(O)c6[nH]c(=O)sc56)c4)CC3)C2)s1 | 10.1021/acs.jmedchem.8b01520 | |||
| CHEMBL4465556 | 171723 | None | 2 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 669 | 10 | 4 | 10 | 4.4 | CC(C)c1ncc(C(=O)N2CCOC3(CCN(Cc4ccc(F)c(CCNC[C@H](O)c5ccc(O)c6[nH]c(=O)sc56)c4)CC3)C2)s1 | 10.1021/acs.jmedchem.8b01520 | |||
| 57397743 | 68773 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 486 | 7 | 1 | 3 | 5.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3c[nH]c4ccccc34)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1921913 | 68773 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 486 | 7 | 1 | 3 | 5.3 | C[C@@](C(=O)O[C@H]1C[N+]2(CCc3c[nH]c4ccccc34)CCC1CC2)(c1ccccc1)N1CCCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 57393499 | 71622 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 316 | 4 | 0 | 2 | 3.5 | CC(C(=O)O[C@@H]1CC[N+](C)(C)C1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1924026 | 71622 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 316 | 4 | 0 | 2 | 3.5 | CC(C(=O)O[C@@H]1CC[N+](C)(C)C1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| CHEMBL1963231 | 71622 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 316 | 4 | 0 | 2 | 3.5 | CC(C(=O)O[C@@H]1CC[N+](C)(C)C1)(c1ccccc1)C1CCCC1 | 10.1016/j.bmcl.2011.10.002 | |||
| 54591014 | 145858 | None | 5 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 810 | 15 | 6 | 13 | 6.1 | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| CHEMBL3916700 | 145858 | None | 5 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 810 | 15 | 6 | 13 | 6.1 | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 | nan | |||
| 54673020 | 151675 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 766 | 14 | 6 | 11 | 5.5 | CN(CCC(=O)Nc1cc(F)c(CNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1F)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| CHEMBL3963417 | 151675 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 766 | 14 | 6 | 11 | 5.5 | CN(CCC(=O)Nc1cc(F)c(CNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1F)[C@H]1CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)CC1 | nan | |||
| 10143954 | 13624 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 470 | 9 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| CHEMBL1194286 | 13624 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 470 | 9 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| CHEMBL549986 | 13624 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 470 | 9 | 1 | 5 | 4.7 | O=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)[C@@](O)(c1cccs1)C1CCCC1 | 10.1021/jm900132z | |||
| 11306852 | 14030 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 434 | 8 | 1 | 3 | 5.0 | CCCCCCC[N+]12CCC(CC1)[C@@H](OC(=O)C1(O)c3ccccc3-c3ccccc31)C2 | 10.1021/jm900132z | |||
| CHEMBL1197250 | 14030 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 434 | 8 | 1 | 3 | 5.0 | CCCCCCC[N+]12CCC(CC1)[C@@H](OC(=O)C1(O)c3ccccc3-c3ccccc31)C2 | 10.1021/jm900132z | |||
| CHEMBL563996 | 14030 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 434 | 8 | 1 | 3 | 5.0 | CCCCCCC[N+]12CCC(CC1)[C@@H](OC(=O)C1(O)c3ccccc3-c3ccccc31)C2 | 10.1021/jm900132z | |||
| 325 | 2062 | None | 10 | Human | Binding | pIC50 | = | 8.8 | 8.8 | -1 | 9 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1016/j.bmcl.2015.02.065 | |||
| 3746 | 2062 | None | 10 | Human | Binding | pIC50 | = | 8.8 | 8.8 | -1 | 9 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1016/j.bmcl.2015.02.065 | |||
| 657308 | 2062 | None | 10 | Human | Binding | pIC50 | = | 8.8 | 8.8 | -1 | 9 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1016/j.bmcl.2015.02.065 | |||
| CHEMBL1615433 | 2062 | None | 10 | Human | Binding | pIC50 | = | 8.8 | 8.8 | -1 | 9 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1016/j.bmcl.2015.02.065 | |||
| DB00332 | 2062 | None | 10 | Human | Binding | pIC50 | = | 8.8 | 8.8 | -1 | 9 | ChEMBL | 332 | 5 | 1 | 3 | 2.9 | OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C | 10.1016/j.bmcl.2015.02.065 | |||
| 9944783 | 62363 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 316 | 6 | 0 | 3 | 3.9 | CCCCCN(C(=O)O[C@H]1CN2CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| CHEMBL1779037 | 62363 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 316 | 6 | 0 | 3 | 3.9 | CCCCCN(C(=O)O[C@H]1CN2CCC1CC2)c1ccccc1 | 10.1016/j.bmcl.2011.03.096 | |||
| 54673702 | 149719 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 814 | 15 | 6 | 14 | 5.6 | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2c1OCC(=O)N2 | nan | |||
| CHEMBL3947244 | 149719 | None | 0 | Human | Binding | pIC50 | = | 8.8 | <||||||||||||||