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 |
|
| 90469674 | 171925 | None | 8 | Rat | Functional | pEC50 | = | 10.7 | 10.7 | 3 | 3 | ChEMBL | 945 | 14 | 10 | 11 | 0.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4468523 | 171925 | None | 8 | Rat | Functional | pEC50 | = | 10.7 | 10.7 | 3 | 3 | ChEMBL | 945 | 14 | 10 | 11 | 0.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 2181 | 1331 | None | 29 | Rat | Functional | pEC50 | = | 10.5 | 10.5 | 6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 2182 | 1331 | None | 29 | Rat | Functional | pEC50 | = | 10.5 | 10.5 | 6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 27991 | 1331 | None | 29 | Rat | Functional | pEC50 | = | 10.5 | 10.5 | 6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 27991.0 | 1331 | None | 29 | Rat | Functional | pEC50 | = | 10.5 | 10.5 | 6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| CHEMBL1429 | 1331 | None | 29 | Rat | Functional | pEC50 | = | 10.5 | 10.5 | 6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| CHEMBL264448 | 1331 | None | 29 | Rat | Functional | pEC50 | = | 10.5 | 10.5 | 6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| DB00035 | 1331 | None | 29 | Rat | Functional | pEC50 | = | 10.5 | 10.5 | 6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 44419026 | 168602 | None | 15 | Human | Functional | pEC50 | = | 10.3 | 10.3 | 478 | 3 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL435323 | 168602 | None | 15 | Human | Functional | pEC50 | = | 10.3 | 10.3 | 478 | 3 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 2168 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 2810 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 644077 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 644077.0 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| DB00067 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 118476355 | 173968 | None | 3 | Rat | Functional | pEC50 | = | 10.3 | 10.3 | 5 | 3 | ChEMBL | 1044 | 17 | 10 | 12 | 0.3 | CCN(CC)C(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4539370 | 173968 | None | 3 | Rat | Functional | pEC50 | = | 10.3 | 10.3 | 5 | 3 | ChEMBL | 1044 | 17 | 10 | 12 | 0.3 | CCN(CC)C(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 2168 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 2810 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 644077 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 644077.0 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| DB00067 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 2168 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2005.10.107 | |||||
| 2810 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2005.10.107 | |||||
| 644077 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2005.10.107 | |||||
| 644077.0 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2005.10.107 | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2005.10.107 | |||||
| DB00067 | 3976 | None | 29 | Human | Functional | pEC50 | = | 10.3 | 10.3 | -12 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2005.10.107 | |||||
| 90469674 | 171925 | None | 8 | Human | Functional | pEC50 | = | 10.2 | 10.2 | -3 | 3 | ChEMBL | 945 | 14 | 10 | 11 | 0.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4468523 | 171925 | None | 8 | Human | Functional | pEC50 | = | 10.2 | 10.2 | -3 | 3 | ChEMBL | 945 | 14 | 10 | 11 | 0.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 155523986 | 171013 | None | 0 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 724 | 3 | ChEMBL | 957 | 15 | 12 | 13 | -1.5 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4454891 | 171013 | None | 0 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 724 | 3 | ChEMBL | 957 | 15 | 12 | 13 | -1.5 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 90469608 | 172363 | None | 0 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 812 | 2 | ChEMBL | 975 | 15 | 11 | 12 | -0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCSCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4474518 | 172363 | None | 0 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 812 | 2 | ChEMBL | 975 | 15 | 11 | 12 | -0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCSCC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476384 | 170976 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 1778 | 2 | ChEMBL | 939 | 14 | 11 | 11 | -0.8 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4454160 | 170976 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 1778 | 2 | ChEMBL | 939 | 14 | 11 | 11 | -0.8 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 90469675 | 171520 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 1412 | 2 | ChEMBL | 975 | 15 | 11 | 12 | -0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4462743 | 171520 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 1412 | 2 | ChEMBL | 975 | 15 | 11 | 12 | -0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476338 | 173495 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 2290 | 3 | ChEMBL | 957 | 15 | 12 | 13 | -1.5 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4528032 | 173495 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 2290 | 3 | ChEMBL | 957 | 15 | 12 | 13 | -1.5 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476337 | 173693 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 1584 | 2 | ChEMBL | 1034 | 16 | 11 | 13 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CSCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4533159 | 173693 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 1584 | 2 | ChEMBL | 1034 | 16 | 11 | 13 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CSCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476357 | 175694 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 2630 | 2 | ChEMBL | 1032 | 16 | 12 | 13 | -1.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4579754 | 175694 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 2630 | 2 | ChEMBL | 1032 | 16 | 12 | 13 | -1.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476361 | 173839 | None | 0 | Human | Functional | pEC50 | = | 10.0 | 10.0 | 363 | 2 | ChEMBL | 1034 | 16 | 11 | 13 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CSCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4536454 | 173839 | None | 0 | Human | Functional | pEC50 | = | 10.0 | 10.0 | 363 | 2 | ChEMBL | 1034 | 16 | 11 | 13 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CSCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476343 | 174201 | None | 0 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 1174 | 2 | ChEMBL | 963 | 14 | 10 | 12 | -0.1 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4544907 | 174201 | None | 0 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 1174 | 2 | ChEMBL | 963 | 14 | 10 | 12 | -0.1 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476360 | 173666 | None | 0 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2691 | 2 | ChEMBL | 975 | 15 | 11 | 12 | -0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4532363 | 173666 | None | 0 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2691 | 2 | ChEMBL | 975 | 15 | 11 | 12 | -0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 155535667 | 172162 | None | 0 | Human | Functional | pEC50 | = | 9.8 | 9.8 | 562 | 2 | ChEMBL | 1116 | 18 | 11 | 14 | 0.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCCc2cccs2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4472007 | 172162 | None | 0 | Human | Functional | pEC50 | = | 9.8 | 9.8 | 562 | 2 | ChEMBL | 1116 | 18 | 11 | 14 | 0.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCCc2cccs2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476369 | 170294 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 3388 | 2 | ChEMBL | 885 | 13 | 9 | 12 | -0.4 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCN)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4444891 | 170294 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 3388 | 2 | ChEMBL | 885 | 13 | 9 | 12 | -0.4 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCN)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476336 | 171314 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 630 | 2 | ChEMBL | 1016 | 16 | 11 | 12 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4459424 | 171314 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 630 | 2 | ChEMBL | 1016 | 16 | 11 | 12 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476365 | 173954 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 794 | 2 | ChEMBL | 1078 | 17 | 11 | 12 | 0.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCc2ccccc2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4539100 | 173954 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 794 | 2 | ChEMBL | 1078 | 17 | 11 | 12 | 0.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCc2ccccc2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 2181 | 1331 | None | 29 | Human | Functional | pEC50 | = | 9.7 | 9.7 | -6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 2182 | 1331 | None | 29 | Human | Functional | pEC50 | = | 9.7 | 9.7 | -6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 27991 | 1331 | None | 29 | Human | Functional | pEC50 | = | 9.7 | 9.7 | -6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 27991.0 | 1331 | None | 29 | Human | Functional | pEC50 | = | 9.7 | 9.7 | -6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| CHEMBL1429 | 1331 | None | 29 | Human | Functional | pEC50 | = | 9.7 | 9.7 | -6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| CHEMBL264448 | 1331 | None | 29 | Human | Functional | pEC50 | = | 9.7 | 9.7 | -6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| DB00035 | 1331 | None | 29 | Human | Functional | pEC50 | = | 9.7 | 9.7 | -6 | 4 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b00132 | |||||
| 132095331 | 175328 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 645 | 2 | ChEMBL | 1060 | 17 | 12 | 13 | -0.8 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4571464 | 175328 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 645 | 2 | ChEMBL | 1060 | 17 | 12 | 13 | -0.8 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476362 | 171051 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 575 | 2 | ChEMBL | 1048 | 17 | 11 | 13 | -0.2 | CCCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CSCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4455496 | 171051 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 575 | 2 | ChEMBL | 1048 | 17 | 11 | 13 | -0.2 | CCCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CSCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476356 | 172312 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 1513 | 2 | ChEMBL | 1042 | 17 | 11 | 12 | -0.1 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC2CC2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4473843 | 172312 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 1513 | 2 | ChEMBL | 1042 | 17 | 11 | 12 | -0.1 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC2CC2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476335 | 170420 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | 1044 | 17 | 11 | 12 | 0.2 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4446853 | 170420 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | 1044 | 17 | 11 | 12 | 0.2 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476329 | 173269 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 954 | 2 | ChEMBL | 1044 | 17 | 11 | 12 | 0.2 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4521807 | 173269 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 954 | 2 | ChEMBL | 1044 | 17 | 11 | 12 | 0.2 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476347 | 175439 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 501 | 2 | ChEMBL | 975 | 14 | 10 | 11 | 0.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4574065 | 175439 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 501 | 2 | ChEMBL | 975 | 14 | 10 | 11 | 0.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476358 | 170771 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2089 | 2 | ChEMBL | 1028 | 16 | 11 | 12 | -0.3 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NC2CC2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4451555 | 170771 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2089 | 2 | ChEMBL | 1028 | 16 | 11 | 12 | -0.3 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NC2CC2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476331 | 173630 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2089 | 2 | ChEMBL | 1060 | 17 | 12 | 13 | -0.8 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4531173 | 173630 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2089 | 2 | ChEMBL | 1060 | 17 | 12 | 13 | -0.8 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476355 | 173968 | None | 3 | Human | Functional | pEC50 | = | 9.6 | 9.6 | -5 | 3 | ChEMBL | 1044 | 17 | 10 | 12 | 0.3 | CCN(CC)C(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4539370 | 173968 | None | 3 | Human | Functional | pEC50 | = | 9.6 | 9.6 | -5 | 3 | ChEMBL | 1044 | 17 | 10 | 12 | 0.3 | CCN(CC)C(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476366 | 174157 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 741 | 2 | ChEMBL | 1044 | 18 | 11 | 12 | 0.3 | CCCCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4543908 | 174157 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 741 | 2 | ChEMBL | 1044 | 18 | 11 | 12 | 0.3 | CCCCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476346 | 174619 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 588 | 2 | ChEMBL | 1060 | 17 | 12 | 13 | -0.2 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCc2ccccc2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4555263 | 174619 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 588 | 2 | ChEMBL | 1060 | 17 | 12 | 13 | -0.2 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCc2ccccc2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476341 | 170785 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 1288 | 2 | ChEMBL | 1002 | 15 | 11 | 12 | -0.8 | CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4451692 | 170785 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 1288 | 2 | ChEMBL | 1002 | 15 | 11 | 12 | -0.8 | CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476385 | 174715 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 169 | 2 | ChEMBL | 1038 | 17 | 11 | 11 | 0.1 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4557473 | 174715 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 169 | 2 | ChEMBL | 1038 | 17 | 11 | 11 | 0.1 | CC(C)CNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476359 | 171512 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 524 | 2 | ChEMBL | 1026 | 16 | 12 | 12 | -1.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4462616 | 171512 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 524 | 2 | ChEMBL | 1026 | 16 | 12 | 12 | -1.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 90468623 | 174266 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 588 | 2 | ChEMBL | 1016 | 16 | 11 | 12 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4546884 | 174266 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 588 | 2 | ChEMBL | 1016 | 16 | 11 | 12 | -0.5 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476342 | 174698 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 1044 | 17 | 11 | 12 | 0.2 | CC(C)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4557118 | 174698 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 1044 | 17 | 11 | 12 | 0.2 | CC(C)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 155513872 | 169901 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 331 | 2 | ChEMBL | 1128 | 18 | 11 | 13 | 0.8 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCCc2cccs2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4439313 | 169901 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 331 | 2 | ChEMBL | 1128 | 18 | 11 | 13 | 0.8 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCCc2cccs2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476383 | 169861 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 457 | 2 | ChEMBL | 957 | 14 | 10 | 10 | 0.1 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4438723 | 169861 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 457 | 2 | ChEMBL | 957 | 14 | 10 | 10 | 0.1 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476348 | 173626 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 457 | 3 | ChEMBL | 1096 | 17 | 11 | 13 | 0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCc2ccccc2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4531053 | 173626 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 457 | 3 | ChEMBL | 1096 | 17 | 11 | 13 | 0.6 | CC(C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CSC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCc2ccccc2)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 118476344 | 173482 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 1034 | 16 | 11 | 13 | -0.2 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4527761 | 173482 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 1034 | 16 | 11 | 13 | -0.2 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476367 | 170304 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 758 | 2 | ChEMBL | 1030 | 17 | 11 | 12 | -0.1 | CCCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4445168 | 170304 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 758 | 2 | ChEMBL | 1030 | 17 | 11 | 12 | -0.1 | CCCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476332 | 169645 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 630 | 2 | ChEMBL | 987 | 15 | 11 | 11 | -0.5 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4435502 | 169645 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 630 | 2 | ChEMBL | 987 | 15 | 11 | 11 | -0.5 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/acs.jmedchem.9b00132 | |||
| 155542670 | 173263 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 969 | 16 | 11 | 12 | -0.7 | CCc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3cccs3)NC2=O)cc1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4521602 | 173263 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 969 | 16 | 11 | 12 | -0.7 | CCc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3cccs3)NC2=O)cc1 | 10.1021/acs.jmedchem.9b00132 | |||
| 118476339 | 172900 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | - | 1 | ChEMBL | 1028 | 16 | 11 | 12 | -0.3 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4513567 | 172900 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | - | 1 | ChEMBL | 1028 | 16 | 11 | 12 | -0.3 | CCNC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| 90469676 | 174509 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2089 | 2 | ChEMBL | 955 | 15 | 11 | 12 | -0.9 | Cc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3cccs3)NC2=O)cc1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4552500 | 174509 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2089 | 2 | ChEMBL | 955 | 15 | 11 | 12 | -0.9 | Cc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CO)CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3cccs3)NC2=O)cc1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL1819440 | 211472 | None | 20 | Human | Functional | pEC50 | = | 9.4 | 9.4 | -1 | 5 | ChEMBL | None | None | None | NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| 118476333 | 169714 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 1288 | 2 | ChEMBL | 1030 | 16 | 11 | 12 | -0.1 | CC(C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL4436571 | 169714 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 1288 | 2 | ChEMBL | 1030 | 16 | 11 | 12 | -0.1 | CC(C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](Cc2cccs2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/acs.jmedchem.9b00132 | |||
| CHEMBL1819440 | 211472 | None | 20 | Human | Functional | pEC50 | = | 9.4 | 9.4 | -1 | 5 | ChEMBL | None | None | None | NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| 3537 | 4004 | None | 22 | Human | Functional | pEC50 | = | 9.2 | 9.2 | 3 | 4 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1021/acs.jmedchem.8b00697 | |||
| 5311500 | 4004 | None | 22 | Human | Functional | pEC50 | = | 9.2 | 9.2 | 3 | 4 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL363910 | 4004 | None | 22 | Human | Functional | pEC50 | = | 9.2 | 9.2 | 3 | 4 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1021/acs.jmedchem.8b00697 | |||
| 3537 | 4004 | None | 22 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2005.10.107 | |||
| 5311500 | 4004 | None | 22 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL363910 | 4004 | None | 22 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2005.10.107 | |||
| 44520851 | 202255 | None | 0 | Human | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL594026 | 202255 | None | 0 | Human | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 44520849 | 204170 | None | 0 | Human | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL606464 | 204170 | None | 0 | Human | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 44520852 | 202164 | None | 0 | Human | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL593325 | 202164 | None | 0 | Human | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 44520850 | 202320 | None | 0 | Human | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL594488 | 202320 | None | 0 | Human | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 44520880 | 12581 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.0 | CC1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186825 | 12581 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.0 | CC1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL479918 | 12581 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.0 | CC1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1819441 | 211473 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | -18 | 4 | ChEMBL | None | None | None | N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| CHEMBL1819441 | 211473 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | -18 | 4 | ChEMBL | None | None | None | N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| 9824954 | 73886 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 43 | 3 | ChEMBL | 449 | 2 | 1 | 5 | 5.5 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL201889 | 73886 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 43 | 3 | ChEMBL | 449 | 2 | 1 | 5 | 5.5 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| 9959174 | 194595 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 547 | 5 | 1 | 5 | 5.6 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL487164 | 194595 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 547 | 5 | 1 | 5 | 5.6 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL528996 | 194595 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 547 | 5 | 1 | 5 | 5.6 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 9959174 | 194595 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 547 | 5 | 1 | 5 | 5.6 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL487164 | 194595 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 547 | 5 | 1 | 5 | 5.6 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL528996 | 194595 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 547 | 5 | 1 | 5 | 5.6 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2008.09.039 | |||
| 10281429 | 188460 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 568 | 7 | 1 | 4 | 4.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](OCc2ccccc2)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL501078 | 188460 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 568 | 7 | 1 | 4 | 4.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](OCc2ccccc2)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 25181105 | 189026 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 463 | 5 | 2 | 2 | 5.8 | CCc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL507816 | 189026 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 463 | 5 | 2 | 2 | 5.8 | CCc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| 25178785 | 176848 | None | 0 | Human | Functional | pEC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 449 | 4 | 1 | 4 | 3.8 | COC(=O)[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| CHEMBL460303 | 176848 | None | 0 | Human | Functional | pEC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 449 | 4 | 1 | 4 | 3.8 | COC(=O)[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| 18759824 | 189952 | None | 0 | Human | Functional | pEC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 448 | 5 | 2 | 3 | 3.4 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N1CCCC1 | 10.1021/jm8008162 | |||
| CHEMBL516629 | 189952 | None | 0 | Human | Functional | pEC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 448 | 5 | 2 | 3 | 3.4 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N1CCCC1 | 10.1021/jm8008162 | |||
| 25180885 | 180446 | None | 0 | Human | Functional | pEC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 464 | 4 | 1 | 4 | 3.2 | Cc1cc(C(=O)N2CCCOc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL475129 | 180446 | None | 0 | Human | Functional | pEC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 464 | 4 | 1 | 4 | 3.2 | Cc1cc(C(=O)N2CCCOc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 44520882 | 12585 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186831 | 12585 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL480104 | 12585 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 145963213 | 161575 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -309 | 4 | ChEMBL | 1095 | 17 | 11 | 14 | -0.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2ccccc2CSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| CHEMBL4127791 | 161575 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -309 | 4 | ChEMBL | 1095 | 17 | 11 | 14 | -0.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2ccccc2CSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| 25178587 | 174694 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 465 | 5 | 2 | 3 | 5.3 | COc1cc(CNC(=O)Nc2c(F)cccc2F)ccc1C(=O)N1CCCCc2ccccc21 | 10.1021/jm8008162 | |||
| CHEMBL455696 | 174694 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 465 | 5 | 2 | 3 | 5.3 | COc1cc(CNC(=O)Nc2c(F)cccc2F)ccc1C(=O)N1CCCCc2ccccc21 | 10.1021/jm8008162 | |||
| 11169 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 131676677 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 165708555 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 165708555.0 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 16681432 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 16681432.0 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 495 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| CHEMBL3301668 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| DB01282 | 797 | None | 33 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 44520881 | 12582 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | CC1CCCN1c1ccc(C(=O)N2CCC(F)(F)/C(=C\C(=O)NCc3ccccn3)c3ccccc32)c(Cl)c1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186826 | 12582 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | CC1CCCN1c1ccc(C(=O)N2CCC(F)(F)/C(=C\C(=O)NCc3ccccn3)c3ccccc32)c(Cl)c1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL479919 | 12582 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | CC1CCCN1c1ccc(C(=O)N2CCC(F)(F)/C(=C\C(=O)NCc3ccccn3)c3ccccc32)c(Cl)c1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1817671 | 211441 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -61 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817671 | 211441 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -61 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819548 | 211482 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -218 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819554 | 211487 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -1513 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2CCCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 25178963 | 180617 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 499 | 4 | 1 | 4 | 3.8 | Cc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL475333 | 180617 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 499 | 4 | 1 | 4 | 3.8 | Cc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 18759822 | 190894 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 451 | 5 | 2 | 4 | 4.1 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)OC(C)(C)C | 10.1021/jm8008162 | |||
| CHEMBL518349 | 190894 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 451 | 5 | 2 | 4 | 4.1 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)OC(C)(C)C | 10.1021/jm8008162 | |||
| CHEMBL1819548 | 211482 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -218 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 53362156 | 64641 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -17 | 3 | ChEMBL | 1035 | 19 | 11 | 16 | -4.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N(C)OC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817690 | 64641 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -17 | 3 | ChEMBL | 1035 | 19 | 11 | 16 | -4.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N(C)OC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819553 | 211486 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -93 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819554 | 211487 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -1513 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2CCCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 53362156 | 64641 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -17 | 3 | ChEMBL | 1035 | 19 | 11 | 16 | -4.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N(C)OC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817690 | 64641 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -17 | 3 | ChEMBL | 1035 | 19 | 11 | 16 | -4.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N(C)OC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819553 | 211486 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -93 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 10456892 | 66086 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -74 | 2 | ChEMBL | 458 | 3 | 0 | 7 | 3.0 | CS(=O)(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1837041 | 66086 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -74 | 2 | ChEMBL | 458 | 3 | 0 | 7 | 3.0 | CS(=O)(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| 44563579 | 174695 | None | 0 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -6 | 2 | ChEMBL | 449 | 4 | 2 | 2 | 5.6 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL455699 | 174695 | None | 0 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -6 | 2 | ChEMBL | 449 | 4 | 2 | 2 | 5.6 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| 25178591 | 173519 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 413 | 4 | 2 | 2 | 5.3 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1ccccc1 | 10.1021/jm8008162 | |||
| CHEMBL452853 | 173519 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 413 | 4 | 2 | 2 | 5.3 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1ccccc1 | 10.1021/jm8008162 | |||
| CHEMBL1817705 | 211446 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -512 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817705 | 211446 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -512 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817706 | 211447 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1348 | 5 | ChEMBL | None | None | None | CCCNCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| 21083206 | 174348 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 430 | 4 | 3 | 3 | 4.0 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1ccc[nH]c1=O | 10.1021/jm8008162 | |||
| CHEMBL454894 | 174348 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 430 | 4 | 3 | 3 | 4.0 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1ccc[nH]c1=O | 10.1021/jm8008162 | |||
| 15896091 | 176857 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 423 | 6 | 2 | 4 | 3.3 | CCOC(=O)CNC(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| CHEMBL460319 | 176857 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 423 | 6 | 2 | 4 | 3.3 | CCOC(=O)CNC(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| 18759812 | 176858 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 437 | 6 | 2 | 4 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)OC(C)C | 10.1021/jm8008162 | |||
| CHEMBL460320 | 176858 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 437 | 6 | 2 | 4 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)OC(C)C | 10.1021/jm8008162 | |||
| 25180887 | 193333 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 499 | 4 | 1 | 4 | 3.8 | Cc1cc(C(=O)N2CCc3cccn3-c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL523596 | 193333 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 499 | 4 | 1 | 4 | 3.8 | Cc1cc(C(=O)N2CCc3cccn3-c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL1817706 | 211447 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1348 | 5 | ChEMBL | None | None | None | CCCNCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| 25180697 | 179336 | None | 0 | Rat | Functional | pEC50 | = | 7.8 | 7.8 | -3 | 2 | ChEMBL | 506 | 6 | 1 | 4 | 3.8 | CCO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| CHEMBL472697 | 179336 | None | 0 | Rat | Functional | pEC50 | = | 7.8 | 7.8 | -3 | 2 | ChEMBL | 506 | 6 | 1 | 4 | 3.8 | CCO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| 18759808 | 177007 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 462 | 5 | 2 | 3 | 3.8 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N1CCCCC1 | 10.1021/jm8008162 | |||
| CHEMBL461725 | 177007 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 462 | 5 | 2 | 3 | 3.8 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N1CCCCC1 | 10.1021/jm8008162 | |||
| 10298385 | 190697 | None | 33 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -6 | 2 | ChEMBL | 462 | 4 | 1 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL518043 | 190697 | None | 33 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -6 | 2 | ChEMBL | 462 | 4 | 1 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL1819542 | 211476 | None | 6 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -1258 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819542 | 211476 | None | 6 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -1258 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 44520861 | 180925 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 548 | 5 | 1 | 6 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cccnn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL475684 | 180925 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 548 | 5 | 1 | 6 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cccnn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 53362548 | 64654 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -602 | 4 | ChEMBL | 991 | 17 | 12 | 15 | -4.8 | CCNC(=O)C[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817751 | 64654 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -602 | 4 | ChEMBL | 991 | 17 | 12 | 15 | -4.8 | CCNC(=O)C[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817702 | 211443 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -4786 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 53362548 | 64654 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -602 | 4 | ChEMBL | 991 | 17 | 12 | 15 | -4.8 | CCNC(=O)C[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817751 | 64654 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -602 | 4 | ChEMBL | 991 | 17 | 12 | 15 | -4.8 | CCNC(=O)C[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| 53362202 | 64642 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -13 | 3 | ChEMBL | 1007 | 18 | 13 | 16 | -4.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817691 | 64642 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -13 | 3 | ChEMBL | 1007 | 18 | 13 | 16 | -4.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817702 | 211443 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -4786 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 53362155 | 64824 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -1513 | 3 | ChEMBL | 1021 | 19 | 12 | 16 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NOC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819560 | 64824 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -1513 | 3 | ChEMBL | 1021 | 19 | 12 | 16 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NOC)NC1=O | 10.1021/jm200278m | |||
| 53362202 | 64642 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -13 | 3 | ChEMBL | 1007 | 18 | 13 | 16 | -4.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817691 | 64642 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -13 | 3 | ChEMBL | 1007 | 18 | 13 | 16 | -4.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| 25178962 | 180445 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 498 | 4 | 1 | 3 | 4.3 | Cc1cc(C(=O)N2CCCC(F)(F)c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL475128 | 180445 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 498 | 4 | 1 | 3 | 4.3 | Cc1cc(C(=O)N2CCCC(F)(F)c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 53362155 | 64824 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -1513 | 3 | ChEMBL | 1021 | 19 | 12 | 16 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NOC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819560 | 64824 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -1513 | 3 | ChEMBL | 1021 | 19 | 12 | 16 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NOC)NC1=O | 10.1021/jm200278m | |||
| 21083210 | 174693 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 453 | 4 | 2 | 2 | 5.4 | O=C(NCc1ccc(C(=O)N2CCCCc3ccccc32)c(F)c1)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL455695 | 174693 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 453 | 4 | 2 | 2 | 5.4 | O=C(NCc1ccc(C(=O)N2CCCCc3ccccc32)c(F)c1)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| 15896092 | 176856 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 395 | 5 | 3 | 3 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)O | 10.1021/jm8008162 | |||
| CHEMBL460318 | 176856 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 395 | 5 | 3 | 3 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)O | 10.1021/jm8008162 | |||
| CHEMBL1817708 | 211449 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -234 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNCCC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 2173 | 2956 | None | 18 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/acs.jmedchem.8b00697 | |||
| 3038506 | 2956 | None | 18 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL332447 | 2956 | None | 18 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/acs.jmedchem.8b00697 | |||
| DB05838 | 2956 | None | 18 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/acs.jmedchem.8b00697 | |||
| 145961670 | 161458 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | -1348 | 4 | ChEMBL | 1139 | 19 | 14 | 15 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2ccccc2CSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| CHEMBL4126100 | 161458 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | -1348 | 4 | ChEMBL | 1139 | 19 | 14 | 15 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2ccccc2CSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| CHEMBL1817708 | 211449 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -234 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNCCC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 44563579 | 174695 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | 6 | 2 | ChEMBL | 449 | 4 | 2 | 2 | 5.6 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL455699 | 174695 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | 6 | 2 | ChEMBL | 449 | 4 | 2 | 2 | 5.6 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| 10162731 | 177095 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | 17 | 2 | ChEMBL | 478 | 4 | 2 | 4 | 2.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](O)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL462574 | 177095 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | 17 | 2 | ChEMBL | 478 | 4 | 2 | 4 | 2.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](O)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 44520848 | 202400 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 534 | 5 | 2 | 5 | 4.4 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)n1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL594953 | 202400 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 534 | 5 | 2 | 5 | 4.4 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)n1 | 10.1016/j.bmc.2009.10.038 | |||
| 44563371 | 179043 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 536 | 7 | 1 | 5 | 3.6 | COC(OC)C1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| CHEMBL470326 | 179043 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 536 | 7 | 1 | 5 | 3.6 | COC(OC)C1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| CHEMBL1819549 | 211483 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -323 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccsc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819549 | 211483 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -323 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccsc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 53363016 | 64821 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -34 | 4 | ChEMBL | 1005 | 18 | 12 | 15 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819557 | 64821 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -34 | 4 | ChEMBL | 1005 | 18 | 12 | 15 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| 2042 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 2174 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 2176 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 439302 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 439302.0 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| CHEMBL395429 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| DB00107 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 18759802 | 177080 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 394 | 5 | 3 | 3 | 2.3 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(N)=O | 10.1021/jm8008162 | |||
| CHEMBL462409 | 177080 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 394 | 5 | 3 | 3 | 2.3 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(N)=O | 10.1021/jm8008162 | |||
| 53363016 | 64821 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -34 | 4 | ChEMBL | 1005 | 18 | 12 | 15 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819557 | 64821 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -34 | 4 | ChEMBL | 1005 | 18 | 12 | 15 | -4.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| 10345610 | 66085 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -204 | 2 | ChEMBL | 422 | 2 | 0 | 6 | 3.6 | CC(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1837040 | 66085 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -204 | 2 | ChEMBL | 422 | 2 | 0 | 6 | 3.6 | CC(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| 25180884 | 179615 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 476 | 4 | 1 | 3 | 4.3 | Cc1cc(C(=O)N2CCCC(C)c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL474120 | 179615 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 476 | 4 | 1 | 3 | 4.3 | Cc1cc(C(=O)N2CCCC(C)c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 25178961 | 179613 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 478 | 4 | 2 | 4 | 3.2 | Cc1cc(C(=O)N2CCCC(O)c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL474119 | 179613 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 478 | 4 | 2 | 4 | 3.2 | Cc1cc(C(=O)N2CCCC(O)c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 135506374 | 137987 | None | 19 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 4 | ChEMBL | 581 | 5 | 4 | 8 | 4.1 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCN(Cc2cc(O)cc(O)c2)CC1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL3763342 | 137987 | None | 19 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 4 | ChEMBL | 581 | 5 | 4 | 8 | 4.1 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCN(Cc2cc(O)cc(O)c2)CC1 | 10.1021/acs.jmedchem.8b00697 | |||
| 10298385 | 190697 | None | 33 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 6 | 2 | ChEMBL | 462 | 4 | 1 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL518043 | 190697 | None | 33 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 6 | 2 | ChEMBL | 462 | 4 | 1 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL1819547 | 211481 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -131 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cscn2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819547 | 211481 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -131 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cscn2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817707 | 211448 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -1621 | 5 | ChEMBL | None | None | None | CCNCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| CHEMBL1817707 | 211448 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -1621 | 5 | ChEMBL | None | None | None | CCNCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| 53362259 | 64646 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -645 | 3 | ChEMBL | 993 | 17 | 13 | 16 | -5.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817696 | 64646 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -645 | 3 | ChEMBL | 993 | 17 | 13 | 16 | -5.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| 53363017 | 64822 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -67 | 3 | ChEMBL | 1019 | 19 | 12 | 15 | -4.0 | CCNC(=O)CC[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819558 | 64822 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -67 | 3 | ChEMBL | 1019 | 19 | 12 | 15 | -4.0 | CCNC(=O)CC[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| 11454 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 53330936 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| CHEMBL1817709 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| DB12495 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 53362259 | 64646 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -645 | 3 | ChEMBL | 993 | 17 | 13 | 16 | -5.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817696 | 64646 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -645 | 3 | ChEMBL | 993 | 17 | 13 | 16 | -5.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NO)NC1=O | 10.1021/jm200278m | |||
| 53363017 | 64822 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -67 | 3 | ChEMBL | 1019 | 19 | 12 | 15 | -4.0 | CCNC(=O)CC[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819558 | 64822 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -67 | 3 | ChEMBL | 1019 | 19 | 12 | 15 | -4.0 | CCNC(=O)CC[C@@H]1NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||
| 11237434 | 66081 | None | 13 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -102 | 2 | ChEMBL | 394 | 2 | 0 | 6 | 3.6 | CN1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1837037 | 66081 | None | 13 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -102 | 2 | ChEMBL | 394 | 2 | 0 | 6 | 3.6 | CN1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| 25178960 | 179363 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 476 | 4 | 1 | 4 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CC(=O)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL472900 | 179363 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 476 | 4 | 1 | 4 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CC(=O)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 25178784 | 176851 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 484 | 7 | 3 | 3 | 4.1 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)NCc1ccccc1 | 10.1021/jm8008162 | |||
| CHEMBL460308 | 176851 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 484 | 7 | 3 | 3 | 4.1 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)NCc1ccccc1 | 10.1021/jm8008162 | |||
| 11454 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| 53330936 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| CHEMBL1817709 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| DB12495 | 3577 | None | 12 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -4786 | 5 | ChEMBL | None | None | None | None | 10.1021/jm200278m | |||||
| CHEMBL1817704 | 211445 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -2238 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 2042 | 2983 | None | 40 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -25 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2018.03.019 | |||||
| 2174 | 2983 | None | 40 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -25 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2018.03.019 | |||||
| 2176 | 2983 | None | 40 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -25 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2018.03.019 | |||||
| 439302 | 2983 | None | 40 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -25 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2018.03.019 | |||||
| 439302.0 | 2983 | None | 40 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -25 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2018.03.019 | |||||
| CHEMBL395429 | 2983 | None | 40 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -25 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2018.03.019 | |||||
| DB00107 | 2983 | None | 40 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -25 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2018.03.019 | |||||
| CHEMBL1817704 | 211445 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -2238 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 44520879 | 12738 | None | 0 | Human | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 536 | 5 | 1 | 4 | 5.7 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1187728 | 12738 | None | 0 | Human | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 536 | 5 | 1 | 4 | 5.7 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL516757 | 12738 | None | 0 | Human | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 536 | 5 | 1 | 4 | 5.7 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 25180696 | 177053 | None | 0 | Human | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 478 | 4 | 1 | 3 | 4.5 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL462212 | 177053 | None | 0 | Human | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 478 | 4 | 1 | 3 | 4.5 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/jm8008162 | |||
| 25180311 | 174699 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 431 | 4 | 2 | 2 | 5.4 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1ccccc1F | 10.1021/jm8008162 | |||
| CHEMBL455717 | 174699 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 431 | 4 | 2 | 2 | 5.4 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)Nc1ccccc1F | 10.1021/jm8008162 | |||
| 53362154 | 64823 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -144 | 3 | ChEMBL | 1047 | 20 | 12 | 15 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NCC(C)C)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819559 | 64823 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -144 | 3 | ChEMBL | 1047 | 20 | 12 | 15 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NCC(C)C)NC1=O | 10.1021/jm200278m | |||
| 53362154 | 64823 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -144 | 3 | ChEMBL | 1047 | 20 | 12 | 15 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NCC(C)C)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1819559 | 64823 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -144 | 3 | ChEMBL | 1047 | 20 | 12 | 15 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)NCC(C)C)NC1=O | 10.1021/jm200278m | |||
| 56672570 | 66082 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -9 | 2 | ChEMBL | 438 | 2 | 0 | 7 | 3.8 | COC(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1837038 | 66082 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -9 | 2 | ChEMBL | 438 | 2 | 0 | 7 | 3.8 | COC(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1819550 | 211484 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -151 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccco2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819550 | 211484 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -151 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccco2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 25180695 | 176976 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 490 | 6 | 1 | 3 | 4.5 | CCN(CC)C(=O)[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| CHEMBL461519 | 176976 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 490 | 6 | 1 | 3 | 4.5 | CCN(CC)C(=O)[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| 145960494 | 161655 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -33 | 4 | ChEMBL | 1081 | 17 | 11 | 14 | -0.9 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2ccc(cc2)SC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| CHEMBL4128839 | 161655 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -33 | 4 | ChEMBL | 1081 | 17 | 11 | 14 | -0.9 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2ccc(cc2)SC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| 15896094 | 189970 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 409 | 5 | 2 | 4 | 3.0 | COC(=O)CNC(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| CHEMBL516788 | 189970 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 409 | 5 | 2 | 4 | 3.0 | COC(=O)CNC(=O)NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1C | 10.1021/jm8008162 | |||
| CHEMBL1817752 | 211451 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -2691 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817752 | 211451 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -2691 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 25178787 | 176977 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 462 | 4 | 1 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL461520 | 176977 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 462 | 4 | 1 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL1819556 | 211489 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -407 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)C2(CCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819556 | 211489 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -407 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)C2(CCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817761 | 211460 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -1202 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 25178786 | 177101 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 491 | 4 | 1 | 4 | 5.0 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)OC(C)(C)C | 10.1021/jm8008162 | |||
| CHEMBL462595 | 177101 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 491 | 4 | 1 | 4 | 5.0 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)OC(C)(C)C | 10.1021/jm8008162 | |||
| CHEMBL1817761 | 211460 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -1202 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cccs2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 145962220 | 161671 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -114 | 4 | ChEMBL | 1095 | 17 | 11 | 14 | -0.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2cccc(c2)CSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| CHEMBL4129142 | 161671 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -114 | 4 | ChEMBL | 1095 | 17 | 11 | 14 | -0.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCc2cccc(c2)CSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/j.bmc.2018.03.019 | |||
| 145976595 | 163810 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 3 | ChEMBL | 408 | 2 | 1 | 4 | 4.9 | Cc1ccn(C(=O)Nc2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4205046 | 163810 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 3 | ChEMBL | 408 | 2 | 1 | 4 | 4.9 | Cc1ccn(C(=O)Nc2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL1819541 | 211475 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -17 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819541 | 211475 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -17 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 42629368 | 182771 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 457 | 3 | 1 | 4 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)O)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL478902 | 182771 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 457 | 3 | 1 | 4 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)O)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 25180697 | 179336 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 3 | 2 | ChEMBL | 506 | 6 | 1 | 4 | 3.8 | CCO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| CHEMBL472697 | 179336 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 3 | 2 | ChEMBL | 506 | 6 | 1 | 4 | 3.8 | CCO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| 10206789 | 189826 | None | 0 | Human | Functional | pEC50 | = | 8.3 | 8.3 | 13 | 2 | ChEMBL | 492 | 5 | 1 | 4 | 3.4 | CO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| CHEMBL515607 | 189826 | None | 0 | Human | Functional | pEC50 | = | 8.3 | 8.3 | 13 | 2 | ChEMBL | 492 | 5 | 1 | 4 | 3.4 | CO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| 25181104 | 189193 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 469 | 4 | 2 | 2 | 5.9 | O=C(NCc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL509960 | 189193 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 469 | 4 | 2 | 2 | 5.9 | O=C(NCc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| 10444 | 2326 | None | 17 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 139030525 | 2326 | None | 17 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 145711714 | 2326 | None | 17 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4204210 | 2326 | None | 17 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 10162731 | 177095 | None | 0 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | -17 | 2 | ChEMBL | 478 | 4 | 2 | 4 | 2.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](O)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL462574 | 177095 | None | 0 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | -17 | 2 | ChEMBL | 478 | 4 | 2 | 4 | 2.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](O)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 25178959 | 189427 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 534 | 5 | 1 | 4 | 4.5 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](OC(C)(C)C)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL512349 | 189427 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 534 | 5 | 1 | 4 | 4.5 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1C[C@H](OC(C)(C)C)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL1819552 | 211485 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -42 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)(C)C)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 9954641 | 174700 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 435 | 4 | 2 | 2 | 5.3 | O=C(NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL455718 | 174700 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 435 | 4 | 2 | 2 | 5.3 | O=C(NCc1ccc(C(=O)N2CCCCc3ccccc32)cc1)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL1819552 | 211485 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -42 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)(C)C)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 44563370 | 179489 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 512 | 5 | 1 | 3 | 4.2 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CC(C(F)F)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL473917 | 179489 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 512 | 5 | 1 | 3 | 4.2 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CC(C(F)F)C[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 6918573 | 65298 | None | 2 | Rat | Functional | pEC50 | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 422 | 5 | 2 | 3 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL182852 | 65298 | None | 2 | Rat | Functional | pEC50 | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 422 | 5 | 2 | 3 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N(C)C | 10.1021/jm8008162 | |||
| 53362547 | 64653 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -1348 | 3 | ChEMBL | 977 | 16 | 12 | 15 | -5.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817750 | 64653 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -1348 | 3 | ChEMBL | 977 | 16 | 12 | 15 | -5.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| 53362547 | 64653 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -1348 | 3 | ChEMBL | 977 | 16 | 12 | 15 | -5.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| CHEMBL1817750 | 64653 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -1348 | 3 | ChEMBL | 977 | 16 | 12 | 15 | -5.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)NC)NC1=O | 10.1021/jm200278m | |||
| 6918573 | 65298 | None | 2 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -1 | 2 | ChEMBL | 422 | 5 | 2 | 3 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL182852 | 65298 | None | 2 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -1 | 2 | ChEMBL | 422 | 5 | 2 | 3 | 2.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)N(C)C | 10.1021/jm8008162 | |||
| 42629369 | 182300 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 500 | 5 | 2 | 5 | 4.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL478283 | 182300 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 500 | 5 | 2 | 5 | 4.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 42629369 | 182300 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 500 | 5 | 2 | 5 | 4.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL478283 | 182300 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 500 | 5 | 2 | 5 | 4.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.10.038 | |||
| 44520872 | 12614 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 533 | 5 | 1 | 5 | 5.3 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(-n3cccn3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186989 | 12614 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 533 | 5 | 1 | 5 | 5.3 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(-n3cccn3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL485760 | 12614 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 533 | 5 | 1 | 5 | 5.3 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(-n3cccn3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 44520883 | 12699 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 564 | 5 | 1 | 4 | 6.5 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1187505 | 12699 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 564 | 5 | 1 | 4 | 6.5 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL505517 | 12699 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 564 | 5 | 1 | 4 | 6.5 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 10206789 | 189826 | None | 0 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -13 | 2 | ChEMBL | 492 | 5 | 1 | 4 | 3.4 | CO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| CHEMBL515607 | 189826 | None | 0 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -13 | 2 | ChEMBL | 492 | 5 | 1 | 4 | 3.4 | CO[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4ccccc43)cc2C)C1 | 10.1021/jm8008162 | |||
| 10444 | 2326 | None | 17 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 139030525 | 2326 | None | 17 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 145711714 | 2326 | None | 17 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4204210 | 2326 | None | 17 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -9 | 4 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 11169 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 131676677 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 165708555 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 165708555.0 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 16681432 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 16681432.0 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 495 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| CHEMBL3301668 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| DB01282 | 797 | None | 33 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -173 | 5 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/acs.jmedchem.8b00697 | |||||
| 25180508 | 177099 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 435 | 4 | 2 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)O | 10.1021/jm8008162 | |||
| CHEMBL462590 | 177099 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 435 | 4 | 2 | 3 | 3.7 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)O | 10.1021/jm8008162 | |||
| CHEMBL1819543 | 211477 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -144 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817703 | 211444 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -24 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817703 | 211444 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -24 | 3 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819543 | 211477 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -144 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 25180507 | 190021 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 485 | 7 | 2 | 4 | 4.5 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)OCc1ccccc1 | 10.1021/jm8008162 | |||
| CHEMBL516985 | 190021 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 485 | 7 | 2 | 4 | 4.5 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)OCc1ccccc1 | 10.1021/jm8008162 | |||
| CHEMBL1819555 | 211488 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -3019 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1819555 | 211488 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -3019 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 2042 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 2174 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 2176 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 439302 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 439302.0 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| CHEMBL395429 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| DB00107 | 2983 | None | 40 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -25 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.8b00697 | |||||
| 21083212 | 174345 | None | 1 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 463 | 4 | 2 | 2 | 5.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)cc(C)c1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| CHEMBL454892 | 174345 | None | 1 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 463 | 4 | 2 | 2 | 5.9 | Cc1cc(C(=O)N2CCCCc3ccccc32)cc(C)c1CNC(=O)Nc1c(F)cccc1F | 10.1021/jm8008162 | |||
| 25178592 | 177079 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 471 | 6 | 2 | 4 | 4.4 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)Oc1ccccc1 | 10.1021/jm8008162 | |||
| CHEMBL462408 | 177079 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 471 | 6 | 2 | 4 | 4.4 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)NCC(=O)Oc1ccccc1 | 10.1021/jm8008162 | |||
| 25180886 | 180970 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 510 | 4 | 1 | 3 | 4.6 | Cc1cc(C(=O)N2CCc3ccccc3-c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| CHEMBL475733 | 180970 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 510 | 4 | 1 | 3 | 4.6 | Cc1cc(C(=O)N2CCc3ccccc3-c3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)N(C)C | 10.1021/jm8008162 | |||
| 135413563 | 122996 | None | 20 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -107 | 3 | ChEMBL | 600 | 4 | 2 | 7 | 4.3 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL360648 | 122996 | None | 20 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -107 | 3 | ChEMBL | 600 | 4 | 2 | 7 | 4.3 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL1819540 | 211474 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | -64 | 3 | ChEMBL | None | None | None | NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| CHEMBL1819540 | 211474 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | -64 | 3 | ChEMBL | None | None | None | NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm200278m | |||||
| 25180509 | 189950 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 477 | 5 | 1 | 4 | 4.6 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)OC(C)C | 10.1021/jm8008162 | |||
| CHEMBL516627 | 189950 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 477 | 5 | 1 | 4 | 4.6 | Cc1cc(C(=O)N2CCCCc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=O)OC(C)C | 10.1021/jm8008162 | |||
| CHEMBL1817756 | 211455 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -1548 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccco2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817756 | 211455 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -1548 | 5 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccco2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817770 | 211469 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -691 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| CHEMBL1817770 | 211469 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -691 | 4 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm200278m | |||||
| 10411308 | 203691 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL603708 | 203691 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.8b00697 | |||
| 44357890 | 168496 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | 39 | 3 | ChEMBL | 462 | 5 | 1 | 3 | 6.0 | Cc1ccccc1OCC(=O)Nc1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(C)c1 | 10.1021/jm000108p | |||
| CHEMBL434654 | 168496 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | 39 | 3 | ChEMBL | 462 | 5 | 1 | 3 | 6.0 | Cc1ccccc1OCC(=O)Nc1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(C)c1 | 10.1021/jm000108p | |||
| 121301508 | 176323 | None | 5 | Human | Functional | pIC50 | = | 8.8 | 8.8 | 2 | 4 | ChEMBL | 542 | 7 | 2 | 9 | 3.6 | C[C@H](O)c1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nn1-c1cccc(Cl)c1 | 10.6019/CHEMBL5463729 | |||
| CHEMBL4594444 | 176323 | None | 5 | Human | Functional | pIC50 | = | 8.8 | 8.8 | 2 | 4 | ChEMBL | 542 | 7 | 2 | 9 | 3.6 | C[C@H](O)c1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nn1-c1cccc(Cl)c1 | 10.6019/CHEMBL5463729 | |||
| 11432362 | 94190 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | -1 | 2 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249340 | 94190 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | -1 | 2 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 10461417 | 107357 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | -7 | 2 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL317243 | 107357 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | -7 | 2 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 44352783 | 116845 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | 4 | 2 | ChEMBL | 508 | 6 | 2 | 4 | 6.5 | O=C(Nc1ccc(C(=O)N2CCC(CCO)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL337725 | 116845 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | 4 | 2 | ChEMBL | 508 | 6 | 2 | 4 | 6.5 | O=C(Nc1ccc(C(=O)N2CCC(CCO)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44336404 | 111022 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -2 | 2 | ChEMBL | 568 | 7 | 2 | 4 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL326225 | 111022 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -2 | 2 | ChEMBL | 568 | 7 | 2 | 4 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 25132999 | 154993 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -3 | 2 | ChEMBL | 572 | 5 | 2 | 5 | 6.0 | COc1cc(C(=O)N2CC[C@]3(C=C(C4=NCCN4)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL400860 | 154993 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -3 | 2 | ChEMBL | 572 | 5 | 2 | 5 | 6.0 | COc1cc(C(=O)N2CC[C@]3(C=C(C4=NCCN4)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 151171 | 1164 | None | 41 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -3 | 2 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 151171.0 | 1164 | None | 41 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -3 | 2 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 216322 | 1164 | None | 41 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -3 | 2 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 2203 | 1164 | None | 41 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -3 | 2 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 732 | 1164 | None | 41 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -3 | 2 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1755 | 1164 | None | 41 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -3 | 2 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| DB00872 | 1164 | None | 41 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -3 | 2 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 25133000 | 94247 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 2 | 2 | ChEMBL | 626 | 6 | 3 | 6 | 4.4 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)NS(N)(=O)=O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249740 | 94247 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 2 | 2 | ChEMBL | 626 | 6 | 3 | 6 | 4.4 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)NS(N)(=O)=O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 216237 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 216237.0 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 2226 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 4110 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 443894 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 443894.0 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL344159 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| DB06212 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.0 | 8.0 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 11261339 | 154710 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -2 | 2 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CCC3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL399289 | 154710 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -2 | 2 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CCC3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 145976595 | 163810 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 2 | 3 | ChEMBL | 408 | 2 | 1 | 4 | 4.9 | Cc1ccn(C(=O)Nc2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4205046 | 163810 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 2 | 3 | ChEMBL | 408 | 2 | 1 | 4 | 4.9 | Cc1ccn(C(=O)Nc2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| 23598597 | 94150 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 91 | 2 | ChEMBL | 528 | 5 | 2 | 4 | 5.8 | COc1cc(NC(=O)c2cc(F)ccc2C)ccc1C(=O)N1CCC2(C=C(C(=O)O)CC2)Cc2ccccc21 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249133 | 94150 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 91 | 2 | ChEMBL | 528 | 5 | 2 | 4 | 5.8 | COc1cc(NC(=O)c2cc(F)ccc2C)ccc1C(=O)N1CCC2(C=C(C(=O)O)CC2)Cc2ccccc21 | 10.1016/j.bmcl.2007.09.059 | |||
| 11238362 | 169011 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -5 | 2 | ChEMBL | 562 | 6 | 2 | 4 | 6.5 | CCOc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL438523 | 169011 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -5 | 2 | ChEMBL | 562 | 6 | 2 | 4 | 6.5 | CCOc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 11683187 | 202388 | None | 41 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -20 | 2 | ChEMBL | 419 | 7 | 0 | 8 | 2.9 | COCc1nnc(N2CC(Oc3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL594828 | 202388 | None | 41 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -20 | 2 | ChEMBL | 419 | 7 | 0 | 8 | 2.9 | COCc1nnc(N2CC(Oc3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acs.jmedchem.8b00697 | |||
| 168289573 | 191948 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 572 | 8 | 2 | 4 | 7.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCCCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL5198918 | 191948 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 572 | 8 | 2 | 4 | 7.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCCCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| 44336636 | 164260 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -7 | 2 | ChEMBL | 585 | 7 | 3 | 4 | 6.0 | O=C(NCCO)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL421039 | 164260 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -7 | 2 | ChEMBL | 585 | 7 | 3 | 4 | 6.0 | O=C(NCCO)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 23598642 | 154894 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -2 | 2 | ChEMBL | 541 | 6 | 2 | 3 | 7.1 | CNCC1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL400267 | 154894 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -2 | 2 | ChEMBL | 541 | 6 | 2 | 3 | 7.1 | CNCC1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 23598641 | 94330 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -6 | 2 | ChEMBL | 528 | 5 | 2 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=C(CO)CC3)Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL250346 | 94330 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -6 | 2 | ChEMBL | 528 | 5 | 2 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=C(CO)CC3)Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2007.09.059 | |||
| 44336784 | 109264 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -1 | 2 | ChEMBL | 626 | 9 | 2 | 4 | 7.0 | CN(C)CCCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL321656 | 109264 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | -1 | 2 | ChEMBL | 626 | 9 | 2 | 4 | 7.0 | CN(C)CCCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 135192997 | 173934 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | -489 | 4 | ChEMBL | 461 | 8 | 0 | 7 | 3.7 | COc1ccc(-n2c(COCCF)nnc2N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)cn1 | 10.1021/acsmedchemlett.9b00186 | |||
| CHEMBL4538696 | 173934 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | -489 | 4 | ChEMBL | 461 | 8 | 0 | 7 | 3.7 | COc1ccc(-n2c(COCCF)nnc2N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)cn1 | 10.1021/acsmedchemlett.9b00186 | |||
| 168294659 | 192510 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 574 | 8 | 1 | 5 | 6.2 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCOCC3)c3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5207885 | 192510 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 574 | 8 | 1 | 5 | 6.2 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCOCC3)c3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.2c00567 | |||
| 135192979 | 175942 | None | 0 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -125 | 4 | ChEMBL | 485 | 7 | 0 | 8 | 3.5 | COc1ccc(-n2c(CO[C@H]3CCOC3)nnc2N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)cn1 | 10.1021/acsmedchemlett.9b00186 | |||
| CHEMBL4585239 | 175942 | None | 0 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -125 | 4 | ChEMBL | 485 | 7 | 0 | 8 | 3.5 | COc1ccc(-n2c(CO[C@H]3CCOC3)nnc2N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)cn1 | 10.1021/acsmedchemlett.9b00186 | |||
| 135192928 | 175008 | None | 0 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -851 | 4 | ChEMBL | 429 | 6 | 0 | 7 | 3.4 | COCc1nnc(N2C[C@@H]3C[C@]3(c3cccc(F)c3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acsmedchemlett.9b00186 | |||
| CHEMBL4564411 | 175008 | None | 0 | Human | Functional | pIC50 | = | 4.6 | 4.6 | -851 | 4 | ChEMBL | 429 | 6 | 0 | 7 | 3.4 | COCc1nnc(N2C[C@@H]3C[C@]3(c3cccc(F)c3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acsmedchemlett.9b00186 | |||
| 11683187 | 202388 | None | 41 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -20 | 2 | ChEMBL | 419 | 7 | 0 | 8 | 2.9 | COCc1nnc(N2CC(Oc3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL594828 | 202388 | None | 41 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -20 | 2 | ChEMBL | 419 | 7 | 0 | 8 | 2.9 | COCc1nnc(N2CC(Oc3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acs.jmedchem.8b00697 | |||
| 11157078 | 94248 | None | 8 | Rat | Functional | pIC50 | = | 7.5 | 7.5 | -2 | 4 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249741 | 94248 | None | 8 | Rat | Functional | pIC50 | = | 7.5 | 7.5 | -2 | 4 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 44352804 | 18966 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 24 | 2 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL128688 | 18966 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 24 | 2 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 9828129 | 116685 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 91 | 2 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL336825 | 116685 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 91 | 2 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44336379 | 107473 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -6 | 2 | ChEMBL | 582 | 8 | 2 | 4 | 5.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL318083 | 107473 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -6 | 2 | ChEMBL | 582 | 8 | 2 | 4 | 5.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 135192983 | 176222 | None | 16 | Human | Functional | pIC50 | = | 4.5 | 4.5 | -2137 | 4 | ChEMBL | 429 | 6 | 0 | 7 | 3.4 | COCc1nnc(N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acsmedchemlett.9b00186 | |||
| CHEMBL4591825 | 176222 | None | 16 | Human | Functional | pIC50 | = | 4.5 | 4.5 | -2137 | 4 | ChEMBL | 429 | 6 | 0 | 7 | 3.4 | COCc1nnc(N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acsmedchemlett.9b00186 | |||
| 44377836 | 57550 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL166261 | 57550 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 44336768 | 163447 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 2 | ChEMBL | 599 | 7 | 3 | 4 | 6.1 | O=C(O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL419183 | 163447 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 2 | ChEMBL | 599 | 7 | 3 | 4 | 6.1 | O=C(O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 44444762 | 154819 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -1 | 2 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL399888 | 154819 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -1 | 2 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 54582950 | 63057 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -3 | 4 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL1788220 | 63057 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -3 | 4 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 44352757 | 118518 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 58 | 2 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL341173 | 118518 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 58 | 2 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 23598595 | 154893 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 542 | 5 | 2 | 3 | 7.0 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL400266 | 154893 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 542 | 5 | 2 | 3 | 7.0 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 216237 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| 216237.0 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| 2226 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| 4110 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| 443894 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| 443894.0 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| CHEMBL344159 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| DB06212 | 3843 | None | 51 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 66 | 11 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.6019/CHEMBL5442687 | |||
| 25132666 | 94582 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 572 | 5 | 2 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@]3(C=C(c4nnn[nH]4)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL251715 | 94582 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 572 | 5 | 2 | 6 | 5.7 | COc1cc(C(=O)N2CC[C@]3(C=C(c4nnn[nH]4)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 44352768 | 115320 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 47 | 2 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL334777 | 115320 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 47 | 2 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 9871426 | 117075 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 44 | 2 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)CC1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL338901 | 117075 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 44 | 2 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)CC1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44444760 | 154709 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -1 | 2 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL399288 | 154709 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -1 | 2 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 44336418 | 108243 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 569 | 6 | 2 | 5 | 5.0 | COC(=O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3C)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL319636 | 108243 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 569 | 6 | 2 | 5 | 5.0 | COC(=O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3C)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 10345610 | 66085 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -204 | 2 | ChEMBL | 422 | 2 | 0 | 6 | 3.6 | CC(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1837040 | 66085 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -204 | 2 | ChEMBL | 422 | 2 | 0 | 6 | 3.6 | CC(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| 23598598 | 4969 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL104839 | 4969 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 23598600 | 5369 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | 594 | 7 | 2 | 4 | 5.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL106938 | 5369 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | 594 | 7 | 2 | 4 | 5.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 172997 | 2332 | None | 49 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| 2238 | 2332 | None | 49 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| DB06666 | 2332 | None | 49 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| 11157078 | 94248 | None | 8 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249741 | 94248 | None | 8 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 9937535 | 63058 | None | 1 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -26 | 4 | ChEMBL | 554 | 7 | 2 | 4 | 5.1 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3F)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL1788221 | 63058 | None | 1 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -26 | 4 | ChEMBL | 554 | 7 | 2 | 4 | 5.1 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3F)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 9826033 | 57479 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | -37 | 3 | ChEMBL | 471 | 4 | 2 | 2 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL165670 | 57479 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | -37 | 3 | ChEMBL | 471 | 4 | 2 | 2 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 9869993 | 165647 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 485 | 4 | 2 | 2 | 7.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCc4c[nH]c5cccc3c45)cc2)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL424183 | 165647 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 485 | 4 | 2 | 2 | 7.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCc4c[nH]c5cccc3c45)cc2)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 10456892 | 66086 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -74 | 2 | ChEMBL | 458 | 3 | 0 | 7 | 3.0 | CS(=O)(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1837041 | 66086 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | -74 | 2 | ChEMBL | 458 | 3 | 0 | 7 | 3.0 | CS(=O)(=O)N1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| 25133001 | 94551 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -7 | 2 | ChEMBL | 570 | 5 | 2 | 4 | 6.9 | COc1cc(C(=O)N2CC[C@]3(C=C(c4ncc[nH]4)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL251561 | 94551 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -7 | 2 | ChEMBL | 570 | 5 | 2 | 4 | 6.9 | COc1cc(C(=O)N2CC[C@]3(C=C(c4ncc[nH]4)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 135192932 | 171631 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | -794 | 4 | ChEMBL | 443 | 7 | 0 | 7 | 3.8 | CCOCc1nnc(N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acsmedchemlett.9b00186 | |||
| CHEMBL4464246 | 171631 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | -794 | 4 | ChEMBL | 443 | 7 | 0 | 7 | 3.8 | CCOCc1nnc(N2C[C@@H]3C[C@]3(c3ccc(F)cc3Cl)C2)n1-c1ccc(OC)nc1 | 10.1021/acsmedchemlett.9b00186 | |||
| 46890707 | 6729 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -20 | 2 | ChEMBL | 419 | 3 | 0 | 3 | 6.6 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1csc2ccccc12 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1083703 | 6729 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -20 | 2 | ChEMBL | 419 | 3 | 0 | 3 | 6.6 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1csc2ccccc12 | 10.1016/j.bmcl.2010.04.068 | |||
| 11237434 | 66081 | None | 13 | Human | Functional | pIC50 | = | 5.1 | 5.1 | -102 | 2 | ChEMBL | 394 | 2 | 0 | 6 | 3.6 | CN1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| CHEMBL1837037 | 66081 | None | 13 | Human | Functional | pIC50 | = | 5.1 | 5.1 | -102 | 2 | ChEMBL | 394 | 2 | 0 | 6 | 3.6 | CN1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1 | 10.1016/j.bmcl.2011.08.038 | |||
| 23598598 | 4969 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 1 | 2 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL104839 | 4969 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 1 | 2 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 168294720 | 192578 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 601 | 9 | 1 | 5 | 6.5 | CCN1CCN(CCCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccccc32)CC1 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5208751 | 192578 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 601 | 9 | 1 | 5 | 6.5 | CCN1CCN(CCCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccccc32)CC1 | 10.1021/acs.jmedchem.2c00567 | |||
| 172997 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| 2238 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| DB06666 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| 172997 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| 2238 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| DB06666 | 2332 | None | 49 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)01059-4 | |||
| 164946750 | 190235 | None | 1 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 574 | 8 | 2 | 5 | 6.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCOCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL5173331 | 190235 | None | 1 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 574 | 8 | 2 | 5 | 6.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCOCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| 44335330 | 160159 | None | 0 | Rat | Functional | pKd | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1181 | 36 | 13 | 13 | -2.0 | CCOc1ccc(C[C@@H](NC(=O)Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL410838 | 160159 | None | 0 | Rat | Functional | pKd | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1181 | 36 | 13 | 13 | -2.0 | CCOc1ccc(C[C@@H](NC(=O)Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| 71458135 | 79720 | None | 0 | Pig | Functional | pKd | = | 7 | 7.0 | - | 0 | ChEMBL | 1171 | 20 | 11 | 15 | 1.3 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(N=[N+]=[N-])cc2)NC(=O)C(C)(C)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00079a020 | |||
| CHEMBL2115364 | 79720 | None | 0 | Pig | Functional | pKd | = | 7 | 7.0 | - | 0 | ChEMBL | 1171 | 20 | 11 | 15 | 1.3 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(N=[N+]=[N-])cc2)NC(=O)C(C)(C)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00079a020 | |||
| CHEMBL2373423 | 212836 | None | 0 | Rat | Functional | pKd | = | 7 | 7.0 | - | 0 | ChEMBL | None | None | None | COc1ccc(C[C@@H](NC(=O)Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||||
| 44335436 | 97112 | None | 0 | Rat | Functional | pKd | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1161 | 35 | 13 | 13 | -1.8 | CCOc1ccc(C[C@@H](NC(=O)CC(C)(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL267111 | 97112 | None | 0 | Rat | Functional | pKd | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1161 | 35 | 13 | 13 | -1.8 | CCOc1ccc(C[C@@H](NC(=O)CC(C)(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| 44335358 | 156088 | None | 0 | Rat | Functional | pKd | = | 7.8 | 7.8 | - | 0 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL406184 | 156088 | None | 0 | Rat | Functional | pKd | = | 7.8 | 7.8 | - | 0 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL2370376 | 212299 | None | 0 | Rat | Functional | pKd | = | 7.8 | 7.8 | - | 0 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||||
| CHEMBL2370381 | 212301 | None | 0 | Rat | Functional | pKd | = | 7.7 | 7.7 | - | 0 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||||
| CHEMBL2370380 | 212300 | None | 0 | Rat | Functional | pKd | = | 7.7 | 7.7 | - | 0 | ChEMBL | None | None | None | CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)CC12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O | 10.1021/jm00173a027 | |||||
| 14730755 | 97378 | None | 0 | Rat | Functional | pKd | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1064 | 32 | 12 | 12 | -1.8 | CCOc1ccc(C[C@@H](NC(=O)CC(C)(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL269251 | 97378 | None | 0 | Rat | Functional | pKd | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1064 | 32 | 12 | 12 | -1.8 | CCOc1ccc(C[C@@H](NC(=O)CC(C)(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL2373516 | 212839 | None | 0 | Rat | Functional | pKd | = | 7.4 | 7.4 | - | 0 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H](NC(=O)Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||||
| 44335434 | 160735 | None | 0 | Rat | Functional | pKd | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1083 | 30 | 10 | 11 | 0.9 | CCOc1ccc(C[C@@H](NC(=O)CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL411320 | 160735 | None | 0 | Rat | Functional | pKd | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1083 | 30 | 10 | 11 | 0.9 | CCOc1ccc(C[C@@H](NC(=O)CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL2373374 | 212835 | None | 0 | Rat | Functional | pKd | = | 7.2 | 7.2 | - | 0 | ChEMBL | None | None | None | NCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)Cc1ccccc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCN=C(N)N)C(N)=O | 10.1021/jm00173a027 | |||||
| CHEMBL2373441 | 212837 | None | 0 | Rat | Functional | pKd | = | 5.2 | 5.2 | - | 0 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H](NC(=O)CC(C)(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)cc1 | 10.1021/jm00173a027 | |||||
| 44335231 | 157654 | None | 0 | Rat | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1239 | 36 | 13 | 13 | -0.6 | CCOc1ccc(C[C@@H](NC(=O)CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| CHEMBL408038 | 157654 | None | 0 | Rat | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1239 | 36 | 13 | 13 | -0.6 | CCOc1ccc(C[C@@H](NC(=O)CC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCCCC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)C(C)C)cc1 | 10.1021/jm00173a027 | |||
| 44385657 | 168330 | None | 0 | Pig | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 967 | 16 | 10 | 12 | 0.8 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL433614 | 168330 | None | 0 | Pig | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 967 | 16 | 10 | 12 | 0.8 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL2372280 | 212667 | None | 0 | Pig | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | None | None | None | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSCC(C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00403a001 | |||||
| 44579442 | 186934 | None | 0 | Human | Functional | pKi | = | 6 | 6.0 | - | 0 | ChEMBL | 391 | 7 | 0 | 9 | 2.7 | CCOc1ccc(-c2nnc(Cn3nccn3)n2-c2ccc(OC)nc2)cc1C | 10.1016/j.bmcl.2008.08.066 | |||
| CHEMBL489387 | 186934 | None | 0 | Human | Functional | pKi | = | 6 | 6.0 | - | 0 | ChEMBL | 391 | 7 | 0 | 9 | 2.7 | CCOc1ccc(-c2nnc(Cn3nccn3)n2-c2ccc(OC)nc2)cc1C | 10.1016/j.bmcl.2008.08.066 | |||
| 11384094 | 178688 | None | 0 | Human | Functional | pKi | = | 7.0 | 7.0 | - | 0 | ChEMBL | 402 | 6 | 0 | 8 | 3.6 | COCc1nnc(-c2cnc(-c3cccc(C)c3C)cn2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2008.06.098 | |||
| CHEMBL467186 | 178688 | None | 0 | Human | Functional | pKi | = | 7.0 | 7.0 | - | 0 | ChEMBL | 402 | 6 | 0 | 8 | 3.6 | COCc1nnc(-c2cnc(-c3cccc(C)c3C)cn2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2008.06.098 | |||
| 44325538 | 112624 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccc(O)cc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL330016 | 112624 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccc(O)cc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 46225153 | 201567 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 399 | 7 | 0 | 8 | 2.5 | COCc1nnc(N2CC(Oc3ccc(F)cc3C)C2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2009.11.097 | |||
| CHEMBL589128 | 201567 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 399 | 7 | 0 | 8 | 2.5 | COCc1nnc(N2CC(Oc3ccc(F)cc3C)C2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2009.11.097 | |||
| 44325345 | 111625 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 493 | 3 | 1 | 4 | 4.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL328079 | 111625 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 493 | 3 | 1 | 4 | 4.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325505 | 209902 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(F)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL94133 | 209902 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(F)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44581241 | 175990 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 495 | 8 | 0 | 6 | 5.2 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3Cl)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| CHEMBL458634 | 175990 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 495 | 8 | 0 | 6 | 5.2 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3Cl)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| 44386688 | 132637 | None | 0 | Pig | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 981 | 17 | 10 | 12 | 1.2 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL369806 | 132637 | None | 0 | Pig | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 981 | 17 | 10 | 12 | 1.2 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 10414302 | 112583 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 519 | 4 | 1 | 4 | 6.2 | O=C(Nc1ccc(C(=O)N2C[C@H]3CSCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL329903 | 112583 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 519 | 4 | 1 | 4 | 6.2 | O=C(Nc1ccc(C(=O)N2C[C@H]3CSCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325332 | 209850 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 503 | 4 | 1 | 4 | 5.5 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL93861 | 209850 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 503 | 4 | 1 | 4 | 5.5 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44577937 | 178687 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 402 | 7 | 0 | 7 | 4.2 | COCc1nnc(-c2ccc(-c3ccccc3OC)cc2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2008.06.098 | |||
| CHEMBL467185 | 178687 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 402 | 7 | 0 | 7 | 4.2 | COCc1nnc(-c2ccc(-c3ccccc3OC)cc2)n1-c1ccc(OC)nc1 | 10.1016/j.bmcl.2008.06.098 | |||
| 44325691 | 13003 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 553 | 4 | 1 | 4 | 6.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3CSCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL1189693 | 13003 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 553 | 4 | 1 | 4 | 6.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3CSCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL539285 | 13003 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 553 | 4 | 1 | 4 | 6.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3CSCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 9807250 | 78378 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | O=C(Nc1ccc(C(=O)N2C[C@@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL2093899 | 78378 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | O=C(Nc1ccc(C(=O)N2C[C@@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL2110044 | 78378 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | O=C(Nc1ccc(C(=O)N2C[C@@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325695 | 168109 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1cccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL432043 | 168109 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1cccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325362 | 209803 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(F)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL93603 | 209803 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(F)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44386594 | 128268 | None | 0 | Pig | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 967 | 16 | 10 | 12 | 0.8 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL366552 | 128268 | None | 0 | Pig | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 967 | 16 | 10 | 12 | 0.8 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 44386593 | 158538 | None | 0 | Pig | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 1024 | 18 | 11 | 13 | -0.1 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL409054 | 158538 | None | 0 | Pig | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 1024 | 18 | 11 | 13 | -0.1 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 73354746 | 89513 | None | 0 | Pig | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 981 | 16 | 10 | 12 | 0.3 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSCC(C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00403a001 | |||
| CHEMBL2372281 | 89513 | None | 0 | Pig | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 981 | 16 | 10 | 12 | 0.3 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSCC(C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00403a001 | |||
| 9849525 | 111489 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 519 | 4 | 1 | 4 | 6.2 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL327365 | 111489 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 519 | 4 | 1 | 4 | 6.2 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325558 | 112632 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1cccc(O)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL330094 | 112632 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1cccc(O)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| 172997 | 2332 | None | 49 | Human | Functional | pKi | = | 7.6 | 7.6 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2004.03.083 | |||
| 2238 | 2332 | None | 49 | Human | Functional | pKi | = | 7.6 | 7.6 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Functional | pKi | = | 7.6 | 7.6 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2004.03.083 | |||
| DB06666 | 2332 | None | 49 | Human | Functional | pKi | = | 7.6 | 7.6 | -4 | 5 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2004.03.083 | |||
| 44325804 | 209769 | None | 0 | Human | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | 533 | 4 | 1 | 4 | 6.5 | Cc1ccc2c(c1)N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)CC1CSCCN1C2 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL93366 | 209769 | None | 0 | Human | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | 533 | 4 | 1 | 4 | 6.5 | Cc1ccc2c(c1)N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)CC1CSCCN1C2 | 10.1016/j.bmcl.2004.03.083 | |||
| 44386687 | 127972 | None | 0 | Pig | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | 968 | 16 | 10 | 12 | 1.4 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL366473 | 127972 | None | 0 | Pig | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | 968 | 16 | 10 | 12 | 1.4 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 46830095 | 8265 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 376 | 5 | 0 | 5 | 4.2 | COc1ccc(N(C(=O)c2cnc(-c3cccc(C)c3C)cn2)C(C)C)cn1 | 10.1016/j.bmcl.2010.02.018 | |||
| CHEMBL1092459 | 8265 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 376 | 5 | 0 | 5 | 4.2 | COc1ccc(N(C(=O)c2cnc(-c3cccc(C)c3C)cn2)C(C)C)cn1 | 10.1016/j.bmcl.2010.02.018 | |||
| 46830094 | 8436 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 392 | 7 | 0 | 6 | 3.5 | COCCN(C(=O)c1cnc(-c2cccc(C)c2C)cn1)c1ccc(OC)nc1 | 10.1016/j.bmcl.2010.02.018 | |||
| CHEMBL1093599 | 8436 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 392 | 7 | 0 | 6 | 3.5 | COCCN(C(=O)c1cnc(-c2cccc(C)c2C)cn1)c1ccc(OC)nc1 | 10.1016/j.bmcl.2010.02.018 | |||
| 44581242 | 175991 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 475 | 8 | 0 | 6 | 4.9 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3C)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| CHEMBL458635 | 175991 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 475 | 8 | 0 | 6 | 4.9 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3C)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| 46225118 | 203509 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 369 | 5 | 0 | 7 | 2.7 | COc1ccc(-n2c(C)nnc2N2CC(Oc3cc(F)ccc3C)C2)cn1 | 10.1016/j.bmcl.2009.11.097 | |||
| CHEMBL602641 | 203509 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 369 | 5 | 0 | 7 | 2.7 | COc1ccc(-n2c(C)nnc2N2CC(Oc3cc(F)ccc3C)C2)cn1 | 10.1016/j.bmcl.2009.11.097 | |||
| 46830096 | 7998 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 362 | 5 | 0 | 5 | 3.8 | CCN(C(=O)c1cnc(-c2cccc(C)c2C)cn1)c1ccc(OC)nc1 | 10.1016/j.bmcl.2010.02.018 | |||
| CHEMBL1090654 | 7998 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 362 | 5 | 0 | 5 | 3.8 | CCN(C(=O)c1cnc(-c2cccc(C)c2C)cn1)c1ccc(OC)nc1 | 10.1016/j.bmcl.2010.02.018 | |||
| 44325607 | 112219 | None | 0 | Human | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)cc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL329026 | 112219 | None | 0 | Human | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)cc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL2372316 | 212675 | None | 0 | Pig | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | None | None | None | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)CCCC(C(=O)N3CCC[C@@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00403a001 | |||||
| CHEMBL2372291 | 212670 | None | 0 | Pig | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | None | None | None | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSCC(C(=O)N3CCC[C@@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00403a001 | |||||
| 44382370 | 141637 | None | 0 | Pig | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1079 | 17 | 10 | 13 | 0.3 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL384776 | 141637 | None | 0 | Pig | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1079 | 17 | 10 | 13 | 0.3 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 44325915 | 112801 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 509 | 3 | 1 | 4 | 5.6 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL330494 | 112801 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 509 | 3 | 1 | 4 | 5.6 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| 2198 | 3420 | None | 2 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | Clc1cc(ccc1C(=O)N1C[C@H]2COCCN2Cc2c1cccc2)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 9807249 | 3420 | None | 2 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | Clc1cc(ccc1C(=O)N1C[C@H]2COCCN2Cc2c1cccc2)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL1192593 | 3420 | None | 2 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | Clc1cc(ccc1C(=O)N1C[C@H]2COCCN2Cc2c1cccc2)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325896 | 210270 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 551 | 4 | 1 | 5 | 4.9 | O=C(Nc1ccc(C(=O)N2CC3CS(=O)(=O)CCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL96255 | 210270 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 551 | 4 | 1 | 5 | 4.9 | O=C(Nc1ccc(C(=O)N2CC3CS(=O)(=O)CCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325895 | 210367 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 519 | 4 | 1 | 4 | 6.2 | O=C(Nc1ccc(C(=O)N2C[C@@H]3CSCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL96731 | 210367 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 519 | 4 | 1 | 4 | 6.2 | O=C(Nc1ccc(C(=O)N2C[C@@H]3CSCCN3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44385658 | 158944 | None | 0 | Pig | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1025 | 18 | 11 | 13 | 0.5 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL409486 | 158944 | None | 0 | Pig | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1025 | 18 | 11 | 13 | 0.5 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 44325363 | 106666 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1ccc(C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)c(-c2ccccc2)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL314290 | 106666 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1ccc(C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)c(-c2ccccc2)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| 73348612 | 89501 | None | 0 | Pig | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 939 | 16 | 9 | 12 | 1.9 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL2371680 | 89501 | None | 0 | Pig | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 939 | 16 | 9 | 12 | 1.9 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@@H](CCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 44577936 | 178686 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 371 | 5 | 0 | 5 | 4.9 | COc1ccc(-n2c(C)nnc2-c2ccc(-c3ccccc3OC)cc2)cc1 | 10.1016/j.bmcl.2008.06.098 | |||
| CHEMBL467184 | 178686 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 371 | 5 | 0 | 5 | 4.9 | COc1ccc(-n2c(C)nnc2-c2ccc(-c3ccccc3OC)cc2)cc1 | 10.1016/j.bmcl.2008.06.098 | |||
| 44581240 | 189833 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 486 | 8 | 0 | 7 | 4.4 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3C#N)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| CHEMBL515660 | 189833 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 486 | 8 | 0 | 7 | 4.4 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3C#N)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| 44325703 | 111466 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(O)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL327242 | 111466 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(O)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44375638 | 168951 | None | 0 | Pig | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| CHEMBL438014 | 168951 | None | 0 | Pig | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00156a015 | |||
| 44581266 | 175499 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 479 | 8 | 0 | 6 | 4.7 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3F)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| CHEMBL457544 | 175499 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 479 | 8 | 0 | 6 | 4.7 | COc1ccc(S(=O)(=O)N(Cc2ccc(-c3ccccc3F)cn2)c2ccc(OC)nc2)cc1 | 10.1016/j.bmcl.2008.11.018 | |||
| 11486351 | 193086 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 398 | 10 | 0 | 8 | 3.2 | CCOc1ccc(-c2nnc(COCCOC)n2-c2ccc(OC)nc2)cc1C | 10.1016/j.bmcl.2008.08.066 | |||
| CHEMBL522255 | 193086 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 398 | 10 | 0 | 8 | 3.2 | CCOc1ccc(-c2nnc(COCCOC)n2-c2ccc(OC)nc2)cc1C | 10.1016/j.bmcl.2008.08.066 | |||
| 44325704 | 112370 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(O)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL329141 | 112370 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(O)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325905 | 164372 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 571 | 4 | 1 | 4 | 7.0 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(Cl)c1)c1cc(F)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL421180 | 164372 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 571 | 4 | 1 | 4 | 7.0 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(Cl)c1)c1cc(F)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 2042 | 2983 | None | 40 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -25 | 5 | Drug Central | None | None | None | None | None | |||||
| 2174 | 2983 | None | 40 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -25 | 5 | Drug Central | None | None | None | None | None | |||||
| 2176 | 2983 | None | 40 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -25 | 5 | Drug Central | None | None | None | None | None | |||||
| 439302 | 2983 | None | 40 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -25 | 5 | Drug Central | None | None | None | None | None | |||||
| 439302.0 | 2983 | None | 40 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -25 | 5 | Drug Central | None | None | None | None | None | |||||
| CHEMBL395429 | 2983 | None | 40 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -25 | 5 | Drug Central | None | None | None | None | None | |||||
| DB00107 | 2983 | None | 40 | Human | Functional | pEC50 | = | 8.2 | 8.2 | -25 | 5 | Drug Central | None | None | None | None | None | |||||
| 5280343 | 188382 | None | 69 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -31 | 12 | Drug Central | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
| CHEMBL1520590 | 188382 | None | 69 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -31 | 12 | Drug Central | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
| CHEMBL50 | 188382 | None | 69 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -31 | 12 | Drug Central | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | None | |||
| 2812 | 4781 | None | 63 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -16 | 44 | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | |||
| CHEMBL104 | 4781 | None | 63 | Human | Functional | pIC50 | = | 8.3 | 8.3 | -16 | 44 | Drug Central | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | None | |||
| 3793 | 205667 | None | 50 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -2 | 4 | Drug Central | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | None | |||
| 45039617 | 205667 | None | 50 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -2 | 4 | Drug Central | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | None | |||
| CHEMBL64391 | 205667 | None | 50 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -2 | 4 | Drug Central | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | None | |||
| 3537 | 4004 | None | 22 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 3 | 4 | Guide to Pharmacology | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 16297621 | |||
| 5311500 | 4004 | None | 22 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 3 | 4 | Guide to Pharmacology | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 16297621 | |||
| CHEMBL363910 | 4004 | None | 22 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 3 | 4 | Guide to Pharmacology | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 16297621 | |||
| 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 |
|
| 3686 | 94720 | None | 64 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 338 | 12 | 1 | 5 | 3.5 | COC1=C(OC)C(=O)C(CCCCCCCCCCO)=C(C)C1=O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL252556 | 94720 | None | 64 | Human | Binding | pAC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 338 | 12 | 1 | 5 | 3.5 | COC1=C(OC)C(=O)C(CCCCCCCCCCO)=C(C)C1=O | 10.1038/s41467-023-40064-9 | |||
| 2335 | 11852 | None | 18 | Human | Binding | pAC50 | = | 4.9 | 4.9 | - | 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 | = | 4.9 | 4.9 | - | 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 | = | 4.9 | 4.9 | - | 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 | = | 4.9 | 4.9 | - | 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 | |||
| 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 | |||
| 2600 | 3779 | None | 53 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 13 | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| 2608 | 3779 | None | 53 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 13 | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| 5405 | 3779 | None | 53 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 13 | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL17157 | 3779 | None | 53 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 13 | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| DB00342 | 3779 | None | 53 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 13 | ChEMBL | 471 | 8 | 2 | 3 | 6.4 | OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O | 10.1038/s41467-023-40064-9 | |||
| 216416 | 111644 | None | 40 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 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 | = | 4.8 | 4.8 | - | 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 | |||
| 107771 | 120312 | None | 42 | Human | Binding | pAC50 | = | 4.8 | 4.8 | - | 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 | = | 4.8 | 4.8 | - | 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 | |||
| 214 | 3860 | None | 43 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 29 | ChEMBL | 407 | 4 | 0 | 4 | 4.9 | CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 156419 | 938 | None | 48 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 15 | ChEMBL | 357 | 6 | 1 | 1 | 6.1 | C[C@H](c1cccc2c1cccc2)NCCCc1cccc(c1)C(F)(F)F | 10.1038/s41467-023-40064-9 | |||
| 68617 | 207985 | None | 33 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | = | 4.7 | 4.7 | - | 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 | |||
| 212 | 3806 | None | 35 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 25 | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| 2639 | 3806 | None | 35 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 25 | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| 941651 | 3806 | None | 35 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 25 | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| 941651.0 | 3806 | None | 35 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 25 | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201 | 3806 | None | 35 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 25 | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| DB01623 | 3806 | None | 35 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 25 | ChEMBL | 443 | 5 | 0 | 5 | 3.5 | CN1CCN(CC1)CC/C=C\1/c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C | 10.1038/s41467-023-40064-9 | |||
| 135409453 | 3773 | None | 26 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 19 | ChEMBL | 301 | 7 | 3 | 3 | 2.6 | CCCCCN=C(N/N=C/c1c[nH]c2c1cc(OC)cc2)N | 10.1038/s41467-023-40064-9 | |||
| 226 | 3773 | None | 26 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 19 | ChEMBL | 301 | 7 | 3 | 3 | 2.6 | CCCCCN=C(N/N=C/c1c[nH]c2c1cc(OC)cc2)N | 10.1038/s41467-023-40064-9 | |||
| CHEMBL76370 | 3773 | None | 26 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 19 | ChEMBL | 301 | 7 | 3 | 3 | 2.6 | CCCCCN=C(N/N=C/c1c[nH]c2c1cc(OC)cc2)N | 10.1038/s41467-023-40064-9 | |||
| 5328940 | 100270 | None | 65 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 529 | 9 | 1 | 8 | 5.2 | COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl | 10.1038/s41467-023-40064-9 | |||
| CHEMBL288441 | 100270 | None | 65 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 529 | 9 | 1 | 8 | 5.2 | COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl | 10.1038/s41467-023-40064-9 | |||
| 9915743 | 63562 | None | 59 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 556 | 11 | 2 | 8 | 5.9 | CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C | 10.1038/s41467-023-40064-9 | |||
| CHEMBL180022 | 63562 | None | 59 | Human | Binding | pAC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 556 | 11 | 2 | 8 | 5.9 | CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C | 10.1038/s41467-023-40064-9 | |||
| 1222 | 1664 | None | 37 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | |||
| 16362 | 3125 | None | 49 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 29 | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 16362.0 | 3125 | None | 49 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 29 | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2172 | 3125 | None | 49 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 29 | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 90 | 3125 | None | 49 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 29 | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1423 | 3125 | None | 49 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 29 | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB01100 | 3125 | None | 49 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 29 | ChEMBL | 461 | 7 | 1 | 3 | 5.9 | Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2 | 10.1038/s41467-023-40064-9 | |||
| 191 | 403 | None | 60 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 28 | ChEMBL | 313 | 0 | 1 | 4 | 3.4 | Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1 | 10.1038/s41467-023-40064-9 | |||
| 6436173 | 55132 | None | 30 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 785 | 2 | 5 | 13 | 6.2 | CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c5c(nc6cc(C)ccn65)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 | |||
| CHEMBL1617 | 55132 | None | 30 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 785 | 2 | 5 | 13 | 6.2 | CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c5c(nc6cc(C)ccn65)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 | |||
| 4495 | 198991 | None | 63 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 30 | ChEMBL | 308 | 5 | 1 | 5 | 2.8 | CS(=O)(=O)Nc1ccc([N+](=O)[O-])cc1Oc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL56367 | 198991 | None | 63 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 30 | ChEMBL | 308 | 5 | 1 | 5 | 2.8 | CS(=O)(=O)Nc1ccc([N+](=O)[O-])cc1Oc1ccccc1 | 10.1038/s41467-023-40064-9 | |||
| 2435 | 3590 | None | 59 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 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 | = | 4.6 | 4.6 | - | 48 | ChEMBL | 440 | 5 | 1 | 3 | 4.6 | Clc1ccc2c(c1)c(cn2c1ccc(cc1)F)C1CCN(CC1)CCN1CCNC1=O | 10.1038/s41467-023-40064-9 | |||
| 176 | 398 | None | 47 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 31 | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2157 | 398 | None | 47 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 31 | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2157.0 | 398 | None | 47 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 31 | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 2566 | 398 | None | 47 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 31 | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL633 | 398 | None | 47 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 31 | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| DB01118 | 398 | None | 47 | Human | Binding | pAC50 | = | 4.6 | 4.6 | - | 31 | ChEMBL | 645 | 11 | 0 | 4 | 6.9 | CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2 | 10.1038/s41467-023-40064-9 | |||
| 118422671 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 1887 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 189562 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 189562.0 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 71301 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 71301.0 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 7246 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 9844194 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 9844194.0 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL2365658 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL3526436 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL434394 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| DB04861 | 2757 | None | 41 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 4 | ChEMBL | 405 | 6 | 3 | 5 | 2.4 | OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O | 10.1038/s41467-023-40064-9 | |||
| 135398735 | 137055 | None | 20 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 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 | = | 4.5 | 4.5 | - | 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 | = | 4.5 | 4.5 | - | 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 | |||
| 4046 | 2483 | None | 21 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 2 | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| 4252 | 2483 | None | 21 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 2 | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL416956 | 2483 | None | 21 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 2 | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| DB00358 | 2483 | None | 21 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 2 | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | OC(c1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F)C1CCCCN1 | 10.1038/s41467-023-40064-9 | |||
| 21722 | 17999 | None | 26 | Human | Binding | pAC50 | = | 4.5 | 4.5 | - | 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 | = | 4.5 | 4.5 | - | 5 | ChEMBL | 284 | 4 | 0 | 2 | 4.3 | CN(C)CCCn1c2c(c3ccccc31)CCCCCC2 | 10.1038/s41467-023-40064-9 | |||
| 54585 | 14508 | None | 49 | Human | Binding | pAC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 357 | 7 | 4 | 6 | 2.7 | O=C(O)CCNC(=O)c1ccc(/N=N/c2ccc(O)c(C(=O)O)c2)cc1 | 10.1038/s41467-023-40064-9 | |||
| CHEMBL1201346 | 14508 | None | 49 | Human | Binding | pAC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 357 | 7 | 4 | 6 | 2.7 | O=C(O)CCNC(=O)c1ccc(/N=N/c2ccc(O)c(C(=O)O)c2)cc1 | 10.1038/s41467-023-40064-9 | |||
| 2213 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 3008 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 5311010 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 5311010.0 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 68613 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 68613.0 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| CHEMBL378642 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| CHEMBL382301 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| DB09059 | 518 | None | 30 | Human | Binding | pAC50 | = | 5.4 | 5.4 | -660 | 5 | ChEMBL | None | None | None | None | 10.1038/s41467-023-40064-9 | |||||
| 2713 | 207729 | None | 57 | Human | Binding | pAC50 | = | 5.4 | 5.4 | - | 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 | = | 5.4 | 5.4 | - | 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 | = | 5.4 | 5.4 | - | 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 | = | 5.4 | 5.4 | - | 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 | = | 5.4 | 5.4 | - | 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 | = | 5.4 | 5.4 | - | 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 | = | 5.4 | 5.4 | - | 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 | |||
| 5329102 | 194838 | None | 50 | Human | Binding | pAC50 | = | 5.3 | 5.3 | - | 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 | = | 5.3 | 5.3 | - | 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 | |||
| 11980903 | 14498 | None | 13 | Human | Binding | pAC50 | = | 5.2 | 5.2 | - | 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 | = | 5.2 | 5.2 | - | 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 | = | 5.2 | 5.2 | - | 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 | = | 5.2 | 5.2 | - | 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 | |||
| 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 | |||
| 72093 | 35070 | None | 5 | Human | Binding | pAC50 | = | 5 | 5.0 | - | 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 | 5.0 | - | 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 | 5.0 | - | 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 | |||
| 2168 | 3976 | None | 29 | Human | Binding | pEC50 | = | 10.3 | 10.3 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 2810 | 3976 | None | 29 | Human | Binding | pEC50 | = | 10.3 | 10.3 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 644077 | 3976 | None | 29 | Human | Binding | pEC50 | = | 10.3 | 10.3 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 644077.0 | 3976 | None | 29 | Human | Binding | pEC50 | = | 10.3 | 10.3 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Binding | pEC50 | = | 10.3 | 10.3 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| DB00067 | 3976 | None | 29 | Human | Binding | pEC50 | = | 10.3 | 10.3 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 2181 | 1331 | None | 29 | Human | Binding | pEC50 | = | 9.7 | 9.7 | -12 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 2182 | 1331 | None | 29 | Human | Binding | pEC50 | = | 9.7 | 9.7 | -12 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 27991 | 1331 | None | 29 | Human | Binding | pEC50 | = | 9.7 | 9.7 | -12 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 27991.0 | 1331 | None | 29 | Human | Binding | pEC50 | = | 9.7 | 9.7 | -12 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| CHEMBL1429 | 1331 | None | 29 | Human | Binding | pEC50 | = | 9.7 | 9.7 | -12 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| CHEMBL264448 | 1331 | None | 29 | Human | Binding | pEC50 | = | 9.7 | 9.7 | -12 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| DB00035 | 1331 | None | 29 | Human | Binding | pEC50 | = | 9.7 | 9.7 | -12 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 118719821 | 115809 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 1005 | 19 | 11 | 14 | -2.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CCC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353932 | 115809 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 1005 | 19 | 11 | 14 | -2.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CCC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719829 | 115817 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 1035 | 23 | 11 | 14 | -1.1 | CCCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3353940 | 115817 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 1035 | 23 | 11 | 14 | -1.1 | CCCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118719832 | 115820 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 1009 | 21 | 12 | 15 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353943 | 115820 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 1009 | 21 | 12 | 15 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720286 | 115924 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 1038 | 21 | 11 | 13 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354598 | 115924 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 1038 | 21 | 11 | 13 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 44393912 | 64576 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 643 | 6 | 1 | 6 | 5.6 | CO[C@@H]1C[C@@H](C(=S)N2CCC(N3CCCC3)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL181487 | 64576 | None | 0 | Human | Binding | pEC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 643 | 6 | 1 | 6 | 5.6 | CO[C@@H]1C[C@@H](C(=S)N2CCC(N3CCCC3)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720277 | 115913 | None | 0 | Human | Binding | pEC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 988 | 22 | 10 | 12 | -1.5 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3354587 | 115913 | None | 0 | Human | Binding | pEC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 988 | 22 | 10 | 12 | -1.5 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118719828 | 115816 | None | 0 | Human | Binding | pEC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1019 | 19 | 11 | 14 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CCCC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353939 | 115816 | None | 0 | Human | Binding | pEC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1019 | 19 | 11 | 14 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CCCC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720275 | 115911 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 1004 | 22 | 11 | 13 | -1.8 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3354585 | 115911 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 1004 | 22 | 11 | 13 | -1.8 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118720266 | 115903 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 975 | 21 | 10 | 13 | -3.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCSC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354577 | 115903 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 975 | 21 | 10 | 13 | -3.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCSC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 10282736 | 123882 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 627 | 6 | 1 | 6 | 4.8 | CO[C@@H]1C[C@@H](C(=O)N2CCC(N3CCCC3)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL362382 | 123882 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 627 | 6 | 1 | 6 | 4.8 | CO[C@@H]1C[C@@H](C(=O)N2CCC(N3CCCC3)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720274 | 115910 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 974 | 21 | 10 | 12 | -1.9 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3354584 | 115910 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 974 | 21 | 10 | 12 | -1.9 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 44394045 | 169606 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 641 | 6 | 1 | 6 | 5.2 | CO[C@@H]1C[C@@H](C(=O)N2CCC(N3CCCCC3)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL443300 | 169606 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 641 | 6 | 1 | 6 | 5.2 | CO[C@@H]1C[C@@H](C(=O)N2CCC(N3CCCCC3)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720267 | 115904 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 975 | 21 | 10 | 13 | -3.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354578 | 115904 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 975 | 21 | 10 | 13 | -3.0 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 44393965 | 126270 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 587 | 5 | 1 | 6 | 3.8 | CO[C@@H]1C[C@@H](C(=O)N2CCCN(C)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL364994 | 126270 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 587 | 5 | 1 | 6 | 3.8 | CO[C@@H]1C[C@@H](C(=O)N2CCCN(C)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720278 | 115914 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 1023 | 20 | 11 | 13 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354588 | 115914 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 1023 | 20 | 11 | 13 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720284 | 115921 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 1041 | 20 | 11 | 13 | -1.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354595 | 115921 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 1041 | 20 | 11 | 13 | -1.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720262 | 115899 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 1048 | 21 | 12 | 15 | -2.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCC2CCCN2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354573 | 115899 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 1048 | 21 | 12 | 15 | -2.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCC2CCCN2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720263 | 115900 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 1064 | 21 | 11 | 16 | -3.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCN2CCOCC2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354574 | 115900 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 1064 | 21 | 11 | 16 | -3.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCN2CCOCC2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720285 | 115922 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 1025 | 20 | 10 | 12 | -1.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354596 | 115922 | None | 0 | Human | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 1025 | 20 | 10 | 12 | -1.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720269 | 115906 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 991 | 21 | 12 | 14 | -3.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354580 | 115906 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 991 | 21 | 12 | 14 | -3.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 44232512 | 115923 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1038 | 21 | 11 | 13 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354597 | 115923 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1038 | 21 | 11 | 13 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720283 | 115919 | None | 0 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 1022 | 20 | 10 | 12 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354593 | 115919 | None | 0 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 1022 | 20 | 10 | 12 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 11169 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| 131676677 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| 165708555 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| 165708555.0 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| 16681432 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| 16681432.0 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| 495 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| CHEMBL3301668 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| DB01282 | 797 | None | 33 | Human | Binding | pEC50 | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | None | None | None | CC[C@@H]([C@@H]1NC(=O)[C@@H](NC(=O)CCCSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)OC)C | 10.1021/jm500365s | |||||
| 118719840 | 115828 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1042 | 20 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccnc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353951 | 115828 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1042 | 20 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccnc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720272 | 115908 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 990 | 21 | 11 | 13 | -2.2 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3354582 | 115908 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 990 | 21 | 11 | 13 | -2.2 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118719839 | 115827 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1042 | 20 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccn2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353950 | 115827 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1042 | 20 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccn2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719843 | 115831 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1056 | 21 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2ccccn2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353954 | 115831 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1056 | 21 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2ccccn2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 44393998 | 66296 | None | 0 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 561 | 8 | 2 | 6 | 3.4 | CO[C@@H]1C[C@@H](C(=O)NCCN(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL184696 | 66296 | None | 0 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 561 | 8 | 2 | 6 | 3.4 | CO[C@@H]1C[C@@H](C(=O)NCCN(C)C)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 44394063 | 66382 | None | 0 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 573 | 4 | 1 | 5 | 5.0 | CN1CCCN(C(=S)[C@@H]2CCCN2C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)CC1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL185152 | 66382 | None | 0 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 573 | 4 | 1 | 5 | 5.0 | CN1CCCN(C(=S)[C@@H]2CCCN2C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)CC1 | 10.1016/j.bmcl.2004.04.107 | |||
| 44393911 | 65247 | None | 0 | Human | Binding | pEC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 611 | 8 | 2 | 6 | 5.7 | CO[C@@H]1C[C@@H](/C(S)=N/CCc2ccccn2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL182627 | 65247 | None | 0 | Human | Binding | pEC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 611 | 8 | 2 | 6 | 5.7 | CO[C@@H]1C[C@@H](/C(S)=N/CCc2ccccn2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720273 | 115909 | None | 0 | Human | Binding | pEC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 974 | 21 | 10 | 12 | -1.9 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3354583 | 115909 | None | 0 | Human | Binding | pEC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 974 | 21 | 10 | 12 | -1.9 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118720281 | 115917 | None | 0 | Human | Binding | pEC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 1038 | 20 | 11 | 13 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354591 | 115917 | None | 0 | Human | Binding | pEC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 1038 | 20 | 11 | 13 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720276 | 115912 | None | 0 | Human | Binding | pEC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 1004 | 22 | 11 | 13 | -1.8 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3354586 | 115912 | None | 0 | Human | Binding | pEC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 1004 | 22 | 11 | 13 | -1.8 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CCSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118720261 | 115898 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1035 | 20 | 11 | 15 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)CC2CCCO2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354572 | 115898 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1035 | 20 | 11 | 15 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)CC2CCCO2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 44394044 | 123902 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 603 | 5 | 1 | 6 | 4.6 | CO[C@@H]1C[C@@H](C(=S)N2CCCN(C)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL362483 | 123902 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 603 | 5 | 1 | 6 | 4.6 | CO[C@@H]1C[C@@H](C(=S)N2CCCN(C)CC2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720288 | 115926 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1029 | 20 | 11 | 14 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354600 | 115926 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1029 | 20 | 11 | 14 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720270 | 115578 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 975 | 21 | 11 | 13 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3352839 | 115578 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 975 | 21 | 11 | 13 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 449224 | 169078 | None | 10 | Human | Binding | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 991 | 17 | 11 | 14 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL439044 | 169078 | None | 10 | Human | Binding | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 991 | 17 | 11 | 14 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719835 | 115823 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1055 | 20 | 11 | 14 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353946 | 115823 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1055 | 20 | 11 | 14 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720289 | 115927 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1029 | 20 | 11 | 14 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354601 | 115927 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1029 | 20 | 11 | 14 | -1.7 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720287 | 115925 | None | 0 | Human | Binding | pEC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 1022 | 21 | 10 | 12 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354599 | 115925 | None | 0 | Human | Binding | pEC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 1022 | 21 | 10 | 12 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 76073634 | 115920 | None | 5 | Human | Binding | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 1041 | 20 | 11 | 13 | -1.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354594 | 115920 | None | 5 | Human | Binding | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 1041 | 20 | 11 | 13 | -1.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719833 | 115821 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1041 | 20 | 11 | 14 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353944 | 115821 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1041 | 20 | 11 | 14 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719820 | 115808 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1007 | 21 | 11 | 14 | -1.9 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3353931 | 115808 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1007 | 21 | 11 | 14 | -1.9 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118720279 | 115915 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1023 | 20 | 11 | 13 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354589 | 115915 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1023 | 20 | 11 | 13 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 2252 | 2230 | None | 35 | Human | Binding | pEC50 | = | 4.4 | 4.4 | -10000 | 5 | ChEMBL | 507 | 5 | 0 | 6 | 3.8 | COc1cc(ccc1C(=O)N1CCC(CC1)N1C(=O)OCc2c1cccc2)OC1CCN(CC1)C(=O)C | 10.1021/jm901084f | |||
| 6918320 | 2230 | None | 35 | Human | Binding | pEC50 | = | 4.4 | 4.4 | -10000 | 5 | ChEMBL | 507 | 5 | 0 | 6 | 3.8 | COc1cc(ccc1C(=O)N1CCC(CC1)N1C(=O)OCc2c1cccc2)OC1CCN(CC1)C(=O)C | 10.1021/jm901084f | |||
| CHEMBL24781 | 2230 | None | 35 | Human | Binding | pEC50 | = | 4.4 | 4.4 | -10000 | 5 | ChEMBL | 507 | 5 | 0 | 6 | 3.8 | COc1cc(ccc1C(=O)N1CCC(CC1)N1C(=O)OCc2c1cccc2)OC1CCN(CC1)C(=O)C | 10.1021/jm901084f | |||
| 118719841 | 115829 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 1042 | 20 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccncc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353952 | 115829 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 1042 | 20 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccncc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 3537 | 4004 | None | 22 | Human | Binding | pEC50 | = | 7.4 | 7.4 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1021/jm901084f | |||
| 5311500 | 4004 | None | 22 | Human | Binding | pEC50 | = | 7.4 | 7.4 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1021/jm901084f | |||
| CHEMBL363910 | 4004 | None | 22 | Human | Binding | pEC50 | = | 7.4 | 7.4 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1021/jm901084f | |||
| 118719818 | 115806 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 991 | 19 | 11 | 14 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353929 | 115806 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 991 | 19 | 11 | 14 | -2.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719824 | 115812 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1017 | 19 | 11 | 14 | -3.1 | CCOc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3C[C@@H](O)C[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm500365s | |||
| CHEMBL3353935 | 115812 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1017 | 19 | 11 | 14 | -3.1 | CCOc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3C[C@@H](O)C[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm500365s | |||
| 118719825 | 115813 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 1032 | 20 | 10 | 14 | -2.5 | CCOc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3C[C@@H](OC)C[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm500365s | |||
| CHEMBL3353936 | 115813 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 1032 | 20 | 10 | 14 | -2.5 | CCOc1ccc(C[C@@H]2NC(=O)CCCSC[C@@H](C(=O)N3C[C@@H](OC)C[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm500365s | |||
| 118719826 | 115814 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 947 | 19 | 11 | 13 | -3.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCCSC[C@@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353937 | 115814 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 947 | 19 | 11 | 13 | -3.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCCSC[C@@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719844 | 115832 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1056 | 21 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2ccncc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353955 | 115832 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1056 | 21 | 11 | 15 | -2.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2ccncc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720268 | 115905 | None | 0 | Human | Binding | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 991 | 21 | 12 | 14 | -3.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354579 | 115905 | None | 0 | Human | Binding | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 991 | 21 | 12 | 14 | -3.6 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CCCO)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720265 | 115902 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 991 | 21 | 11 | 14 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354576 | 115902 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 991 | 21 | 11 | 14 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720282 | 115918 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1038 | 20 | 11 | 13 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354592 | 115918 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1038 | 20 | 11 | 13 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccc(C)c2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719830 | 115818 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1033 | 19 | 11 | 14 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CCCCC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353941 | 115818 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1033 | 19 | 11 | 14 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C2CCCCC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719845 | 115833 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1047 | 20 | 11 | 15 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353956 | 115833 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1047 | 20 | 11 | 15 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 44393941 | 170951 | None | 0 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 595 | 8 | 2 | 6 | 4.4 | CO[C@@H]1C[C@@H](C(=O)NCCc2ccccn2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL445393 | 170951 | None | 0 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 595 | 8 | 2 | 6 | 4.4 | CO[C@@H]1C[C@@H](C(=O)NCCc2ccccn2)N(C(=O)NCc2ccc(C(=O)N3CCCCc4sccc43)cc2Cl)C1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720259 | 115896 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1031 | 20 | 11 | 15 | -1.9 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccco2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354570 | 115896 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1031 | 20 | 11 | 15 | -1.9 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccco2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719842 | 115830 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1055 | 21 | 11 | 14 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353953 | 115830 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1055 | 21 | 11 | 14 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719823 | 115811 | None | 0 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 1033 | 19 | 10 | 14 | -2.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCCSC[C@@H](C(=O)N2C[C@H](SC)C[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353934 | 115811 | None | 0 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 1033 | 19 | 10 | 14 | -2.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCCSC[C@@H](C(=O)N2C[C@H](SC)C[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719834 | 115822 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1055 | 20 | 11 | 14 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353945 | 115822 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1055 | 20 | 11 | 14 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719822 | 115810 | None | 0 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 1017 | 19 | 10 | 14 | -2.9 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCCSC[C@@H](C(=O)N2C[C@H](OC)C[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353933 | 115810 | None | 0 | Human | Binding | pEC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 1017 | 19 | 10 | 14 | -2.9 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCCSC[C@@H](C(=O)N2C[C@H](OC)C[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 2042 | 2983 | None | 40 | Human | Binding | pEC50 | = | 8.1 | 8.1 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 2174 | 2983 | None | 40 | Human | Binding | pEC50 | = | 8.1 | 8.1 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 2176 | 2983 | None | 40 | Human | Binding | pEC50 | = | 8.1 | 8.1 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 439302 | 2983 | None | 40 | Human | Binding | pEC50 | = | 8.1 | 8.1 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 439302.0 | 2983 | None | 40 | Human | Binding | pEC50 | = | 8.1 | 8.1 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| CHEMBL395429 | 2983 | None | 40 | Human | Binding | pEC50 | = | 8.1 | 8.1 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| DB00107 | 2983 | None | 40 | Human | Binding | pEC50 | = | 8.1 | 8.1 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm500365s | |||||
| 10411308 | 203691 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm901084f | |||
| CHEMBL603708 | 203691 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm901084f | |||
| 118720264 | 115901 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 991 | 21 | 11 | 14 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354575 | 115901 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 991 | 21 | 11 | 14 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCSC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720280 | 115916 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 1007 | 20 | 10 | 12 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354590 | 115916 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 1007 | 20 | 10 | 12 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118720271 | 115907 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 990 | 21 | 11 | 13 | -2.2 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3354581 | 115907 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 990 | 21 | 11 | 13 | -2.2 | CCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSCCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118720290 | 115928 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 1013 | 20 | 10 | 13 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354602 | 115928 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 1013 | 20 | 10 | 13 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSCC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2cccs2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719827 | 115815 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1021 | 22 | 11 | 14 | -1.5 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| CHEMBL3353938 | 115815 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1021 | 22 | 11 | 14 | -1.5 | CCCCCN(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm500365s | |||
| 118719838 | 115826 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1071 | 21 | 11 | 15 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(OC)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353949 | 115826 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1071 | 21 | 11 | 15 | -1.5 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(OC)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719831 | 115819 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1009 | 21 | 11 | 15 | -3.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353942 | 115819 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1009 | 21 | 11 | 15 | -3.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCOC)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719837 | 115825 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1059 | 20 | 11 | 14 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353948 | 115825 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1059 | 20 | 11 | 14 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(F)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 118719836 | 115824 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1055 | 20 | 11 | 14 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(C)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353947 | 115824 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1055 | 20 | 11 | 14 | -1.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)Cc2ccc(C)cc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 135413563 | 122996 | None | 20 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 8 | ChEMBL | 600 | 4 | 2 | 7 | 4.3 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1021/jm901084f | |||
| CHEMBL360648 | 122996 | None | 20 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 8 | ChEMBL | 600 | 4 | 2 | 7 | 4.3 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1021/jm901084f | |||
| 135413563 | 122996 | None | 20 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 8 | ChEMBL | 600 | 4 | 2 | 7 | 4.3 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL360648 | 122996 | None | 20 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 8 | ChEMBL | 600 | 4 | 2 | 7 | 4.3 | Cc1cc(C(=O)N2Cc3cnn(C)c3Nc3ccccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118720260 | 115897 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1061 | 21 | 11 | 15 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2cccs2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3354571 | 115897 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1061 | 21 | 11 | 15 | -1.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CCc2cccs2)CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 10187625 | 127357 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 553 | 4 | 1 | 5 | 4.7 | Cc1cc(C(=O)N2CCCCc3sccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1016/j.bmcl.2004.04.107 | |||
| CHEMBL365862 | 127357 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 553 | 4 | 1 | 5 | 4.7 | Cc1cc(C(=O)N2CCCCc3sccc32)ccc1CNC(=O)N1CCC[C@H]1C(=S)N1CCCN(C)CC1 | 10.1016/j.bmcl.2004.04.107 | |||
| 118719819 | 115807 | None | 0 | Human | Binding | pEC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 1005 | 20 | 11 | 14 | -2.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)CC2CC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| CHEMBL3353930 | 115807 | None | 0 | Human | Binding | pEC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 1005 | 20 | 11 | 14 | -2.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(CC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)CC2CC2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm500365s | |||
| 44332239 | 4535 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 466 | 4 | 1 | 3 | 6.3 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL102311 | 4535 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 466 | 4 | 1 | 3 | 6.3 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.02.103 | |||
| 172997 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00279-6 | |||
| 2238 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL49429 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00279-6 | |||
| DB06666 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00279-6 | |||
| 10648029 | 105476 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 469 | 3 | 1 | 3 | 6.2 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)c(Cl)c2)c1C | 10.1021/jm980179c | |||
| CHEMBL311931 | 105476 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 469 | 3 | 1 | 3 | 6.2 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)c(Cl)c2)c1C | 10.1021/jm980179c | |||
| 10743786 | 163574 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 493 | 3 | 1 | 3 | 6.4 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccc(F)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL420031 | 163574 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 493 | 3 | 1 | 3 | 6.4 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccc(F)cc1Cl | 10.1021/jm980179c | |||
| 15308000 | 187450 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 438 | 3 | 1 | 3 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)cc1 | 10.1016/s0960-894x(99)00278-4 | |||
| CHEMBL49322 | 187450 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 438 | 3 | 1 | 3 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)cc1 | 10.1016/s0960-894x(99)00278-4 | |||
| 9826033 | 57479 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 471 | 4 | 2 | 2 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL165670 | 57479 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 471 | 4 | 2 | 2 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 56848490 | 146840 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 575 | 10 | 3 | 8 | 2.9 | NC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| CHEMBL3924331 | 146840 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 575 | 10 | 3 | 8 | 2.9 | NC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| 44213443 | 177123 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 440 | 3 | 1 | 4 | 4.8 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL46295 | 177123 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 440 | 3 | 1 | 4 | 4.8 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| 10742418 | 104542 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 455 | 3 | 1 | 3 | 5.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/jm980179c | |||
| CHEMBL310416 | 104542 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 455 | 3 | 1 | 3 | 5.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/jm980179c | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 9 | 9.0 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2005.08.007 | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 9 | 9.0 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 9 | 9.0 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2005.08.007 | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 9 | 9.0 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2005.08.007 | |||
| 11490613 | 161832 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 636 | 9 | 1 | 6 | 6.6 | CN1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL413748 | 161832 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 636 | 9 | 1 | 6 | 6.6 | CN1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 11490514 | 130757 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 622 | 10 | 1 | 6 | 7.1 | CN1CCN(CCCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL368354 | 130757 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 622 | 10 | 1 | 6 | 7.1 | CN1CCN(CCCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 44213442 | 102085 | None | 0 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 460 | 3 | 1 | 4 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL301788 | 102085 | None | 0 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 460 | 3 | 1 | 4 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| 21467141 | 119731 | None | 0 | Rat | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 486 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL347020 | 119731 | None | 0 | Rat | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 486 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.08.053 | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.08.053 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.08.053 | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.08.053 | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00095-0 | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00095-0 | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00095-0 | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00278-4 | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00278-4 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00278-4 | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(99)00278-4 | |||
| 44378719 | 57435 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 629 | 6 | 1 | 5 | 7.0 | CN1CCN(Cc2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL165340 | 57435 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 629 | 6 | 1 | 5 | 7.0 | CN1CCN(Cc2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| 89701036 | 151892 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 496 | 7 | 2 | 7 | 3.2 | O=c1n(Cc2nnc(Cc3ccccc3F)[nH]2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3965167 | 151892 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 496 | 7 | 2 | 7 | 3.2 | O=c1n(Cc2nnc(Cc3ccccc3F)[nH]2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10459252 | 52667 | None | 0 | Rat | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 517 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL159359 | 52667 | None | 0 | Rat | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 517 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 69940391 | 148637 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 512 | 7 | 2 | 7 | 3.7 | O=c1n(Cc2nnc(Cc3ccccc3Cl)[nH]2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3938717 | 148637 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 512 | 7 | 2 | 7 | 3.7 | O=c1n(Cc2nnc(Cc3ccccc3Cl)[nH]2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10003306 | 206231 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| CHEMBL68085 | 206231 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| 10003306 | 206231 | None | 0 | Rat | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL68085 | 206231 | None | 0 | Rat | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 18917497 | 101775 | None | 0 | Rat | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 486 | 3 | 1 | 4 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1Br | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL299532 | 101775 | None | 0 | Rat | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 486 | 3 | 1 | 4 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1Br | 10.1016/s0960-894x(99)00279-6 | |||
| 10098338 | 120167 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 524 | 4 | 2 | 4 | 6.9 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL350973 | 120167 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 524 | 4 | 2 | 4 | 6.9 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 44213444 | 101969 | None | 0 | Rat | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 442 | 3 | 1 | 4 | 5.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL300963 | 101969 | None | 0 | Rat | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 442 | 3 | 1 | 4 | 5.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| 10672170 | 207854 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/jm980179c | |||
| CHEMBL80029 | 207854 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/jm980179c | |||
| 10696913 | 208027 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 505 | 4 | 1 | 4 | 6.3 | COc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1NC(=O)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL81269 | 208027 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 505 | 4 | 1 | 4 | 6.3 | COc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1NC(=O)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| 44336418 | 108243 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 569 | 6 | 2 | 5 | 5.0 | COC(=O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3C)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL319636 | 108243 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 569 | 6 | 2 | 5 | 5.0 | COC(=O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3C)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 56848557 | 146761 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 607 | 9 | 3 | 7 | 3.5 | CC(=O)NC(C)(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| CHEMBL3923775 | 146761 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 607 | 9 | 3 | 7 | 3.5 | CC(=O)NC(C)(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| 44335345 | 5173 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | 4 | 2 | ChEMBL | 505 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1Cl | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL105961 | 5173 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | 4 | 2 | ChEMBL | 505 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1Cl | 10.1016/s0960-894x(02)00649-2 | |||
| 11386922 | 60460 | None | 0 | Rat | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 525 | 6 | 1 | 5 | 6.7 | COc1cc(C(=O)N2CCCC(N(C)C)c3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL175212 | 60460 | None | 0 | Rat | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 525 | 6 | 1 | 5 | 6.7 | COc1cc(C(=O)N2CCCC(N(C)C)c3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 11272841 | 60820 | None | 0 | Rat | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 550 | 7 | 1 | 5 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCN(CCN3CCCC3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL176146 | 60820 | None | 0 | Rat | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 550 | 7 | 1 | 5 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCN(CCN3CCCC3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 10840974 | 61799 | None | 0 | Rat | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 579 | 7 | 1 | 6 | 5.8 | CN1CCN(CCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccsc32)CC1 | 10.1021/jm030287l | |||
| CHEMBL177285 | 61799 | None | 0 | Rat | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 579 | 7 | 1 | 6 | 5.8 | CN1CCN(CCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccsc32)CC1 | 10.1021/jm030287l | |||
| 11763684 | 131425 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 650 | 9 | 1 | 6 | 7.0 | CN1CCCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL368818 | 131425 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 650 | 9 | 1 | 6 | 7.0 | CN1CCCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 11798757 | 206746 | None | 0 | Rat | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1C(F)(F)F | 10.1021/jm980179c | |||
| CHEMBL71305 | 206746 | None | 0 | Rat | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1C(F)(F)F | 10.1021/jm980179c | |||
| 44352767 | 115185 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 528 | 6 | 1 | 3 | 7.8 | O=C(Nc1ccc(C(=O)N2CCC(CC(F)F)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL334363 | 115185 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 528 | 6 | 1 | 3 | 7.8 | O=C(Nc1ccc(C(=O)N2CCC(CC(F)F)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| 69940642 | 151868 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 509 | 6 | 1 | 7 | 4.4 | O=c1n(Cc2ccnc(-c3ccccc3Cl)n2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3964983 | 151868 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 509 | 6 | 1 | 7 | 4.4 | O=c1n(Cc2ccnc(-c3ccccc3Cl)n2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10603742 | 128739 | None | 0 | Rat | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 607 | 6 | 1 | 6 | 5.7 | CN1CCCN(CC(=O)N2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccsc32)CC1 | 10.1021/jm030287l | |||
| CHEMBL366816 | 128739 | None | 0 | Rat | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 607 | 6 | 1 | 6 | 5.7 | CN1CCCN(CC(=O)N2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccsc32)CC1 | 10.1021/jm030287l | |||
| 44386548 | 132423 | None | 0 | Rat | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 433 | 4 | 1 | 4 | 5.4 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3sccc32)cc1 | 10.1021/jm00137a004 | |||
| CHEMBL369712 | 132423 | None | 0 | Rat | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 433 | 4 | 1 | 4 | 5.4 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3sccc32)cc1 | 10.1021/jm00137a004 | |||
| 10527137 | 12791 | None | 0 | Rat | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 441 | 4 | 0 | 3 | 5.3 | Cc1ccccc1C(=O)N(C)c1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL118805 | 12791 | None | 0 | Rat | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 441 | 4 | 0 | 3 | 5.3 | Cc1ccccc1C(=O)N(C)c1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 10499401 | 14037 | None | 0 | Rat | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 370 | 4 | 1 | 2 | 4.5 | O=C(Cc1ccccc1)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL119730 | 14037 | None | 0 | Rat | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 370 | 4 | 1 | 2 | 4.5 | O=C(Cc1ccccc1)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44433372 | 89960 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 426 | 5 | 3 | 3 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)Nc2ccccc2C(=O)O)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| CHEMBL237987 | 89960 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 426 | 5 | 3 | 3 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)Nc2ccccc2C(=O)O)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| 44433375 | 90221 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 505 | 7 | 3 | 4 | 5.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)Nc2ccccc2Cn2cccc2C(=O)O)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| CHEMBL238206 | 90221 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 505 | 7 | 3 | 4 | 5.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)Nc2ccccc2Cn2cccc2C(=O)O)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| 10710850 | 119311 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 320 | 2 | 0 | 2 | 4.3 | O=C(c1ccc(N2CCCC2)cc1)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| CHEMBL343538 | 119311 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 320 | 2 | 0 | 2 | 4.3 | O=C(c1ccc(N2CCCC2)cc1)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| 11756081 | 18906 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 510 | 6 | 1 | 5 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cn1ccnc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128398 | 18906 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 510 | 6 | 1 | 5 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cn1ccnc1)C2 | 10.1021/jm00077a002 | |||
| 10098227 | 18964 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1cccnc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128680 | 18964 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1cccnc1)C2 | 10.1021/jm00077a002 | |||
| 9983763 | 19391 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 508 | 7 | 1 | 4 | 3.8 | CCCS(=O)(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL129234 | 19391 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 508 | 7 | 1 | 4 | 3.8 | CCCS(=O)(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10436744 | 21176 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1ccncc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131269 | 21176 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1ccncc1)C2 | 10.1021/jm00077a002 | |||
| 10256140 | 21525 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 520 | 6 | 1 | 3 | 4.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@H](NC(=O)Cc1ccccc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131613 | 21525 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 520 | 6 | 1 | 3 | 4.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@H](NC(=O)Cc1ccccc1)C2 | 10.1021/jm00077a002 | |||
| 44352440 | 116835 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 535 | 6 | 2 | 5 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1ccncc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL337667 | 116835 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 535 | 6 | 2 | 5 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1ccncc1)C2 | 10.1021/jm00077a002 | |||
| 44352497 | 117121 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 472 | 5 | 2 | 4 | 3.1 | CC(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL339151 | 117121 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 472 | 5 | 2 | 4 | 3.1 | CC(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10324129 | 168655 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 512 | 6 | 1 | 7 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cn1cnnn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL435613 | 168655 | None | 0 | Rat | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 512 | 6 | 1 | 7 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cn1cnnn1)C2 | 10.1021/jm00077a002 | |||
| 10432863 | 98369 | None | 0 | Rat | Binding | pIC50 | = | 4 | 4.0 | - | 0 | ChEMBL | 430 | 4 | 2 | 4 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@](O)(CN)C2 | 10.1021/jm00077a002 | |||
| CHEMBL274955 | 98369 | None | 0 | Rat | Binding | pIC50 | = | 4 | 4.0 | - | 0 | ChEMBL | 430 | 4 | 2 | 4 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@](O)(CN)C2 | 10.1021/jm00077a002 | |||
| CHEMBL2332718 | 211994 | None | 0 | Human | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | None | None | None | NC[C@@H]1NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O | 10.1016/j.bmcl.2012.12.041 | |||||
| 10461417 | 107357 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL317243 | 107357 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 44336636 | 164260 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 585 | 7 | 3 | 4 | 6.0 | O=C(NCCO)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL421039 | 164260 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 585 | 7 | 3 | 4 | 6.0 | O=C(NCCO)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 67409933 | 150153 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 554 | 8 | 1 | 7 | 5.5 | COc1ccc(Cn2c(-c3ccc(Cl)cc3)nn(Cc3nnc(Cc4c(Cl)cccc4Cl)[nH]3)c2=O)cc1 | nan | |||
| CHEMBL3950716 | 150153 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 554 | 8 | 1 | 7 | 5.5 | COc1ccc(Cn2c(-c3ccc(Cl)cc3)nn(Cc3nnc(Cc4c(Cl)cccc4Cl)[nH]3)c2=O)cc1 | nan | |||
| 56848553 | 145705 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 651 | 9 | 3 | 8 | 5.0 | CC(C)(C)OC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(Cl)c1Cl | nan | |||
| CHEMBL3915616 | 145705 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 651 | 9 | 3 | 8 | 5.0 | CC(C)(C)OC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(Cl)c1Cl | nan | |||
| 9869993 | 165647 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 485 | 4 | 2 | 2 | 7.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCc4c[nH]c5cccc3c45)cc2)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL424183 | 165647 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 485 | 4 | 2 | 2 | 7.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCc4c[nH]c5cccc3c45)cc2)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 44433363 | 146740 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 489 | 3 | 1 | 3 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2C=C3CCC(=O)N3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| CHEMBL392363 | 146740 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 489 | 3 | 1 | 3 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2C=C3CCC(=O)N3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| 9961036 | 11730 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 643 | 5 | 1 | 5 | 6.7 | CN1CCN(C(=O)c2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL1181319 | 11730 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 643 | 5 | 1 | 5 | 6.7 | CN1CCN(C(=O)c2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL164387 | 11730 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 643 | 5 | 1 | 5 | 6.7 | CN1CCN(C(=O)c2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| 53378729 | 142542 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 473 | 7 | 0 | 6 | 5.2 | C=CCn1c(-c2ccc(Cl)cc2)nn(Cc2cncn2Cc2c(Cl)cccc2Cl)c1=O | nan | |||
| CHEMBL3890193 | 142542 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 473 | 7 | 0 | 6 | 5.2 | C=CCn1c(-c2ccc(Cl)cc2)nn(Cc2cncn2Cc2c(Cl)cccc2Cl)c1=O | nan | |||
| 10620180 | 113568 | None | 0 | Rat | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 386 | 3 | 1 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCOc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL332060 | 113568 | None | 0 | Rat | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 386 | 3 | 1 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCOc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 23598597 | 94150 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 528 | 5 | 2 | 4 | 5.8 | COc1cc(NC(=O)c2cc(F)ccc2C)ccc1C(=O)N1CCC2(C=C(C(=O)O)CC2)Cc2ccccc21 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249133 | 94150 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 528 | 5 | 2 | 4 | 5.8 | COc1cc(NC(=O)c2cc(F)ccc2C)ccc1C(=O)N1CCC2(C=C(C(=O)O)CC2)Cc2ccccc21 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL338018 | 214061 | None | 0 | Rat | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](CCCCN)NC(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 69940703 | 146287 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 490 | 6 | 0 | 6 | 5.8 | O=c1n(Cc2ncc(Cc3cccc(C(F)(F)F)c3)s2)nc(-c2ccc(Cl)cc2)n1C1CC1 | nan | |||
| CHEMBL3920097 | 146287 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 490 | 6 | 0 | 6 | 5.8 | O=c1n(Cc2ncc(Cc3cccc(C(F)(F)F)c3)s2)nc(-c2ccc(Cl)cc2)n1C1CC1 | nan | |||
| CHEMBL2112248 | 211694 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00099a019 | |||||
| 44273368 | 98848 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 584 | 9 | 1 | 6 | 3.2 | CN(C)CCCNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL278377 | 98848 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 584 | 9 | 1 | 6 | 3.2 | CN(C)CCCNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 10031372 | 18883 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 592 | 7 | 2 | 6 | 2.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CCS(N)(=O)=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128258 | 18883 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 592 | 7 | 2 | 6 | 2.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CCS(N)(=O)=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44352433 | 117339 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 622 | 10 | 3 | 7 | 1.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)NC(=O)CN)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339498 | 117339 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 622 | 10 | 3 | 7 | 1.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)NC(=O)CN)C2 | 10.1021/jm00077a002 | |||
| 9881053 | 120309 | None | 0 | Pig | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 339 | 5 | 1 | 4 | 4.1 | CCCN1CCC(COc2nc3ccccc3c3c2CCCN3)CC1 | 10.1021/jm020954v | |||
| CHEMBL35226 | 120309 | None | 0 | Pig | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 339 | 5 | 1 | 4 | 4.1 | CCCN1CCC(COc2nc3ccccc3c3c2CCCN3)CC1 | 10.1021/jm020954v | |||
| CHEMBL129733 | 211141 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| CHEMBL338020 | 214062 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 10030575 | 22126 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 554 | 5 | 2 | 4 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)NC1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| CHEMBL132210 | 22126 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 554 | 5 | 2 | 4 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)NC1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| 44273077 | 99238 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 589 | 7 | 1 | 5 | 4.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@H](NCc3ccccc3)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL281361 | 99238 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 589 | 7 | 1 | 5 | 4.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@H](NCc3ccccc3)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 3793 | 205667 | None | 50 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 45039617 | 205667 | None | 50 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| CHEMBL64391 | 205667 | None | 50 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 44352777 | 21389 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 572 | 7 | 2 | 5 | 6.4 | O=C(Nc1ccc(C(=O)N2CCC(CCS(=O)(=O)O)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL131439 | 21389 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 572 | 7 | 2 | 5 | 6.4 | O=C(Nc1ccc(C(=O)N2CCC(CCS(=O)(=O)O)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| 53378841 | 145985 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 508 | 6 | 1 | 6 | 5.1 | O=c1n(Cc2cncc(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1CC(O)C(F)(F)F | nan | |||
| CHEMBL3917760 | 145985 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 508 | 6 | 1 | 6 | 5.1 | O=c1n(Cc2cncc(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1CC(O)C(F)(F)F | nan | |||
| 53378731 | 153817 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 556 | 8 | 2 | 9 | 3.3 | O=C(O)Cn1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nc1-c1ccccc1Cl | nan | |||
| CHEMBL3981686 | 153817 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 556 | 8 | 2 | 9 | 3.3 | O=C(O)Cn1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nc1-c1ccccc1Cl | nan | |||
| 119369 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm960133o | |||
| 2197 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm960133o | |||
| 4004 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm960133o | |||
| CHEMBL420762 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm960133o | |||
| 44377961 | 57531 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 585 | 5 | 3 | 4 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCc3c(S(=O)(=O)O)[nH]c4cccc2c34)cc1Cl)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL166135 | 57531 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 585 | 5 | 3 | 4 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCc3c(S(=O)(=O)O)[nH]c4cccc2c34)cc1Cl)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 19699093 | 120102 | None | 0 | Rat | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 428 | 3 | 2 | 4 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL350383 | 120102 | None | 0 | Rat | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 428 | 3 | 2 | 4 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 10595255 | 26547 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 368 | 2 | 0 | 2 | 5.3 | O=C(c1ccc(N2CCCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| CHEMBL136065 | 26547 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 368 | 2 | 0 | 2 | 5.3 | O=C(c1ccc(N2CCCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| 56848685 | 151884 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 603 | 10 | 2 | 9 | 4.5 | COCCn1c(-c2ccc(Cl)s2)nn(CC(=O)NCC(NC(=O)OC(C)(C)C)c2ccccc2C(F)(F)F)c1=O | nan | |||
| CHEMBL3965109 | 151884 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 603 | 10 | 2 | 9 | 4.5 | COCCn1c(-c2ccc(Cl)s2)nn(CC(=O)NCC(NC(=O)OC(C)(C)C)c2ccccc2C(F)(F)F)c1=O | nan | |||
| 10810069 | 11727 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 384 | 3 | 1 | 2 | 5.1 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)cc1C | 10.1021/jm960133o | |||
| CHEMBL118128 | 11727 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 384 | 3 | 1 | 2 | 5.1 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)cc1C | 10.1021/jm960133o | |||
| CHEMBL2370623 | 212350 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00099a019 | |||||
| 10391259 | 18903 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 499 | 5 | 1 | 4 | 3.3 | CNC1CCN([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| CHEMBL128388 | 18903 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 499 | 5 | 1 | 4 | 3.3 | CNC1CCN([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| 10052640 | 21134 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 527 | 6 | 2 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CC1CCCNC1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131239 | 21134 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 527 | 6 | 2 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CC1CCCNC1)C2 | 10.1021/jm00077a002 | |||
| 10483039 | 78528 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 565 | 8 | 2 | 6 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](N)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL2111851 | 78528 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 565 | 8 | 2 | 6 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](N)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| 44433360 | 89483 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 418 | 2 | 0 | 4 | 4.5 | Cc1ccn(-c2ccc(C(=O)N3C=C4CCC(=O)N4Cc4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2007.08.053 | |||
| CHEMBL237120 | 89483 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 418 | 2 | 0 | 4 | 4.5 | Cc1ccn(-c2ccc(C(=O)N3C=C4CCC(=O)N4Cc4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2007.08.053 | |||
| 3793 | 205667 | None | 50 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 45039617 | 205667 | None | 50 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| CHEMBL64391 | 205667 | None | 50 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 88064173 | 151715 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 530 | 7 | 1 | 6 | 5.4 | O=c1n(Cc2nnc(Cc3c(Cl)cccc3Cl)[nH]2)nc(-c2ccc(Cl)cc2)n1CCC(F)(F)F | nan | |||
| CHEMBL3963751 | 151715 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 530 | 7 | 1 | 6 | 5.4 | O=c1n(Cc2nnc(Cc3c(Cl)cccc3Cl)[nH]2)nc(-c2ccc(Cl)cc2)n1CCC(F)(F)F | nan | |||
| 56848556 | 147125 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 579 | 10 | 3 | 7 | 2.9 | O=CNC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| CHEMBL3926829 | 147125 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 579 | 10 | 3 | 7 | 2.9 | O=CNC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| 10838493 | 13919 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 481 | 4 | 1 | 3 | 6.3 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL119638 | 13919 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 481 | 4 | 1 | 3 | 6.3 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 10742994 | 110435 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 470 | 6 | 2 | 4 | 4.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)CC(N)=O)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL324251 | 110435 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 470 | 6 | 2 | 4 | 4.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)CC(N)=O)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 9850567 | 57467 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 551 | 5 | 3 | 4 | 5.9 | O=C(Nc1ccc(C(=O)N2CCCc3c(S(=O)(=O)O)[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL165554 | 57467 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 551 | 5 | 3 | 4 | 5.9 | O=C(Nc1ccc(C(=O)N2CCCc3c(S(=O)(=O)O)[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 21837162 | 102588 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 453 | 4 | 1 | 4 | 5.7 | CSc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL304060 | 102588 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 453 | 4 | 1 | 4 | 5.7 | CSc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 10503021 | 102791 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 435 | 3 | 1 | 3 | 5.6 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)c1C | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL304956 | 102791 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 435 | 3 | 1 | 3 | 5.6 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)c1C | 10.1016/s0960-894x(03)00388-3 | |||
| 10570880 | 26598 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 365 | 2 | 0 | 3 | 4.8 | Cc1ccn(-c2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)n1 | 10.1021/jm000108p | |||
| CHEMBL136109 | 26598 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 365 | 2 | 0 | 3 | 4.8 | Cc1ccn(-c2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)n1 | 10.1021/jm000108p | |||
| 10498917 | 116074 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 362 | 2 | 0 | 2 | 5.0 | CN(C)c1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL335592 | 116074 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 362 | 2 | 0 | 2 | 5.0 | CN(C)c1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 44335343 | 107526 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 519 | 3 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(CC4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1Cl | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL318392 | 107526 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 519 | 3 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(CC4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1Cl | 10.1016/s0960-894x(02)00649-2 | |||
| 14981580 | 78902 | None | 0 | Rat | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 637 | 11 | 3 | 8 | 1.9 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCNCC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| CHEMBL2112895 | 78902 | None | 0 | Rat | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 637 | 11 | 3 | 8 | 1.9 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCNCC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| 19699093 | 120102 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 428 | 3 | 2 | 4 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL350383 | 120102 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 428 | 3 | 2 | 4 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL2112247 | 211693 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2cn(C)c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 9805972 | 98668 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 499 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@@H](N)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL276990 | 98668 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 499 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@@H](N)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 44273346 | 163042 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 570 | 8 | 1 | 6 | 2.8 | CN(C)CCNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL417458 | 163042 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 570 | 8 | 1 | 6 | 2.8 | CN(C)CCNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 44352492 | 18977 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 593 | 9 | 1 | 6 | 3.0 | CN(C)C(CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL128749 | 18977 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 593 | 9 | 1 | 6 | 3.0 | CN(C)C(CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 44352150 | 18872 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 515 | 7 | 2 | 5 | 2.8 | CC(C(N)=O)[C@@H](N)C(=O)[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL128194 | 18872 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 515 | 7 | 2 | 5 | 2.8 | CC(C(N)=O)[C@@H](N)C(=O)[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10413998 | 19055 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 510 | 6 | 2 | 4 | 3.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@H](NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128879 | 19055 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 510 | 6 | 2 | 4 | 3.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@H](NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 44352299 | 116867 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 416 | 3 | 1 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)/C(=N\O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL337842 | 116867 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 416 | 3 | 1 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)/C(=N\O)C2 | 10.1021/jm00077a002 | |||
| 10347314 | 116991 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 542 | 8 | 2 | 4 | 4.9 | CCC(C)(C)C(=O)NCC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL338499 | 116991 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 542 | 8 | 2 | 4 | 4.9 | CCC(C)(C)C(=O)NCC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10459672 | 117555 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 530 | 8 | 1 | 5 | 4.0 | CCOC(=O)CCC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL340016 | 117555 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 530 | 8 | 1 | 5 | 4.0 | CCOC(=O)CCC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10574499 | 113051 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCCC(N(C)C)c4ccccc43)cc2)c1 | 10.1021/jm960133o | |||
| CHEMBL331098 | 113051 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCCC(N(C)C)c4ccccc43)cc2)c1 | 10.1021/jm960133o | |||
| 10524974 | 114124 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 399 | 3 | 1 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCN(C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL332685 | 114124 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 399 | 3 | 1 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCN(C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 10984131 | 120107 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 517 | 4 | 2 | 4 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3ccc(C(=O)O)n3Cc3ccccc32)c(Cl)c1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL350408 | 120107 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 517 | 4 | 2 | 4 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3ccc(C(=O)O)n3Cc3ccccc32)c(Cl)c1 | 10.1016/s0960-894x(00)00095-0 | |||
| 10789117 | 207070 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 437 | 4 | 1 | 4 | 5.0 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| CHEMBL73286 | 207070 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 437 | 4 | 1 | 4 | 5.0 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| 23598595 | 154893 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 542 | 5 | 2 | 3 | 7.0 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL400266 | 154893 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 542 | 5 | 2 | 3 | 7.0 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 21837107 | 206358 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1cc(Cl)ccc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL68948 | 206358 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1cc(Cl)ccc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| 10789117 | 207070 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 437 | 4 | 1 | 4 | 5.0 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL73286 | 207070 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 437 | 4 | 1 | 4 | 5.0 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 44378886 | 56695 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 556 | 6 | 2 | 5 | 6.4 | CN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1O)C2 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL164226 | 56695 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 556 | 6 | 2 | 5 | 6.4 | CN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1O)C2 | 10.1016/s0960-894x(00)00095-0 | |||
| 10601045 | 13966 | None | 0 | Rat | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 487 | 4 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCC(N3CCCCC3)c3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm960133o | |||
| CHEMBL119671 | 13966 | None | 0 | Rat | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 487 | 4 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCC(N3CCCCC3)c3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm960133o | |||
| 19699060 | 56163 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 466 | 3 | 2 | 4 | 5.4 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL162588 | 56163 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 466 | 3 | 2 | 4 | 5.4 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| 10690528 | 113575 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.8 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)cc1 | 10.1021/jm960133o | |||
| CHEMBL332090 | 113575 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.8 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)cc1 | 10.1021/jm960133o | |||
| CHEMBL338294 | 214065 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](CCCCN)NC(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 10347928 | 118530 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 565 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL341289 | 118530 | None | 0 | Rat | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 565 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44352165 | 118618 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 552 | 7 | 3 | 6 | 1.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CS(N)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL341507 | 118618 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 552 | 7 | 3 | 6 | 1.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CS(N)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| 10324995 | 164428 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 539 | 7 | 3 | 4 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)NCCc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL421248 | 164428 | None | 0 | Rat | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 539 | 7 | 3 | 4 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)NCCc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 44352804 | 18966 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL128688 | 18966 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 56848624 | 160861 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 566 | 9 | 3 | 7 | 3.0 | O=C(Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)N[C@@H](CO)Cc1cccc(C(F)(F)F)c1 | nan | |||
| CHEMBL4114132 | 160861 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 566 | 9 | 3 | 7 | 3.0 | O=C(Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)N[C@@H](CO)Cc1cccc(C(F)(F)F)c1 | nan | |||
| 44377903 | 57317 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1Cl)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL165076 | 57317 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1Cl)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 44310163 | 102278 | None | 0 | Rat | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1c(Cl)cccc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL302955 | 102278 | None | 0 | Rat | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1c(Cl)cccc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| 11757222 | 108058 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 547 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3C4CCC(C4)N3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL319418 | 108058 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 547 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3C4CCC(C4)N3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 10043741 | 118245 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm020133q | |||
| CHEMBL340893 | 118245 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm020133q | |||
| 10043741 | 118245 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| CHEMBL340893 | 118245 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| 86690916 | 151014 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 549 | 6 | 1 | 8 | 4.9 | O=c1n(Cc2nnc(-c3ccccc3C(F)(F)F)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3957738 | 151014 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 549 | 6 | 1 | 8 | 4.9 | O=c1n(Cc2nnc(-c3ccccc3C(F)(F)F)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10527129 | 13854 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 441 | 4 | 2 | 3 | 4.9 | CC(=O)NC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL119591 | 13854 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 441 | 4 | 2 | 3 | 4.9 | CC(=O)NC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 19699133 | 119995 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 496 | 3 | 1 | 5 | 5.9 | Cn1cc2c(n1)-c1sccc1N(C(=O)c1ccc(NC(=O)c3ccc(Cl)cc3Cl)cc1)CC2 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL349506 | 119995 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 496 | 3 | 1 | 5 | 5.9 | Cn1cc2c(n1)-c1sccc1N(C(=O)c1ccc(NC(=O)c3ccc(Cl)cc3Cl)cc1)CC2 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL340204 | 214091 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2cccc3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](CCCCN)NC(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 44272990 | 99660 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 500 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@H](O)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL283994 | 99660 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 500 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@H](O)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 44352481 | 117085 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 621 | 11 | 1 | 6 | 3.8 | CCN(CC)C(CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL338951 | 117085 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 621 | 11 | 1 | 6 | 3.8 | CCN(CC)C(CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10347928 | 118530 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 565 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL341289 | 118530 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 565 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 22405325 | 133629 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 427 | 4 | 0 | 4 | 5.5 | CN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(-c3cccs3)cc1)C2 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL371055 | 133629 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 427 | 4 | 0 | 4 | 5.5 | CN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(-c3cccs3)cc1)C2 | 10.1016/j.bmcl.2005.08.007 | |||
| 10098755 | 21493 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 538 | 7 | 2 | 4 | 4.5 | CCC(C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C)c1c[nH]cn1 | 10.1021/jm00077a002 | |||
| CHEMBL131581 | 21493 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 538 | 7 | 2 | 4 | 4.5 | CCC(C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C)c1c[nH]cn1 | 10.1021/jm00077a002 | |||
| 9985844 | 116712 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 588 | 6 | 2 | 4 | 4.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1[nH]cnc1Br)C2 | 10.1021/jm00077a002 | |||
| CHEMBL336992 | 116712 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 588 | 6 | 2 | 4 | 4.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1[nH]cnc1Br)C2 | 10.1021/jm00077a002 | |||
| 2812 | 4781 | None | 63 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| CHEMBL104 | 4781 | None | 63 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| 5280343 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.8 | 4.8 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL1520590 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.8 | 4.8 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL50 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.8 | 4.8 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| 5280343 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.8 | 4.8 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL1520590 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.8 | 4.8 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL50 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.8 | 4.8 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| 2812 | 4781 | None | 63 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| CHEMBL104 | 4781 | None | 63 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| 44332208 | 4246 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 504 | 3 | 1 | 2 | 7.6 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1c(Cl)cccc1Cl | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL100447 | 4246 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 504 | 3 | 1 | 2 | 7.6 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1c(Cl)cccc1Cl | 10.1016/j.bmcl.2004.02.103 | |||
| 44352768 | 115320 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL334777 | 115320 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 536 | 7 | 2 | 4 | 7.0 | O=C(O)CC[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44336784 | 109264 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 626 | 9 | 2 | 4 | 7.0 | CN(C)CCCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL321656 | 109264 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 626 | 9 | 2 | 4 | 7.0 | CN(C)CCCNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 56849411 | 153267 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 609 | 10 | 3 | 8 | 3.3 | NC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| CHEMBL3976964 | 153267 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 609 | 10 | 3 | 8 | 3.3 | NC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| 10528416 | 104785 | None | 0 | Rat | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 471 | 4 | 1 | 4 | 5.6 | COc1cc(Cl)ccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| CHEMBL310581 | 104785 | None | 0 | Rat | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 471 | 4 | 1 | 4 | 5.6 | COc1cc(Cl)ccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| 10691737 | 27195 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 388 | 2 | 0 | 2 | 5.6 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2cc(Cl)ccc21 | 10.1021/jm000108p | |||
| CHEMBL136628 | 27195 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 388 | 2 | 0 | 2 | 5.6 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2cc(Cl)ccc21 | 10.1021/jm000108p | |||
| 18917508 | 188189 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 453 | 4 | 1 | 6 | 4.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL49796 | 188189 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 453 | 4 | 1 | 6 | 4.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1[N+](=O)[O-] | 10.1016/s0960-894x(99)00279-6 | |||
| 14981581 | 78900 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 686 | 11 | 2 | 9 | 1.7 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCS(=O)(=O)CC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| CHEMBL2112893 | 78900 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 686 | 11 | 2 | 9 | 1.7 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCS(=O)(=O)CC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| 10763869 | 11879 | None | 1 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 406 | 4 | 1 | 3 | 4.5 | O=C(c1ccc(NS(=O)(=O)c2ccccc2)cc1)N1CCCCc2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL118244 | 11879 | None | 1 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 406 | 4 | 1 | 3 | 4.5 | O=C(c1ccc(NS(=O)(=O)c2ccccc2)cc1)N1CCCCc2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL338308 | 214067 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](CCCN)NC(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00099a019 | |||||
| 44352141 | 21457 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 501 | 7 | 2 | 5 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](C(=O)[C@H](N)CC(N)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131538 | 21457 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 501 | 7 | 2 | 5 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](C(=O)[C@H](N)CC(N)=O)C2 | 10.1021/jm00077a002 | |||
| 10323684 | 117109 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 499 | 4 | 1 | 5 | 2.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339096 | 117109 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 499 | 4 | 1 | 5 | 2.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44273080 | 98672 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 571 | 7 | 1 | 7 | 2.4 | COC(=O)CNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL277022 | 98672 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 571 | 7 | 1 | 7 | 2.4 | COC(=O)CNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 10834761 | 114602 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 399 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCN(C)Cc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL333652 | 114602 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 399 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCN(C)Cc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 23505561 | 120055 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 527 | 4 | 1 | 4 | 7.1 | CC(=O)n1cc2c3c(cccc31)N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccc(C)cc3)cc1)CCC2 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL349965 | 120055 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 527 | 4 | 1 | 4 | 7.1 | CC(=O)n1cc2c3c(cccc31)N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccc(C)cc3)cc1)CCC2 | 10.1016/s0960-894x(02)01059-4 | |||
| 67412584 | 150865 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 473 | 6 | 1 | 5 | 5.1 | O=c1n(Cc2ncc(Cc3cccc(C(F)(F)F)c3)[nH]2)nc(-c2ccc(Cl)cc2)n1C1CC1 | nan | |||
| CHEMBL3956553 | 150865 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 473 | 6 | 1 | 5 | 5.1 | O=c1n(Cc2ncc(Cc3cccc(C(F)(F)F)c3)[nH]2)nc(-c2ccc(Cl)cc2)n1C1CC1 | nan | |||
| 10832492 | 114863 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 362 | 3 | 1 | 3 | 4.6 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccsc1 | 10.1021/jm960133o | |||
| CHEMBL334009 | 114863 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 362 | 3 | 1 | 3 | 4.6 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccsc1 | 10.1021/jm960133o | |||
| 44309805 | 206740 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 434 | 3 | 1 | 3 | 6.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Oc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL71283 | 206740 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 434 | 3 | 1 | 3 | 6.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Oc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL405289 | 215014 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | None | None | None | CCCC[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 10100280 | 96871 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 610 | 9 | 0 | 7 | 3.9 | COC(=O)CCN(C(=O)Cc1cn(C)cn1)[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL265073 | 96871 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 610 | 9 | 0 | 7 | 3.9 | COC(=O)CCN(C(=O)Cc1cn(C)cn1)[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10346739 | 117091 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 524 | 5 | 0 | 5 | 3.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(CC#N)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL338984 | 117091 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 524 | 5 | 0 | 5 | 3.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(CC#N)C1=O)C2 | 10.1021/jm00077a002 | |||
| 10368075 | 168554 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 484 | 4 | 0 | 4 | 3.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CCC1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL435019 | 168554 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 484 | 4 | 0 | 4 | 3.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CCC1=O)C2 | 10.1021/jm00077a002 | |||
| 10436379 | 74205 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 510 | 6 | 2 | 4 | 3.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1c[nH]cn1)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL20230 | 74205 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 510 | 6 | 2 | 4 | 3.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1c[nH]cn1)C2 | 10.1016/0960-894X(94)00469-V | |||
| 10413997 | 2224 | None | 5 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 2 | ChEMBL | 510 | 6 | 2 | 4 | 3.6 | O=C(Cc1cnc[nH]1)N[C@H]1C[C@@H]2C([C@]1(CC2)CS(=O)(=O)N1CCC2(CC1)CCc1c2cccc1)(C)C | 10.1021/jm00077a002 | |||
| 2246 | 2224 | None | 5 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 2 | ChEMBL | 510 | 6 | 2 | 4 | 3.6 | O=C(Cc1cnc[nH]1)N[C@H]1C[C@@H]2C([C@]1(CC2)CS(=O)(=O)N1CCC2(CC1)CCc1c2cccc1)(C)C | 10.1021/jm00077a002 | |||
| CHEMBL338522 | 2224 | None | 5 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 2 | ChEMBL | 510 | 6 | 2 | 4 | 3.6 | O=C(Cc1cnc[nH]1)N[C@H]1C[C@@H]2C([C@]1(CC2)CS(=O)(=O)N1CCC2(CC1)CCc1c2cccc1)(C)C | 10.1021/jm00077a002 | |||
| 44336768 | 163447 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 599 | 7 | 3 | 4 | 6.1 | O=C(O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL419183 | 163447 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 599 | 7 | 3 | 4 | 6.1 | O=C(O)CNC(=O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 11740743 | 14113 | None | 0 | Rat | Binding | pIC50 | = | 7.8 | 7.8 | - | 3 | ChEMBL | 384 | 3 | 1 | 2 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL119793 | 14113 | None | 0 | Rat | Binding | pIC50 | = | 7.8 | 7.8 | - | 3 | ChEMBL | 384 | 3 | 1 | 2 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 10495509 | 115191 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 314 | 1 | 1 | 2 | 4.2 | Cc1cc(N)ccc1C(=O)N1CCCCc2cc(Cl)ccc21 | 10.1021/acs.jmedchem.5b00982 | |||
| CHEMBL334376 | 115191 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 314 | 1 | 1 | 2 | 4.2 | Cc1cc(N)ccc1C(=O)N1CCCCc2cc(Cl)ccc21 | 10.1021/acs.jmedchem.5b00982 | |||
| 23598641 | 94330 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 528 | 5 | 2 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=C(CO)CC3)Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL250346 | 94330 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 528 | 5 | 2 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=C(CO)CC3)Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2007.09.059 | |||
| 9974701 | 26670 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 342 | 4 | 1 | 2 | 5.1 | CCCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL136177 | 26670 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 342 | 4 | 1 | 2 | 5.1 | CCCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 10711405 | 119363 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 328 | 2 | 0 | 2 | 4.4 | CN(C)c1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL343935 | 119363 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 328 | 2 | 0 | 2 | 4.4 | CN(C)c1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 10810133 | 113867 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 385 | 3 | 2 | 2 | 5.3 | O=C(Nc1ccccc1)Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL332450 | 113867 | None | 0 | Rat | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 385 | 3 | 2 | 2 | 5.3 | O=C(Nc1ccccc1)Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44377894 | 119955 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 427 | 3 | 2 | 2 | 5.5 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL349062 | 119955 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 427 | 3 | 2 | 2 | 5.5 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 44332209 | 4322 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 470 | 3 | 1 | 2 | 6.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1Cl | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL100893 | 4322 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 470 | 3 | 1 | 2 | 6.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1Cl | 10.1016/j.bmcl.2004.02.103 | |||
| 10587836 | 119489 | None | 3 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 266 | 1 | 1 | 2 | 3.3 | Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/jm000108p | |||
| CHEMBL344848 | 119489 | None | 3 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 266 | 1 | 1 | 2 | 3.3 | Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/jm000108p | |||
| 10524202 | 13767 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 386 | 4 | 1 | 3 | 4.5 | COc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)cc1 | 10.1021/jm960133o | |||
| CHEMBL119534 | 13767 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 386 | 4 | 1 | 3 | 4.5 | COc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)cc1 | 10.1021/jm960133o | |||
| 10258045 | 18876 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 601 | 11 | 4 | 6 | 1.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CCN)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128219 | 18876 | None | 0 | Rat | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 601 | 11 | 4 | 6 | 1.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CCN)C2 | 10.1021/jm00077a002 | |||
| 44352393 | 116929 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 555 | 6 | 3 | 4 | 4.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)NC1CCCCC1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL338177 | 116929 | None | 0 | Rat | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 555 | 6 | 3 | 4 | 4.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)NC1CCCCC1)C2 | 10.1021/jm00077a002 | |||
| 9931699 | 75077 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 415 | 2 | 1 | 5 | 5.0 | Cn1ccc(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL203513 | 75077 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 415 | 2 | 1 | 5 | 5.0 | Cn1ccc(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| 21467152 | 53173 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 478 | 3 | 1 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2CCCCc3sc(Cl)cc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL159831 | 53173 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 478 | 3 | 1 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2CCCCc3sc(Cl)cc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| 15307999 | 101461 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 492 | 3 | 1 | 3 | 7.1 | O=C(Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(99)00278-4 | |||
| CHEMBL297293 | 101461 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 492 | 3 | 1 | 3 | 7.1 | O=C(Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(99)00278-4 | |||
| 11792631 | 115292 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 356 | 4 | 0 | 2 | 5.2 | CCN(CC)c1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL334688 | 115292 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 356 | 4 | 0 | 2 | 5.2 | CCN(CC)c1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 44335357 | 107546 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 517 | 3 | 1 | 3 | 6.4 | Cc1cc(F)cc(C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(CC5)N4Cc4ccccc43)c(Cl)c2)c1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL318530 | 107546 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 517 | 3 | 1 | 3 | 6.4 | Cc1cc(F)cc(C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(CC5)N4Cc4ccccc43)c(Cl)c2)c1 | 10.1016/s0960-894x(02)00649-2 | |||
| 10550481 | 12880 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 428 | 4 | 2 | 4 | 4.6 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3N)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL118878 | 12880 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 428 | 4 | 2 | 4 | 4.6 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3N)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 44377837 | 57551 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 427 | 3 | 2 | 2 | 5.5 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL166265 | 57551 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 427 | 3 | 2 | 2 | 5.5 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 10668163 | 13796 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 390 | 3 | 1 | 2 | 5.2 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccc(Cl)cc1 | 10.1021/jm960133o | |||
| CHEMBL119551 | 13796 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 390 | 3 | 1 | 2 | 5.2 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccc(Cl)cc1 | 10.1021/jm960133o | |||
| 10054982 | 117009 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 645 | 10 | 2 | 6 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)N(CCc1c[nH]cn1)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL338576 | 117009 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 645 | 10 | 2 | 6 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)N(CCc1c[nH]cn1)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| 10054203 | 118109 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 593 | 8 | 0 | 6 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(CCCn3ccnc3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL340388 | 118109 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 593 | 8 | 0 | 6 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(CCCn3ccnc3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL2112654 | 211702 | None | 0 | Rat | Binding | pIC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 69940428 | 149959 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 568 | 8 | 2 | 7 | 5.2 | O=C(O)c1cccc(Cn2c(-c3ccc(Cl)cc3)nn(Cc3nnc(Cc4c(Cl)cccc4Cl)[nH]3)c2=O)c1 | nan | |||
| CHEMBL3949118 | 149959 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 568 | 8 | 2 | 7 | 5.2 | O=C(O)c1cccc(Cn2c(-c3ccc(Cl)cc3)nn(Cc3nnc(Cc4c(Cl)cccc4Cl)[nH]3)c2=O)c1 | nan | |||
| 56848625 | 145281 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 595 | 9 | 3 | 8 | 3.5 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(Cl)c1Cl | nan | |||
| CHEMBL3912406 | 145281 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 595 | 9 | 3 | 8 | 3.5 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(Cl)c1Cl | nan | |||
| 56848623 | 151770 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 561 | 9 | 3 | 8 | 2.9 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| CHEMBL3964135 | 151770 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 561 | 9 | 3 | 8 | 2.9 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| 10673295 | 104952 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 509 | 3 | 1 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL311230 | 104952 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 509 | 3 | 1 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| 10766720 | 105506 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 469 | 4 | 1 | 4 | 5.4 | COc1cc(NC(=O)c2cc(F)ccc2C)ccc1C(=O)N1Cc2cccn2Cc2ccccc21 | 10.1021/jm980179c | |||
| CHEMBL312036 | 105506 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 469 | 4 | 1 | 4 | 5.4 | COc1cc(NC(=O)c2cc(F)ccc2C)ccc1C(=O)N1Cc2cccn2Cc2ccccc21 | 10.1021/jm980179c | |||
| 44378702 | 120155 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 657 | 7 | 1 | 5 | 7.8 | CN(C)C1CCN(Cc2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL350869 | 120155 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 657 | 7 | 1 | 5 | 7.8 | CN(C)C1CCN(Cc2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| 9939024 | 132643 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 622 | 9 | 1 | 6 | 7.1 | CN1CCCN(CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL369832 | 132643 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 622 | 9 | 1 | 6 | 7.1 | CN1CCCN(CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 10503858 | 208015 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 453 | 3 | 1 | 3 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(C)c1 | 10.1021/jm980179c | |||
| CHEMBL81133 | 208015 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 453 | 3 | 1 | 3 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(C)c1 | 10.1021/jm980179c | |||
| 44378703 | 57424 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 697 | 7 | 1 | 5 | 8.7 | O=C(Nc1ccc(C(=O)N2Cc3ccc(CN4CCC(N5CCCCC5)CC4)n3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL165200 | 57424 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 697 | 7 | 1 | 5 | 8.7 | O=C(Nc1ccc(C(=O)N2Cc3ccc(CN4CCC(N5CCCCC5)CC4)n3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00095-0 | |||
| 172997 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| 2238 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL49429 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| DB06666 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(00)00084-6 | |||
| 172997 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| 2238 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| CHEMBL49429 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| DB06666 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1021/jm980179c | |||
| 172997 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(03)00388-3 | |||
| 2238 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL49429 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(03)00388-3 | |||
| DB06666 | 2332 | None | 49 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(03)00388-3 | |||
| 9935001 | 53166 | None | 0 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 483 | 4 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL159823 | 53166 | None | 0 | Rat | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 483 | 4 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 9874047 | 119973 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 631 | 9 | 1 | 5 | 7.3 | CN(C)CCN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1Cl)C2 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL349237 | 119973 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 631 | 9 | 1 | 5 | 7.3 | CN(C)CCN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1Cl)C2 | 10.1016/s0960-894x(00)00095-0 | |||
| 10459252 | 52667 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 517 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL159359 | 52667 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 517 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 44352776 | 21602 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 560 | 7 | 1 | 7 | 6.2 | O=C(Nc1ccc(C(=O)N2CCC(CCn3cnnn3)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL131727 | 21602 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 560 | 7 | 1 | 7 | 6.2 | O=C(Nc1ccc(C(=O)N2CCC(CCn3cnnn3)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44336404 | 111022 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 568 | 7 | 2 | 4 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL326225 | 111022 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 568 | 7 | 2 | 4 | 5.4 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 10838492 | 13469 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 481 | 4 | 1 | 3 | 6.3 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL119318 | 13469 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 481 | 4 | 1 | 3 | 6.3 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 9826033 | 57479 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 471 | 4 | 2 | 2 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL165670 | 57479 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 471 | 4 | 2 | 2 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 11239468 | 130756 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 704 | 10 | 1 | 6 | 8.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1OCCCC(=O)N1CCC(N2CCCCC2)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL368353 | 130756 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 704 | 10 | 1 | 6 | 8.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1OCCCC(=O)N1CCC(N2CCCCC2)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 11167861 | 131417 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 495 | 5 | 1 | 4 | 6.7 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| CHEMBL368791 | 131417 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 495 | 5 | 1 | 4 | 6.7 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| 10578000 | 168605 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 524 | 7 | 1 | 5 | 6.1 | CN(C)CCN1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm030287l | |||
| CHEMBL435331 | 168605 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 524 | 7 | 1 | 5 | 6.1 | CN(C)CCN1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm030287l | |||
| 11386922 | 60460 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 525 | 6 | 1 | 5 | 6.7 | COc1cc(C(=O)N2CCCC(N(C)C)c3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL175212 | 60460 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 525 | 6 | 1 | 5 | 6.7 | COc1cc(C(=O)N2CCCC(N(C)C)c3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 9939929 | 167691 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 664 | 10 | 1 | 6 | 7.4 | CN(C)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL430083 | 167691 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 664 | 10 | 1 | 6 | 7.4 | CN(C)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 10548464 | 15388 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 390 | 3 | 1 | 2 | 5.2 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cccc(Cl)c1 | 10.1021/jm960133o | |||
| CHEMBL121455 | 15388 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 390 | 3 | 1 | 2 | 5.2 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cccc(Cl)c1 | 10.1021/jm960133o | |||
| 10666852 | 113127 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.8 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL331164 | 113127 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.8 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 11270497 | 60459 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 435 | 4 | 2 | 2 | 5.9 | O=C(Nc1ccc(C(=O)N2CCCCc3[nH]ccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| CHEMBL175211 | 60459 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 435 | 4 | 2 | 2 | 5.9 | O=C(Nc1ccc(C(=O)N2CCCCc3[nH]ccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| 11418441 | 169399 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 410 | 3 | 1 | 3 | 5.6 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1)c1ccccc1Cl | 10.1021/jm00137a004 | |||
| CHEMBL441498 | 169399 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 410 | 3 | 1 | 3 | 5.6 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1)c1ccccc1Cl | 10.1021/jm00137a004 | |||
| 11272841 | 60820 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 550 | 7 | 1 | 5 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCN(CCN3CCCC3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL176146 | 60820 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 550 | 7 | 1 | 5 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCN(CCN3CCCC3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL2332717 | 211993 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | None | None | None | NC(=O)CC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CNC(=O)[C@H](CC(N)=O)NC1=O | 10.1016/j.bmcl.2012.12.041 | |||||
| 10156521 | 72500 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 378 | 2 | 0 | 2 | 5.7 | Cc1ccccc1-c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL198931 | 72500 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 378 | 2 | 0 | 2 | 5.7 | Cc1ccccc1-c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/j.bmcl.2005.08.007 | |||
| 10347928 | 118530 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 565 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL341289 | 118530 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 565 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 10052468 | 21129 | None | 0 | Rat | Binding | pIC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)/C=C/c1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131235 | 21129 | None | 0 | Rat | Binding | pIC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)/C=C/c1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 18917500 | 187551 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 423 | 3 | 2 | 5 | 3.9 | Nc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL49392 | 187551 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 423 | 3 | 2 | 5 | 3.9 | Nc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| 10667727 | 11037 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 384 | 3 | 1 | 2 | 5.1 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)c(C)c1 | 10.1021/jm960133o | |||
| CHEMBL117566 | 11037 | None | 0 | Rat | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 384 | 3 | 1 | 2 | 5.1 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)c(C)c1 | 10.1021/jm960133o | |||
| 9935694 | 57402 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 499 | 4 | 1 | 3 | 7.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCc4cn(C)c5cccc3c45)cc2)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL165183 | 57402 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 499 | 4 | 1 | 3 | 7.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCc4cn(C)c5cccc3c45)cc2)cc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 10784361 | 115490 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1)N1CCCCc2cc(Cl)ccc21 | 10.1021/jm000108p | |||
| CHEMBL335040 | 115490 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1)N1CCCCc2cc(Cl)ccc21 | 10.1021/jm000108p | |||
| 10834036 | 13640 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 386 | 4 | 1 | 3 | 4.5 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL119442 | 13640 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 386 | 4 | 1 | 3 | 4.5 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 10458629 | 18970 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 499 | 4 | 1 | 4 | 3.4 | CC1NC(=O)N([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| CHEMBL128712 | 18970 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 499 | 4 | 1 | 4 | 3.4 | CC1NC(=O)N([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| 10029477 | 20718 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 514 | 5 | 2 | 5 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CN)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL130905 | 20718 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 514 | 5 | 2 | 5 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CN)C1=O)C2 | 10.1021/jm00077a002 | |||
| 10051081 | 116967 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 485 | 4 | 1 | 4 | 3.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CNC1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL338383 | 116967 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 485 | 4 | 1 | 4 | 3.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CNC1=O)C2 | 10.1021/jm00077a002 | |||
| 10256281 | 18911 | None | 0 | Rat | Binding | pIC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 524 | 7 | 2 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CCc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128422 | 18911 | None | 0 | Rat | Binding | pIC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 524 | 7 | 2 | 4 | 4.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CCc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 56848626 | 143805 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 557 | 9 | 2 | 7 | 4.2 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(Cc2ccccc2F)c1=O)c1ccccc1Cl | nan | |||
| CHEMBL3900528 | 143805 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 557 | 9 | 2 | 7 | 4.2 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(Cc2ccccc2F)c1=O)c1ccccc1Cl | nan | |||
| 10766187 | 12859 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 455 | 6 | 1 | 3 | 6.1 | CCCN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL118863 | 12859 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 455 | 6 | 1 | 3 | 6.1 | CCCN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 11798757 | 206746 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1C(F)(F)F | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL71305 | 206746 | None | 0 | Rat | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1C(F)(F)F | 10.1016/s0960-894x(03)00388-3 | |||
| 10737018 | 30639 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 356 | 5 | 1 | 2 | 5.5 | CCCCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL139415 | 30639 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 356 | 5 | 1 | 2 | 5.5 | CCCCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 44374839 | 120233 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 442 | 3 | 1 | 5 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3cn(C)nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL351587 | 120233 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 442 | 3 | 1 | 5 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3cn(C)nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 44352373 | 22327 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 543 | 8 | 3 | 5 | 3.4 | CC(C)C[C@H](N)C(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL132389 | 22327 | None | 0 | Rat | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 543 | 8 | 3 | 5 | 3.4 | CC(C)C[C@H](N)C(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 8105663 | 13434 | None | 2 | Rat | Binding | pIC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 356 | 3 | 1 | 2 | 4.5 | O=C(Nc1ccccc1C(=O)N1CCCc2ccccc21)c1ccccc1 | 10.1021/jm960133o | |||
| CHEMBL119291 | 13434 | None | 2 | Rat | Binding | pIC50 | = | 4.7 | 4.7 | - | 0 | ChEMBL | 356 | 3 | 1 | 2 | 4.5 | O=C(Nc1ccccc1C(=O)N1CCCc2ccccc21)c1ccccc1 | 10.1021/jm960133o | |||
| 44336379 | 107473 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 582 | 8 | 2 | 4 | 5.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL318083 | 107473 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 582 | 8 | 2 | 4 | 5.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCCN(C)C)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 86690920 | 145630 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 548 | 6 | 1 | 7 | 5.5 | O=c1n(Cc2cnc(-c3ccccc3C(F)(F)F)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3915055 | 145630 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 548 | 6 | 1 | 7 | 5.5 | O=c1n(Cc2cnc(-c3ccccc3C(F)(F)F)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 69940395 | 149166 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 514 | 6 | 1 | 7 | 5.1 | O=c1n(Cc2ncc(-c3ccccc3Cl)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3943019 | 149166 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 514 | 6 | 1 | 7 | 5.1 | O=c1n(Cc2ncc(-c3ccccc3Cl)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 87388676 | 151955 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 533 | 6 | 1 | 8 | 4.4 | O=c1n(Cc2nc(-c3ccccc3C(F)(F)F)no2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3965602 | 151955 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 533 | 6 | 1 | 8 | 4.4 | O=c1n(Cc2nc(-c3ccccc3C(F)(F)F)no2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 2173 | 2956 | None | 18 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| 3038506 | 2956 | None | 18 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| CHEMBL332447 | 2956 | None | 18 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| DB05838 | 2956 | None | 18 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| 19699114 | 53392 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 434 | 3 | 1 | 5 | 4.9 | Cn1cc2c(n1)-c1sccc1N(C(=O)c1ccc(NC(=O)C3CCCCC3)cc1)CC2 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL160029 | 53392 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 434 | 3 | 1 | 5 | 4.9 | Cn1cc2c(n1)-c1sccc1N(C(=O)c1ccc(NC(=O)C3CCCCC3)cc1)CC2 | 10.1016/s0960-894x(00)00084-6 | |||
| 14981577 | 78908 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 636 | 11 | 2 | 7 | 3.5 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCCCC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| CHEMBL2112900 | 78908 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 636 | 11 | 2 | 7 | 3.5 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCCCC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| 2241 | 2218 | None | 2 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | -208 | 4 | ChEMBL | None | None | None | None | 10.1021/jm00099a019 | |||||
| 9810632 | 2218 | None | 2 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | -208 | 4 | ChEMBL | None | None | None | None | 10.1021/jm00099a019 | |||||
| CHEMBL127686 | 2218 | None | 2 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | -208 | 4 | ChEMBL | None | None | None | None | 10.1021/jm00099a019 | |||||
| 44273425 | 98957 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 557 | 7 | 2 | 6 | 2.6 | C[C@@H](O)CNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL279281 | 98957 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 557 | 7 | 2 | 6 | 2.6 | C[C@@H](O)CNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 44273369 | 99598 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 500 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@@H](O)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL283524 | 99598 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 500 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@@H](O)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 10007685 | 98653 | None | 0 | Rat | Binding | pIC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 548 | 7 | 2 | 4 | 4.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)c1ccccc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL276906 | 98653 | None | 0 | Rat | Binding | pIC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 548 | 7 | 2 | 4 | 4.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)c1ccccc1)C2 | 10.1021/jm00077a002 | |||
| 44374839 | 120233 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 442 | 3 | 1 | 5 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3cn(C)nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL351587 | 120233 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 442 | 3 | 1 | 5 | 4.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3cn(C)nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 10716676 | 110474 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 413 | 4 | 2 | 3 | 4.9 | CNC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL324488 | 110474 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 413 | 4 | 2 | 3 | 4.9 | CNC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 44293784 | 188003 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 444 | 3 | 1 | 4 | 4.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(F)ccc1F | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL49657 | 188003 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 444 | 3 | 1 | 4 | 4.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(F)ccc1F | 10.1016/s0960-894x(99)00279-6 | |||
| 71450903 | 78909 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 614 | 12 | 3 | 9 | 0.8 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)N(CO)CO)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| CHEMBL2112901 | 78909 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 614 | 12 | 3 | 9 | 0.8 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)N(CO)CO)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| 71449109 | 78910 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 565 | 8 | 2 | 6 | 2.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCS(C)(=O)=O)C2 | 10.1021/jm00031a004 | |||
| CHEMBL2112902 | 78910 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 565 | 8 | 2 | 6 | 2.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCS(C)(=O)=O)C2 | 10.1021/jm00031a004 | |||
| 10257352 | 78813 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 565 | 8 | 2 | 6 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL2112666 | 78813 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 565 | 8 | 2 | 6 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| 10326385 | 155776 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 609 | 7 | 2 | 8 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(CC(=O)Nc3nn[nH]n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL405016 | 155776 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 609 | 7 | 2 | 8 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(CC(=O)Nc3nn[nH]n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 2168 | 3976 | None | 29 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -15 | 9 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2012.12.041 | |||||
| 2810 | 3976 | None | 29 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -15 | 9 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2012.12.041 | |||||
| 644077 | 3976 | None | 29 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -15 | 9 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2012.12.041 | |||||
| 644077.0 | 3976 | None | 29 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -15 | 9 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2012.12.041 | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -15 | 9 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2012.12.041 | |||||
| DB00067 | 3976 | None | 29 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -15 | 9 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2012.12.041 | |||||
| 10647295 | 110330 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 452 | 5 | 1 | 4 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)CC#N)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL323802 | 110330 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 452 | 5 | 1 | 4 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)CC#N)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44212554 | 103730 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 432 | 3 | 1 | 2 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3ccccc3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL308741 | 103730 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 432 | 3 | 1 | 2 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3ccccc3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 10622282 | 13171 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 424 | 3 | 1 | 2 | 5.8 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1021/jm960133o | |||
| CHEMBL119087 | 13171 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 424 | 3 | 1 | 2 | 5.8 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1021/jm960133o | |||
| 22405331 | 135409 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 400 | 2 | 0 | 2 | 5.6 | O=C(c1ccc(-c2cc(F)cc(F)c2)cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL372766 | 135409 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 400 | 2 | 0 | 2 | 5.6 | O=C(c1ccc(-c2cc(F)cc(F)c2)cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| 44273473 | 72809 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 542 | 5 | 0 | 6 | 3.2 | CC(=O)OC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL20002 | 72809 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 542 | 5 | 0 | 6 | 3.2 | CC(=O)OC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 10392579 | 116759 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 542 | 6 | 1 | 5 | 3.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(CC(=O)O)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL337221 | 116759 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 542 | 6 | 1 | 5 | 3.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(CC(=O)O)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44352455 | 168733 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 701 | 12 | 4 | 8 | 1.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C(CCS(C)(=O)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL436189 | 168733 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 701 | 12 | 4 | 8 | 1.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C(CCS(C)(=O)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 2812 | 4781 | None | 63 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| CHEMBL104 | 4781 | None | 63 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| 44335386 | 108066 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | 14 | 2 | ChEMBL | 489 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1F | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL319433 | 108066 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | 14 | 2 | ChEMBL | 489 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1F | 10.1016/s0960-894x(02)00649-2 | |||
| 44352171 | 20823 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 565 | 7 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)C1=CCC(=O)N=C1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL130993 | 20823 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 565 | 7 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)C1=CCC(=O)N=C1)C2 | 10.1021/jm00077a002 | |||
| 10366192 | 116756 | None | 0 | Rat | Binding | pIC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 444 | 4 | 1 | 3 | 3.6 | CC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL337212 | 116756 | None | 0 | Rat | Binding | pIC50 | = | 4.6 | 4.6 | - | 0 | ChEMBL | 444 | 4 | 1 | 3 | 3.6 | CC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 53378951 | 144868 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 507 | 6 | 1 | 5 | 5.7 | O=c1n(Cc2cccc(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1CC(O)C(F)(F)F | nan | |||
| CHEMBL3909196 | 144868 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 507 | 6 | 1 | 5 | 5.7 | O=c1n(Cc2cccc(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1CC(O)C(F)(F)F | nan | |||
| 10837161 | 11924 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 447 | 4 | 1 | 3 | 5.6 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL118270 | 11924 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 447 | 4 | 1 | 3 | 5.6 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 10716675 | 114979 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 413 | 4 | 1 | 3 | 5.0 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL334225 | 114979 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 413 | 4 | 1 | 3 | 5.0 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 14981578 | 78904 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 638 | 11 | 2 | 8 | 2.3 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCOCC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| CHEMBL2112897 | 78904 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 638 | 11 | 2 | 8 | 2.3 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)NC2CCOCC2)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| 10074681 | 117117 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 499 | 4 | 0 | 4 | 3.4 | CN1CC(=O)N([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| CHEMBL339132 | 117117 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 499 | 4 | 0 | 4 | 3.4 | CN1CC(=O)N([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| 2812 | 4781 | None | 63 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| CHEMBL104 | 4781 | None | 63 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 34 | ChEMBL | 344 | 4 | 0 | 2 | 5.4 | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1 | 10.1021/jm301749y | |||
| 44332207 | 107318 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 504 | 3 | 1 | 2 | 7.6 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL316958 | 107318 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 504 | 3 | 1 | 2 | 7.6 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2004.02.103 | |||
| 53378730 | 153032 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 548 | 7 | 1 | 7 | 5.4 | O=c1n(Cc2nnc(Cc3ccccc3C(F)(F)F)[nH]2)nc(-c2ccc(Cl)s2)n1Cc1ccccc1F | nan | |||
| CHEMBL3975038 | 153032 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 548 | 7 | 1 | 7 | 5.4 | O=c1n(Cc2nnc(Cc3ccccc3C(F)(F)F)[nH]2)nc(-c2ccc(Cl)s2)n1Cc1ccccc1F | nan | |||
| 10692266 | 14135 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 398 | 3 | 1 | 2 | 5.6 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL119806 | 14135 | None | 0 | Rat | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 398 | 3 | 1 | 2 | 5.6 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44335356 | 5227 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | 5 | 2 | ChEMBL | 385 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCNc3ccccc32)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL106229 | 5227 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | 5 | 2 | ChEMBL | 385 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCNc3ccccc32)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 44352185 | 21412 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 673 | 11 | 3 | 7 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131477 | 21412 | None | 0 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 673 | 11 | 3 | 7 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 44272997 | 71745 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 499 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@H](N)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL19658 | 71745 | None | 0 | Rat | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 499 | 4 | 1 | 5 | 2.6 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@H](N)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 10715974 | 11926 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 2 | ChEMBL | 400 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL118271 | 11926 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 2 | ChEMBL | 400 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 10835094 | 12090 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 404 | 3 | 1 | 2 | 5.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm960133o | |||
| CHEMBL118387 | 12090 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 404 | 3 | 1 | 2 | 5.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm960133o | |||
| 10598596 | 12946 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 427 | 5 | 2 | 3 | 5.3 | CCNC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL118922 | 12946 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 427 | 5 | 2 | 3 | 5.3 | CCNC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 10743970 | 113128 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 499 | 7 | 1 | 5 | 5.2 | CCOC(=O)CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL331173 | 113128 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 499 | 7 | 1 | 5 | 5.2 | CCOC(=O)CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 22099567 | 101394 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 457 | 3 | 1 | 4 | 5.6 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00278-4 | |||
| CHEMBL296814 | 101394 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 457 | 3 | 1 | 4 | 5.6 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00278-4 | |||
| 23598560 | 4452 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 512 | 4 | 1 | 2 | 7.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL101678 | 4452 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 512 | 4 | 1 | 2 | 7.9 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.02.103 | |||
| 44309960 | 206739 | None | 1 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1cccc(Cl)c1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL71282 | 206739 | None | 1 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1cccc(Cl)c1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| 15307971 | 207015 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 418 | 3 | 1 | 2 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL72945 | 207015 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 418 | 3 | 1 | 2 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 18917519 | 187453 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 525 | 7 | 0 | 5 | 5.1 | Cc1ccc(F)cc1C(=O)N(CCCN(C)C)c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL49323 | 187453 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 525 | 7 | 0 | 5 | 5.1 | Cc1ccc(F)cc1C(=O)N(CCCN(C)C)c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| 14981575 | 78903 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 582 | 10 | 1 | 7 | 2.1 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)N(C)C)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| CHEMBL2112896 | 78903 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 582 | 10 | 1 | 7 | 2.1 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@H](CCS(C)(=O)=O)N(C)C)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| 10483940 | 117338 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 616 | 9 | 2 | 6 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)c1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339497 | 117338 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 616 | 9 | 2 | 6 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)c1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 9868852 | 75319 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 459 | 2 | 1 | 5 | 5.2 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(Br)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL203739 | 75319 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 459 | 2 | 1 | 5 | 5.2 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(Br)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| 56848622 | 148028 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 595 | 9 | 3 | 8 | 3.3 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| CHEMBL3933782 | 148028 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 595 | 9 | 3 | 8 | 3.3 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| 44293763 | 101563 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 422 | 3 | 1 | 4 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL297990 | 101563 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 422 | 3 | 1 | 4 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| 9826254 | 163404 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL418890 | 163404 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| 11763684 | 131425 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 650 | 9 | 1 | 6 | 7.0 | CN1CCCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL368818 | 131425 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 650 | 9 | 1 | 6 | 7.0 | CN1CCCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 9939929 | 167691 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 664 | 10 | 1 | 6 | 7.4 | CN(C)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL430083 | 167691 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 664 | 10 | 1 | 6 | 7.4 | CN(C)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 9826254 | 163404 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL418890 | 163404 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| 9826254 | 163404 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL418890 | 163404 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| 44374781 | 53197 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 486 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sc(Cl)cc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL159856 | 53197 | None | 0 | Rat | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 486 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sc(Cl)cc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 9826254 | 163404 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL418890 | 163404 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| 9826254 | 163404 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL418890 | 163404 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 475 | 3 | 1 | 3 | 6.3 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(Cl)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| 69940338 | 150717 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 497 | 6 | 1 | 7 | 4.2 | O=c1n(Cc2cn(-c3ccccc3Cl)cn2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3955416 | 150717 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 497 | 6 | 1 | 7 | 4.2 | O=c1n(Cc2cn(-c3ccccc3Cl)cn2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 2168 | 3976 | None | 29 | Pig | Binding | pIC50 | = | 8.5 | 8.5 | - | 9 | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00050-4 | |||||
| 2810 | 3976 | None | 29 | Pig | Binding | pIC50 | = | 8.5 | 8.5 | - | 9 | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00050-4 | |||||
| 644077 | 3976 | None | 29 | Pig | Binding | pIC50 | = | 8.5 | 8.5 | - | 9 | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00050-4 | |||||
| 644077.0 | 3976 | None | 29 | Pig | Binding | pIC50 | = | 8.5 | 8.5 | - | 9 | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00050-4 | |||||
| CHEMBL373742 | 3976 | None | 29 | Pig | Binding | pIC50 | = | 8.5 | 8.5 | - | 9 | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00050-4 | |||||
| DB00067 | 3976 | None | 29 | Pig | Binding | pIC50 | = | 8.5 | 8.5 | - | 9 | ChEMBL | None | None | None | None | 10.1016/S0960-894X(97)00050-4 | |||||
| 44374802 | 120067 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 442 | 3 | 1 | 3 | 6.1 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCCCc3sccc32)c(Cl)c1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL350089 | 120067 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 442 | 3 | 1 | 3 | 6.1 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCCCc3sccc32)c(Cl)c1 | 10.1016/s0960-894x(00)00084-6 | |||
| 20825285 | 109253 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 595 | 4 | 1 | 3 | 8.2 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(C5)N4Cc4cc(Cl)ccc43)c(Cl)c2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL321561 | 109253 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 595 | 4 | 1 | 3 | 8.2 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(C5)N4Cc4cc(Cl)ccc43)c(Cl)c2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 10578460 | 60451 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 544 | 6 | 1 | 5 | 7.1 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3cccnc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL175182 | 60451 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 544 | 6 | 1 | 5 | 7.1 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3cccnc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 11190868 | 60581 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 482 | 5 | 1 | 4 | 6.7 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CCCCc2sccc21 | 10.1021/jm00137a004 | |||
| CHEMBL175930 | 60581 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 482 | 5 | 1 | 4 | 6.7 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CCCCc2sccc21 | 10.1021/jm00137a004 | |||
| 11190868 | 60581 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 482 | 5 | 1 | 4 | 6.7 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CCCCc2sccc21 | 10.1021/jm00137a004 | |||
| CHEMBL175930 | 60581 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 482 | 5 | 1 | 4 | 6.7 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CCCCc2sccc21 | 10.1021/jm00137a004 | |||
| 11239468 | 130756 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 704 | 10 | 1 | 6 | 8.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1OCCCC(=O)N1CCC(N2CCCCC2)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL368353 | 130756 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 704 | 10 | 1 | 6 | 8.3 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1OCCCC(=O)N1CCC(N2CCCCC2)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 11167861 | 131417 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 495 | 5 | 1 | 4 | 6.7 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| CHEMBL368791 | 131417 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 495 | 5 | 1 | 4 | 6.7 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| 56848686 | 144626 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 653 | 9 | 2 | 8 | 6.0 | CC(C)(C)OC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)s2)n(Cc2ccccc2F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| CHEMBL3907257 | 144626 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 653 | 9 | 2 | 8 | 6.0 | CC(C)(C)OC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)s2)n(Cc2ccccc2F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| 10762739 | 114447 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 386 | 3 | 1 | 3 | 4.4 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCOCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL333135 | 114447 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 386 | 3 | 1 | 3 | 4.4 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCOCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44404614 | 165845 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 378 | 2 | 0 | 2 | 5.7 | Cc1ccc(-c2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)cc1 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL424663 | 165845 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 378 | 2 | 0 | 2 | 5.7 | Cc1ccc(-c2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)cc1 | 10.1016/j.bmcl.2005.08.007 | |||
| 119369 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| 2197 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| 4004 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| CHEMBL420762 | 2606 | None | 50 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | -1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| 11476070 | 60491 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 436 | 4 | 1 | 3 | 6.2 | O=C(Nc1ccc(C(=O)N2CCCCc3occc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| CHEMBL175411 | 60491 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 436 | 4 | 1 | 3 | 6.2 | O=C(Nc1ccc(C(=O)N2CCCCc3occc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| 44273426 | 77135 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 557 | 7 | 2 | 6 | 2.6 | C[C@H](CO)NC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL20757 | 77135 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 557 | 7 | 2 | 6 | 2.6 | C[C@H](CO)NC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 44352311 | 18959 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 638 | 11 | 4 | 6 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128652 | 18959 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 638 | 11 | 4 | 6 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| 44352372 | 20649 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 558 | 9 | 4 | 6 | 1.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)[C@@H](N)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL130848 | 20649 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 558 | 9 | 4 | 6 | 1.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)[C@@H](N)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| 10460052 | 22127 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 544 | 8 | 2 | 5 | 2.3 | CN(C)CC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL132211 | 22127 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 544 | 8 | 2 | 5 | 2.3 | CN(C)CC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 71449094 | 78810 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 581 | 8 | 3 | 7 | 1.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@](O)(CNC(=O)C(N)CS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL2112663 | 78810 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 581 | 8 | 3 | 7 | 1.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@](O)(CNC(=O)C(N)CS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| 10392298 | 116877 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 532 | 8 | 2 | 6 | 2.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CC[N+](=O)[O-])C2 | 10.1021/jm00077a002 | |||
| CHEMBL337888 | 116877 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 532 | 8 | 2 | 6 | 2.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CC[N+](=O)[O-])C2 | 10.1021/jm00077a002 | |||
| 9982888 | 168553 | None | 0 | Rat | Binding | pIC50 | = | 4.5 | 4.5 | - | 0 | ChEMBL | 486 | 6 | 2 | 4 | 3.5 | CC(=O)NCC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL435009 | 168553 | None | 0 | Rat | Binding | pIC50 | = | 4.5 | 4.5 | - | 0 | ChEMBL | 486 | 6 | 2 | 4 | 3.5 | CC(=O)NCC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 44273259 | 73545 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 557 | 7 | 1 | 6 | 2.5 | CN(CCO)C1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL20171 | 73545 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 557 | 7 | 1 | 6 | 2.5 | CN(CCO)C1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 11793558 | 28396 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 370 | 6 | 1 | 2 | 5.9 | CCCCCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL137500 | 28396 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 370 | 6 | 1 | 2 | 5.9 | CCCCCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 14981576 | 78901 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 610 | 12 | 1 | 7 | 2.9 | CCN(CC)[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1CC2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1021/jm00031a004 | |||
| CHEMBL2112894 | 78901 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 610 | 12 | 1 | 7 | 2.9 | CCN(CC)[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1CC2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1021/jm00031a004 | |||
| 21467167 | 60554 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 452 | 4 | 1 | 3 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| CHEMBL175813 | 60554 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 452 | 4 | 1 | 3 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| CHEMBL1790937 | 211365 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 2 | ChEMBL | None | None | None | CC[C@@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 67412781 | 154361 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 499 | 6 | 1 | 8 | 4.0 | O=c1n(Cc2nnc(-c3ccccc3Cl)o2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3986461 | 154361 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 499 | 6 | 1 | 8 | 4.0 | O=c1n(Cc2nnc(-c3ccccc3Cl)o2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10692311 | 164133 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 399 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL420880 | 164133 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 399 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 10591515 | 118947 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 316 | 2 | 0 | 2 | 4.5 | O=C(c1ccc(-n2cccc2)cc1)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| CHEMBL342251 | 118947 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 316 | 2 | 0 | 2 | 4.5 | O=C(c1ccc(-n2cccc2)cc1)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| 44352164 | 18901 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 541 | 4 | 1 | 5 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C3CC(O)CN3C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128383 | 18901 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 541 | 4 | 1 | 5 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C3CC(O)CN3C1=O)C2 | 10.1021/jm00077a002 | |||
| 18917554 | 189930 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 497 | 5 | 1 | 5 | 4.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3ccc(CN(C)C)n3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL51645 | 189930 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 497 | 5 | 1 | 5 | 4.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3ccc(CN(C)C)n3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| 21837085 | 102311 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 421 | 3 | 1 | 3 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3cccn3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL303176 | 102311 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 421 | 3 | 1 | 3 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCc3cccn3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 2173 | 2956 | None | 18 | Human | Binding | pIC50 | = | 6.5 | 6.5 | 8 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| 3038506 | 2956 | None | 18 | Human | Binding | pIC50 | = | 6.5 | 6.5 | 8 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| CHEMBL332447 | 2956 | None | 18 | Human | Binding | pIC50 | = | 6.5 | 6.5 | 8 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| DB05838 | 2956 | None | 18 | Human | Binding | pIC50 | = | 6.5 | 6.5 | 8 | 2 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C | 10.1021/jm020133q | |||
| CHEMBL126765 | 211127 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](CCCN)NC(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00099a019 | |||||
| 10483940 | 117338 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 616 | 9 | 2 | 6 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)c1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339497 | 117338 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 616 | 9 | 2 | 6 | 3.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(CCS(C)(=O)=O)c1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 44433367 | 89881 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 489 | 3 | 1 | 3 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CC3C=CC(=O)N3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| CHEMBL237772 | 89881 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 489 | 3 | 1 | 3 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CC3C=CC(=O)N3Cc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2007.08.053 | |||
| 11157078 | 94248 | None | 8 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249741 | 94248 | None | 8 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 10758700 | 24870 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 328 | 3 | 1 | 2 | 4.8 | CCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL134525 | 24870 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 328 | 3 | 1 | 2 | 4.8 | CCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 19699060 | 56163 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 466 | 3 | 2 | 4 | 5.4 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL162588 | 56163 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 466 | 3 | 2 | 4 | 5.4 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(00)00084-6 | |||
| 44352442 | 163558 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 567 | 8 | 2 | 5 | 3.5 | CN(C)[C@H](Cc1c[nH]cn1)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL419973 | 163558 | None | 0 | Rat | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 567 | 8 | 2 | 5 | 3.5 | CN(C)[C@H](Cc1c[nH]cn1)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 9937535 | 63058 | None | 1 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 554 | 7 | 2 | 4 | 5.1 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3F)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL1788221 | 63058 | None | 1 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 554 | 7 | 2 | 4 | 5.1 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3F)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 21837086 | 169553 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 425 | 3 | 1 | 3 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1F | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL442743 | 169553 | None | 0 | Rat | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 425 | 3 | 1 | 3 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1F | 10.1016/s0960-894x(03)00388-3 | |||
| 10519373 | 116738 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 314 | 2 | 1 | 2 | 4.4 | CNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL337098 | 116738 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 314 | 2 | 1 | 2 | 4.4 | CNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 14981574 | 78905 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 568 | 10 | 2 | 7 | 1.8 | CN[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1CC2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1021/jm00031a004 | |||
| CHEMBL2112898 | 78905 | None | 0 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 568 | 10 | 2 | 7 | 1.8 | CN[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1CC2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1021/jm00031a004 | |||
| 10483105 | 90714 | None | 1 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 4 | ChEMBL | 568 | 10 | 2 | 7 | 1.8 | CN[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1016/j.bmcl.2012.10.116 | |||
| CHEMBL2391300 | 90714 | None | 1 | Rat | Binding | pIC50 | = | 6.5 | 6.5 | - | 4 | ChEMBL | 568 | 10 | 2 | 7 | 1.8 | CN[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1016/j.bmcl.2012.10.116 | |||
| 56848687 | 150569 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 581 | 11 | 2 | 9 | 2.5 | COCCn1c(-c2ccc(Cl)s2)nn(CC(=O)NCC(NS(C)(=O)=O)c2ccccc2C(F)(F)F)c1=O | nan | |||
| CHEMBL3954357 | 150569 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 581 | 11 | 2 | 9 | 2.5 | COCCn1c(-c2ccc(Cl)s2)nn(CC(=O)NCC(NS(C)(=O)=O)c2ccccc2C(F)(F)F)c1=O | nan | |||
| 19699076 | 120270 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 500 | 3 | 2 | 4 | 6.0 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)c(Cl)c1)c1cc(Cl)ccc1F | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL351970 | 120270 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 500 | 3 | 2 | 4 | 6.0 | O=C(Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)c(Cl)c1)c1cc(Cl)ccc1F | 10.1016/s0960-894x(00)00084-6 | |||
| 44352441 | 20697 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 535 | 6 | 2 | 5 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1ccccn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL130887 | 20697 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 535 | 6 | 2 | 5 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1ccccn1)C2 | 10.1021/jm00077a002 | |||
| 5280343 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.4 | 4.4 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL1520590 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.4 | 4.4 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL50 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.4 | 4.4 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| 19699133 | 119995 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 496 | 3 | 1 | 5 | 5.9 | Cn1cc2c(n1)-c1sccc1N(C(=O)c1ccc(NC(=O)c3ccc(Cl)cc3Cl)cc1)CC2 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL349506 | 119995 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 496 | 3 | 1 | 5 | 5.9 | Cn1cc2c(n1)-c1sccc1N(C(=O)c1ccc(NC(=O)c3ccc(Cl)cc3Cl)cc1)CC2 | 10.1016/s0960-894x(00)00084-6 | |||
| 44357890 | 168496 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 462 | 5 | 1 | 3 | 6.0 | Cc1ccccc1OCC(=O)Nc1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(C)c1 | 10.1021/jm000108p | |||
| CHEMBL434654 | 168496 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 462 | 5 | 1 | 3 | 6.0 | Cc1ccccc1OCC(=O)Nc1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(C)c1 | 10.1021/jm000108p | |||
| 44332272 | 107295 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 450 | 3 | 1 | 2 | 6.6 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCC4(C=CCCC4)Cc4ccccc43)cc2)c1 | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL316849 | 107295 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 450 | 3 | 1 | 2 | 6.6 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCC4(C=CCCC4)Cc4ccccc43)cc2)c1 | 10.1016/j.bmcl.2004.02.103 | |||
| 11351397 | 61027 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 449 | 4 | 1 | 3 | 5.9 | Cn1ccc2c1CCCCN2C(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2)cc1 | 10.1021/jm00137a004 | |||
| CHEMBL176264 | 61027 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 449 | 4 | 1 | 3 | 5.9 | Cn1ccc2c1CCCCN2C(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2)cc1 | 10.1021/jm00137a004 | |||
| CHEMBL339118 | 214076 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | -19 | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 44352496 | 19568 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 538 | 4 | 1 | 5 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C3CCC(=N)N3C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL129983 | 19568 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 538 | 4 | 1 | 5 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C3CCC(=N)N3C1=O)C2 | 10.1021/jm00077a002 | |||
| 23598598 | 4969 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL104839 | 4969 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 23598600 | 5369 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 594 | 7 | 2 | 4 | 5.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL106938 | 5369 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 594 | 7 | 2 | 4 | 5.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 11070458 | 17794 | None | 2 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(C)NC(=O)C[C@@H]1CCCN(C(=O)c2ccc(N3CCCC3)cc2Cl)c2ccccc21 | 10.1021/jm020133q | |||
| CHEMBL125878 | 17794 | None | 2 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(C)NC(=O)C[C@@H]1CCCN(C(=O)c2ccc(N3CCCC3)cc2Cl)c2ccccc21 | 10.1021/jm020133q | |||
| 9801970 | 140807 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 415 | 2 | 1 | 5 | 5.1 | Cc1ccnn1-c1ccc(C(=O)N2Cc3cccnc3Nc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL381763 | 140807 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 415 | 2 | 1 | 5 | 5.1 | Cc1ccnn1-c1ccc(C(=O)N2Cc3cccnc3Nc3ccccc32)c(Cl)c1 | 10.1016/j.bmcl.2005.10.107 | |||
| 44332168 | 4487 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 436 | 3 | 1 | 2 | 6.3 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1 | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL101935 | 4487 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 436 | 3 | 1 | 2 | 6.3 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1 | 10.1016/j.bmcl.2004.02.103 | |||
| 9799174 | 140660 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 364 | 2 | 0 | 2 | 5.4 | O=C(c1ccc(-c2ccccc2)cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL381248 | 140660 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 364 | 2 | 0 | 2 | 5.4 | O=C(c1ccc(-c2ccccc2)cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| 44273316 | 98925 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 589 | 7 | 1 | 5 | 4.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@@H](NCc3ccccc3)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL279022 | 98925 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 589 | 7 | 1 | 5 | 4.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C[C@@H](NCc3ccccc3)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 71720517 | 87041 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| CHEMBL2324200 | 87041 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| 5280343 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.4 | 4.4 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL1520590 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.4 | 4.4 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL50 | 188382 | None | 69 | Human | Binding | pIC50 | = | 4.4 | 4.4 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| 44293777 | 188215 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 460 | 3 | 1 | 4 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1c(F)cccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL49824 | 188215 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 460 | 3 | 1 | 4 | 5.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1c(F)cccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| 10837633 | 103079 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 459 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(F)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL306970 | 103079 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 459 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(F)cc1Cl | 10.1021/jm980179c | |||
| 10719289 | 208090 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL81755 | 208090 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1Cl | 10.1021/jm980179c | |||
| 44214518 | 119963 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 561 | 5 | 2 | 4 | 7.0 | O=C(Nc1ccc(C(=O)N2Cc3ccc(C(=O)O)n3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL349141 | 119963 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 561 | 5 | 2 | 4 | 7.0 | O=C(Nc1ccc(C(=O)N2Cc3ccc(C(=O)O)n3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00095-0 | |||
| 10551037 | 206692 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| CHEMBL70981 | 206692 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| 9954905 | 101967 | None | 4 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 440 | 3 | 1 | 4 | 4.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL300946 | 101967 | None | 4 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 440 | 3 | 1 | 4 | 4.8 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1 | 10.1016/s0960-894x(99)00279-6 | |||
| 10837633 | 103079 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 459 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL306970 | 103079 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 459 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccc(F)cc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| 10551037 | 206692 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL70981 | 206692 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 439 | 3 | 1 | 3 | 5.4 | Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 10764664 | 206837 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 421 | 3 | 1 | 3 | 5.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL71797 | 206837 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 421 | 3 | 1 | 3 | 5.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 10231366 | 4956 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 561 | 4 | 1 | 3 | 7.7 | O=C(Nc1ccc(C(=O)N2CC3C4CCC(CC4)N3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL104796 | 4956 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 561 | 4 | 1 | 3 | 7.7 | O=C(Nc1ccc(C(=O)N2CC3C4CCC(CC4)N3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 9915472 | 169626 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | 14 | 2 | ChEMBL | 547 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL443498 | 169626 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | 14 | 2 | ChEMBL | 547 | 4 | 1 | 3 | 7.3 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 11422294 | 62326 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 636 | 8 | 1 | 6 | 6.6 | CN(C)C1CCN(C(=O)COc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL177885 | 62326 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 636 | 8 | 1 | 6 | 6.6 | CN(C)C1CCN(C(=O)COc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 10764664 | 206837 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 421 | 3 | 1 | 3 | 5.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| CHEMBL71797 | 206837 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 421 | 3 | 1 | 3 | 5.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1021/jm980179c | |||
| 10495509 | 115191 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 314 | 1 | 1 | 2 | 4.2 | Cc1cc(N)ccc1C(=O)N1CCCCc2cc(Cl)ccc21 | 10.1021/jm000108p | |||
| CHEMBL334376 | 115191 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 314 | 1 | 1 | 2 | 4.2 | Cc1cc(N)ccc1C(=O)N1CCCCc2cc(Cl)ccc21 | 10.1021/jm000108p | |||
| 10814200 | 163599 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 469 | 3 | 1 | 3 | 6.2 | Cc1ccc(C)c(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)c(Cl)c2)c1 | 10.1021/jm980179c | |||
| CHEMBL420216 | 163599 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 469 | 3 | 1 | 3 | 6.2 | Cc1ccc(C)c(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)c(Cl)c2)c1 | 10.1021/jm980179c | |||
| 44293778 | 101675 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 476 | 3 | 1 | 4 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(Cl)ccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL298911 | 101675 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 476 | 3 | 1 | 4 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(Cl)ccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| 69939726 | 145117 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 498 | 6 | 1 | 8 | 3.6 | O=c1n(Cc2cn(-c3ccccc3Cl)nn2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3911148 | 145117 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 498 | 6 | 1 | 8 | 3.6 | O=c1n(Cc2cn(-c3ccccc3Cl)nn2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10742418 | 104542 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 455 | 3 | 1 | 3 | 5.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/jm980179c | |||
| CHEMBL310416 | 104542 | None | 0 | Rat | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 455 | 3 | 1 | 3 | 5.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/jm980179c | |||
| 53379068 | 142458 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 551 | 7 | 2 | 6 | 5.4 | O=C(O)c1ccc(-c2ccccc2Cl)cc1Cn1nc(-c2ccc(Cl)cc2)n(CC(O)C(F)(F)F)c1=O | nan | |||
| CHEMBL3889504 | 142458 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 551 | 7 | 2 | 6 | 5.4 | O=C(O)c1ccc(-c2ccccc2Cl)cc1Cn1nc(-c2ccc(Cl)cc2)n(CC(O)C(F)(F)F)c1=O | nan | |||
| 10527151 | 102228 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 441 | 3 | 1 | 3 | 5.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm980179c | |||
| CHEMBL302709 | 102228 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 441 | 3 | 1 | 3 | 5.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm980179c | |||
| 86690918 | 151909 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 547 | 6 | 1 | 6 | 6.4 | O=c1n(Cc2ccc(-c3cccc(Cl)c3Cl)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3965329 | 151909 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 547 | 6 | 1 | 6 | 6.4 | O=c1n(Cc2ccc(-c3cccc(Cl)c3Cl)s2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 69940091 | 148005 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 508 | 6 | 1 | 6 | 5.1 | O=c1n(Cc2ccnc(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3933604 | 148005 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 508 | 6 | 1 | 6 | 5.1 | O=c1n(Cc2ccnc(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10548204 | 12388 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 386 | 4 | 1 | 3 | 4.5 | COc1cccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)c1 | 10.1021/jm960133o | |||
| CHEMBL118562 | 12388 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 386 | 4 | 1 | 3 | 4.5 | COc1cccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)c1 | 10.1021/jm960133o | |||
| 10762667 | 12820 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 385 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCN(C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL118829 | 12820 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 385 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCN(C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 71720517 | 87041 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| CHEMBL2324200 | 87041 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| 1307424 | 12439 | None | 8 | Rat | Binding | pIC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 356 | 3 | 1 | 2 | 4.5 | O=C(Nc1cccc(C(=O)N2CCCc3ccccc32)c1)c1ccccc1 | 10.1021/jm960133o | |||
| CHEMBL118595 | 12439 | None | 8 | Rat | Binding | pIC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 356 | 3 | 1 | 2 | 4.5 | O=C(Nc1cccc(C(=O)N2CCCc3ccccc32)c1)c1ccccc1 | 10.1021/jm960133o | |||
| CHEMBL419793 | 215701 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](CCCCN)NC(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 10595449 | 10519 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 372 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCOc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL116820 | 10519 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 372 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCOc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44272960 | 73290 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 527 | 6 | 1 | 5 | 3.2 | CCNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL20126 | 73290 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 527 | 6 | 1 | 5 | 3.2 | CCNC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 11757133 | 117004 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 543 | 6 | 2 | 5 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CC(=O)O)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL338548 | 117004 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 543 | 6 | 2 | 5 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CC(=O)O)C1=O)C2 | 10.1021/jm00077a002 | |||
| 9889904 | 140433 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 449 | 2 | 1 | 5 | 5.5 | Cc1ccnn1-c1ccc(C(=O)N2Cc3cccnc3Nc3ccccc32)c(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL380733 | 140433 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 449 | 2 | 1 | 5 | 5.5 | Cc1ccnn1-c1ccc(C(=O)N2Cc3cccnc3Nc3ccccc32)c(C(F)(F)F)c1 | 10.1016/j.bmcl.2005.10.107 | |||
| 44309820 | 206686 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 433 | 3 | 2 | 3 | 6.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Nc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL70949 | 206686 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 433 | 3 | 2 | 3 | 6.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Nc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 2981363 | 12527 | None | 4 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 390 | 3 | 1 | 2 | 5.2 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm960133o | |||
| CHEMBL118660 | 12527 | None | 4 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 390 | 3 | 1 | 2 | 5.2 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccccc1Cl | 10.1021/jm960133o | |||
| 10030231 | 18923 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 541 | 6 | 1 | 4 | 4.5 | CC(C)CC1NC(=O)N([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| CHEMBL128489 | 18923 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 541 | 6 | 1 | 4 | 4.5 | CC(C)CC1NC(=O)N([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1021/jm00077a002 | |||
| 44352302 | 18965 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 6.7 | CN(C)CC1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL128687 | 18965 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 6.7 | CN(C)CC1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL1790938 | 211366 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | None | None | None | CC[C@@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)N(C)C(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 10693776 | 10163 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC(N(C)C)c4ccccc43)cc2)cc1 | 10.1021/jm960133o | |||
| CHEMBL115853 | 10163 | None | 0 | Rat | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC(N(C)C)c4ccccc43)cc2)cc1 | 10.1021/jm960133o | |||
| 9935969 | 120216 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c(Cl)[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL351453 | 120216 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c(Cl)[nH]c4cccc2c34)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 23598642 | 154894 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 541 | 6 | 2 | 3 | 7.1 | CNCC1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL400267 | 154894 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 541 | 6 | 2 | 3 | 7.1 | CNCC1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 10460610 | 172733 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 567 | 6 | 1 | 7 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(Cc3nn[nH]n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL449399 | 172733 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 567 | 6 | 1 | 7 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(Cc3nn[nH]n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 14969548 | 204588 | None | 0 | Rat | Binding | pIC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 477 | 11 | 1 | 4 | 4.9 | NCCCCCCCCOc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| CHEMBL60905 | 204588 | None | 0 | Rat | Binding | pIC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 477 | 11 | 1 | 4 | 4.9 | NCCCCCCCCOc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| 9937535 | 63058 | None | 1 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 554 | 7 | 2 | 4 | 5.1 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3F)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL1788221 | 63058 | None | 1 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 554 | 7 | 2 | 4 | 5.1 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3F)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 86690936 | 149215 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 596 | 7 | 1 | 10 | 3.2 | O=c1n(S(=O)(=O)c2ncnn2Cc2ccccc2C(F)(F)F)nc(-c2ccc(Cl)cc2)n1CC(O)C(F)(F)F | nan | |||
| CHEMBL3943296 | 149215 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 596 | 7 | 1 | 10 | 3.2 | O=c1n(S(=O)(=O)c2ncnn2Cc2ccccc2C(F)(F)F)nc(-c2ccc(Cl)cc2)n1CC(O)C(F)(F)F | nan | |||
| 10461149 | 117344 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 596 | 7 | 4 | 8 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CNc3n[nH]c(N)n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339524 | 117344 | None | 0 | Rat | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 596 | 7 | 4 | 8 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CNc3n[nH]c(N)n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44352413 | 21471 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)Cc1cccnc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131551 | 21471 | None | 0 | Rat | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)Cc1cccnc1)C2 | 10.1021/jm00077a002 | |||
| 71720517 | 87041 | None | 0 | Human | Binding | pIC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| CHEMBL2324200 | 87041 | None | 0 | Human | Binding | pIC50 | = | 4.4 | 4.4 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| 132072820 | 181039 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 610 | 8 | 0 | 7 | 5.4 | COC(=O)[C@H]1[C@@H](OCc2cccc(OC)c2)CC[C@H]2CN3CC[C@@]4(C(=O)N(Cc5cccc(OC)c5)c5ccccc54)[C@@H]3C[C@@H]21 | 10.1016/j.bmc.2020.115546 | |||
| CHEMBL4758081 | 181039 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 610 | 8 | 0 | 7 | 5.4 | COC(=O)[C@H]1[C@@H](OCc2cccc(OC)c2)CC[C@H]2CN3CC[C@@]4(C(=O)N(Cc5cccc(OC)c5)c5ccccc54)[C@@H]3C[C@@H]21 | 10.1016/j.bmc.2020.115546 | |||
| 10369423 | 168682 | None | 0 | Rat | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 520 | 6 | 1 | 3 | 4.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1ccccc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL435815 | 168682 | None | 0 | Rat | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 520 | 6 | 1 | 3 | 4.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1ccccc1)C2 | 10.1021/jm00077a002 | |||
| 44352400 | 18912 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)Cc1ccccn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128423 | 18912 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)Cc1ccccn1)C2 | 10.1021/jm00077a002 | |||
| 9910527 | 75945 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 429 | 2 | 0 | 5 | 5.2 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4N(C)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL205013 | 75945 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 429 | 2 | 0 | 5 | 5.2 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4N(C)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| 56848684 | 148500 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 545 | 9 | 2 | 7 | 3.9 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(CCC(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| CHEMBL3937650 | 148500 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 545 | 9 | 2 | 7 | 3.9 | NC(=O)OC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(CCC(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| 44294195 | 101370 | None | 1 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 519 | 4 | 1 | 5 | 6.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(-c2ccccn2)ccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL296619 | 101370 | None | 1 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 519 | 4 | 1 | 5 | 6.1 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(-c2ccccn2)ccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| 44352347 | 116870 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 540 | 6 | 4 | 7 | 2.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1n[nH]c(N)n1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL337853 | 116870 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 540 | 6 | 4 | 7 | 2.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1n[nH]c(N)n1)C2 | 10.1021/jm00077a002 | |||
| 44352184 | 117039 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 687 | 11 | 2 | 8 | 2.5 | Cn1cnc(CC(=O)NC(CCS(C)(=O)=O)C(=O)N[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| CHEMBL338711 | 117039 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 687 | 11 | 2 | 8 | 2.5 | Cn1cnc(CC(=O)NC(CCS(C)(=O)=O)C(=O)N[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| 44352374 | 18534 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 529 | 7 | 3 | 5 | 3.0 | CC(C)[C@H](N)C(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL127445 | 18534 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 529 | 7 | 3 | 5 | 3.0 | CC(C)[C@H](N)C(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 9824954 | 73886 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 449 | 2 | 1 | 5 | 5.5 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL201889 | 73886 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 449 | 2 | 1 | 5 | 5.5 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(C(F)(F)F)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| 56848488 | 149643 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 609 | 10 | 3 | 8 | 3.3 | NC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| CHEMBL3946734 | 149643 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 609 | 10 | 3 | 8 | 3.3 | NC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| 56848554 | 151934 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 595 | 10 | 3 | 8 | 2.3 | CS(=O)(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| CHEMBL3965460 | 151934 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 595 | 10 | 3 | 8 | 2.3 | CS(=O)(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| 10503021 | 102791 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 435 | 3 | 1 | 3 | 5.6 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)c1C | 10.1021/jm980179c | |||
| CHEMBL304956 | 102791 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 435 | 3 | 1 | 3 | 5.6 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)c1C | 10.1021/jm980179c | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/j.bmcl.2007.09.059 | |||
| 54582950 | 63057 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL1788220 | 63057 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 10527151 | 102228 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 441 | 3 | 1 | 3 | 5.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL302709 | 102228 | None | 0 | Rat | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 441 | 3 | 1 | 3 | 5.6 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1Cl | 10.1016/s0960-894x(03)00388-3 | |||
| 10642447 | 119364 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 362 | 3 | 1 | 2 | 5.4 | CCNc1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL343945 | 119364 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 362 | 3 | 1 | 2 | 5.4 | CCNc1ccc(C(=O)N2CCCCc3cc(Cl)ccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 172997 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)00649-2 | |||
| 2238 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL49429 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)00649-2 | |||
| DB06666 | 2332 | None | 49 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 64 | 2 | ChEMBL | 473 | 3 | 1 | 3 | 6.1 | Fc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2)C | 10.1016/s0960-894x(02)00649-2 | |||
| 44335329 | 167941 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 1 | 2 | ChEMBL | 561 | 4 | 1 | 3 | 7.6 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(C5)N4Cc4cc(Cl)ccc43)cc2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL430841 | 167941 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 1 | 2 | ChEMBL | 561 | 4 | 1 | 3 | 7.6 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(C5)N4Cc4cc(Cl)ccc43)cc2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 21467167 | 60554 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 452 | 4 | 1 | 3 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| CHEMBL175813 | 60554 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 452 | 4 | 1 | 3 | 6.7 | O=C(Nc1ccc(C(=O)N2CCCCc3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm00137a004 | |||
| 9851013 | 120287 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 570 | 7 | 1 | 5 | 6.7 | COc1cc(C(=O)N2Cc3ccc(CN(C)C)n3Cc3ccccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL352150 | 120287 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 570 | 7 | 1 | 5 | 6.7 | COc1cc(C(=O)N2Cc3ccc(CN(C)C)n3Cc3ccccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(00)00095-0 | |||
| 67408780 | 152218 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 550 | 7 | 2 | 6 | 4.8 | NC(=O)c1ccc(-c2ccccc2Cl)cc1Cn1nc(-c2ccc(Cl)cc2)n(CC(O)C(F)(F)F)c1=O | nan | |||
| CHEMBL3967902 | 152218 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 550 | 7 | 2 | 6 | 4.8 | NC(=O)c1ccc(-c2ccccc2Cl)cc1Cn1nc(-c2ccc(Cl)cc2)n(CC(O)C(F)(F)F)c1=O | nan | |||
| 10831068 | 27217 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 340 | 4 | 1 | 2 | 4.9 | C=CCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| CHEMBL136644 | 27217 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 340 | 4 | 1 | 2 | 4.9 | C=CCNc1ccc(C(=O)N2CCCCc3ccccc32)c(Cl)c1 | 10.1021/jm000108p | |||
| 10765617 | 12457 | None | 0 | Rat | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 441 | 6 | 2 | 3 | 5.7 | CCCNC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL118609 | 12457 | None | 0 | Rat | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 441 | 6 | 2 | 3 | 5.7 | CCCNC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 44377836 | 57550 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL166261 | 57550 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 505 | 4 | 2 | 2 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCc3c[nH]c4cccc2c34)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 11365307 | 62126 | None | 0 | Rat | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 586 | 8 | 1 | 5 | 7.7 | CN(CCc1cccnc1)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| CHEMBL177556 | 62126 | None | 0 | Rat | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 586 | 8 | 1 | 5 | 7.7 | CN(CCc1cccnc1)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| 10840974 | 61799 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 579 | 7 | 1 | 6 | 5.8 | CN1CCN(CCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccsc32)CC1 | 10.1021/jm030287l | |||
| CHEMBL177285 | 61799 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 579 | 7 | 1 | 6 | 5.8 | CN1CCN(CCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccsc32)CC1 | 10.1021/jm030287l | |||
| 11365307 | 62126 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 586 | 8 | 1 | 5 | 7.7 | CN(CCc1cccnc1)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| CHEMBL177556 | 62126 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 586 | 8 | 1 | 5 | 7.7 | CN(CCc1cccnc1)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm00137a004 | |||
| 119369 | 2606 | None | 50 | Human | Binding | pIC50 | = | 6.3 | 6.3 | 1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| 2197 | 2606 | None | 50 | Human | Binding | pIC50 | = | 6.3 | 6.3 | 1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| 4004 | 2606 | None | 50 | Human | Binding | pIC50 | = | 6.3 | 6.3 | 1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| CHEMBL420762 | 2606 | None | 50 | Human | Binding | pIC50 | = | 6.3 | 6.3 | 1 | 8 | ChEMBL | 427 | 4 | 1 | 3 | 5.3 | O=C(N1CCCC(c2c1cccc2)N(C)C)c1ccc(cc1)NC(=O)c1ccccc1C | 10.1021/jm00137a004 | |||
| 15307972 | 206807 | None | 0 | Rat | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 446 | 3 | 1 | 2 | 6.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL71626 | 206807 | None | 0 | Rat | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 446 | 3 | 1 | 2 | 6.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 71720517 | 87041 | None | 0 | Human | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| CHEMBL2324200 | 87041 | None | 0 | Human | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 822 | 2 | 2 | 4 | 6.0 | O=C1OC(c2cc(I)c(O)c(I)c2)(c2c(I)cc(O)cc2I)c2ccccc21 | 10.1021/jm301749y | |||
| 10737785 | 27391 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 368 | 2 | 0 | 2 | 5.2 | CC1CCN(c2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)C1 | 10.1021/jm000108p | |||
| CHEMBL136790 | 27391 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 368 | 2 | 0 | 2 | 5.2 | CC1CCN(c2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)C1 | 10.1021/jm000108p | |||
| 15298022 | 72064 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 370 | 2 | 0 | 3 | 5.4 | O=C(c1ccc(-c2cccs2)cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL197616 | 72064 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 370 | 2 | 0 | 3 | 5.4 | O=C(c1ccc(-c2cccs2)cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| 71458039 | 78906 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 530 | 8 | 3 | 5 | 2.2 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C2 | 10.1021/jm00031a004 | |||
| CHEMBL2112899 | 78906 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 530 | 8 | 3 | 5 | 2.2 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C2 | 10.1021/jm00031a004 | |||
| 10256467 | 20514 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 530 | 8 | 3 | 5 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](N)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL130742 | 20514 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 530 | 8 | 3 | 5 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](N)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| 44352438 | 115285 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 541 | 6 | 3 | 5 | 3.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C1CCCNC1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL334610 | 115285 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 541 | 6 | 3 | 5 | 3.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C1CCCNC1)C2 | 10.1021/jm00077a002 | |||
| 44352412 | 115563 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)Cc1ccncc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL335182 | 115563 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)Cc1ccncc1)C2 | 10.1021/jm00077a002 | |||
| 11269308 | 122679 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 390 | 3 | 1 | 3 | 5.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCCc3sccc32)cc1 | 10.1021/jm00137a004 | |||
| CHEMBL360272 | 122679 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 390 | 3 | 1 | 3 | 5.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCCc3sccc32)cc1 | 10.1021/jm00137a004 | |||
| CHEMBL1790937 | 211365 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 2 | ChEMBL | None | None | None | CC[C@@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 9984805 | 117122 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 541 | 7 | 2 | 4 | 4.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CCC1CCCNC1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339155 | 117122 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 541 | 7 | 2 | 4 | 4.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CCC1CCCNC1)C2 | 10.1021/jm00077a002 | |||
| 11432362 | 94190 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL249340 | 94190 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 10621059 | 114326 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 401 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccccc1[N+](=O)[O-] | 10.1021/jm960133o | |||
| CHEMBL333055 | 114326 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 401 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccccc1[N+](=O)[O-] | 10.1021/jm960133o | |||
| 44310140 | 206925 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 423 | 3 | 2 | 4 | 4.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1O | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL72342 | 206925 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 423 | 3 | 2 | 4 | 4.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1O | 10.1016/s0960-894x(03)00388-3 | |||
| 44352427 | 116878 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 637 | 10 | 4 | 6 | 3.2 | CC(C)[C@H](NC(=O)Cc1c[nH]cn1)C(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL337889 | 116878 | None | 0 | Rat | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 637 | 10 | 4 | 6 | 3.2 | CC(C)[C@H](NC(=O)Cc1c[nH]cn1)C(=O)NC[C@@]1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 10258572 | 118163 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 638 | 11 | 4 | 6 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CC(CC(N)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL340676 | 118163 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 638 | 11 | 4 | 6 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CC(CC(N)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 14969539 | 168064 | None | 0 | Rat | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 434 | 8 | 0 | 3 | 5.2 | CCCCCCOc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| CHEMBL431723 | 168064 | None | 0 | Rat | Binding | pIC50 | = | 4.3 | 4.3 | - | 0 | ChEMBL | 434 | 8 | 0 | 3 | 5.2 | CCCCCCOc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| 44273321 | 167600 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 542 | 7 | 2 | 6 | 2.2 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(NCCN)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL429971 | 167600 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 542 | 7 | 2 | 6 | 2.2 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(NCCN)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 44377521 | 120143 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 571 | 7 | 1 | 5 | 7.0 | CCOC(=O)Cn1cc2c3c(cccc31)N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccc(C)cc3)cc1)CCC2 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL350792 | 120143 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 571 | 7 | 1 | 5 | 7.0 | CCOC(=O)Cn1cc2c3c(cccc31)N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccc(C)cc3)cc1)CCC2 | 10.1016/s0960-894x(02)01059-4 | |||
| 23598556 | 4367 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 454 | 3 | 1 | 2 | 6.4 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1F | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL101157 | 4367 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 454 | 3 | 1 | 2 | 6.4 | O=C(Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1)c1ccccc1F | 10.1016/j.bmcl.2004.02.103 | |||
| 10459923 | 116406 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 539 | 5 | 1 | 4 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| CHEMBL335944 | 116406 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 539 | 5 | 1 | 4 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| 10480543 | 116589 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 485 | 4 | 1 | 4 | 3.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1CCC(N)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL336195 | 116589 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 485 | 4 | 1 | 4 | 3.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1CCC(N)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44352490 | 118016 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 577 | 6 | 2 | 6 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C1CC(S(C)(=O)=O)CN1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL340362 | 118016 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 577 | 6 | 2 | 6 | 2.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C1CC(S(C)(=O)=O)CN1)C2 | 10.1021/jm00077a002 | |||
| 44352443 | 118535 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 539 | 7 | 3 | 5 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](N)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL341311 | 118535 | None | 0 | Rat | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 539 | 7 | 3 | 5 | 2.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](N)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 10437668 | 78911 | None | 1 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 2 | ChEMBL | 554 | 9 | 2 | 7 | 1.5 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@@H](N)CCS(C)(=O)=O)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| CHEMBL2112903 | 78911 | None | 1 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 2 | ChEMBL | 554 | 9 | 2 | 7 | 1.5 | Cc1ccccc1N1CCN(S(=O)(=O)C[C@]23CCC(C[C@@H]2NC(=O)[C@@H](N)CCS(C)(=O)=O)C3(C)C)CC1 | 10.1021/jm00031a004 | |||
| 10415322 | 168343 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 556 | 7 | 2 | 5 | 2.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CCC(N)=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL433662 | 168343 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 556 | 7 | 2 | 5 | 2.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CCC(N)=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| 2249 | 2227 | None | 17 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | -54 | 7 | ChEMBL | 554 | 9 | 2 | 7 | 1.5 | O=C([C@H](CCS(=O)(=O)C)N)N[C@H]1C[C@@H]2C([C@]1(CC2)CS(=O)(=O)N1CCN(CC1)c1ccccc1C)(C)C | 10.1016/j.bmcl.2012.10.116 | |||
| 9872389 | 2227 | None | 17 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | -54 | 7 | ChEMBL | 554 | 9 | 2 | 7 | 1.5 | O=C([C@H](CCS(=O)(=O)C)N)N[C@H]1C[C@@H]2C([C@]1(CC2)CS(=O)(=O)N1CCN(CC1)c1ccccc1C)(C)C | 10.1016/j.bmcl.2012.10.116 | |||
| CHEMBL1253853 | 2227 | None | 17 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | -54 | 7 | ChEMBL | 554 | 9 | 2 | 7 | 1.5 | O=C([C@H](CCS(=O)(=O)C)N)N[C@H]1C[C@@H]2C([C@]1(CC2)CS(=O)(=O)N1CCN(CC1)c1ccccc1C)(C)C | 10.1016/j.bmcl.2012.10.116 | |||
| 10789935 | 11820 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 455 | 4 | 1 | 5 | 5.0 | CC(=O)O/N=C1\CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL118204 | 11820 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 455 | 4 | 1 | 5 | 5.0 | CC(=O)O/N=C1\CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 22405322 | 71806 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 406 | 4 | 0 | 2 | 6.3 | CCCc1ccc(-c2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)cc1 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL196737 | 71806 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 406 | 4 | 0 | 2 | 6.3 | CCCc1ccc(-c2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)cc2)cc1 | 10.1016/j.bmcl.2005.08.007 | |||
| 9805201 | 56273 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 480 | 3 | 2 | 4 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)c(Cl)c1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL162748 | 56273 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 480 | 3 | 2 | 4 | 5.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)c(Cl)c1 | 10.1016/s0960-894x(00)00084-6 | |||
| 10279928 | 107411 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 527 | 4 | 1 | 3 | 7.0 | O=C(Nc1ccc(C(=O)N2CC3C4CCC(CC4)N3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL317673 | 107411 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 527 | 4 | 1 | 3 | 7.0 | O=C(Nc1ccc(C(=O)N2CC3C4CCC(CC4)N3Cc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 11158261 | 129718 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 692 | 12 | 1 | 6 | 8.1 | CCN(CC)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL367323 | 129718 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 692 | 12 | 1 | 6 | 8.1 | CCN(CC)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 11490613 | 161832 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 636 | 9 | 1 | 6 | 6.6 | CN1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL413748 | 161832 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 636 | 9 | 1 | 6 | 6.6 | CN1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 10390899 | 186829 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 490 | 3 | 1 | 3 | 6.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)c(Cl)c1 | 10.1016/s0960-894x(99)00278-4 | |||
| CHEMBL48867 | 186829 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 490 | 3 | 1 | 3 | 6.9 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3sccc3Cc3ccccc32)c(Cl)c1 | 10.1016/s0960-894x(99)00278-4 | |||
| 10578460 | 60451 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 544 | 6 | 1 | 5 | 7.1 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3cccnc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL175182 | 60451 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 544 | 6 | 1 | 5 | 7.1 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3cccnc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 11351397 | 61027 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 449 | 4 | 1 | 3 | 5.9 | Cn1ccc2c1CCCCN2C(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2)cc1 | 10.1021/jm00137a004 | |||
| CHEMBL176264 | 61027 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 449 | 4 | 1 | 3 | 5.9 | Cn1ccc2c1CCCCN2C(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2)cc1 | 10.1021/jm00137a004 | |||
| 10392781 | 118341 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 4.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)c1cccnc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL340964 | 118341 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 549 | 7 | 2 | 5 | 4.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)c1cccnc1)C2 | 10.1021/jm00077a002 | |||
| 3793 | 205667 | None | 50 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 45039617 | 205667 | None | 50 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| CHEMBL64391 | 205667 | None | 50 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 10620049 | 114170 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 384 | 5 | 1 | 2 | 4.9 | O=C(CCc1ccccc1)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL332757 | 114170 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 384 | 5 | 1 | 2 | 4.9 | O=C(CCc1ccccc1)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44352392 | 116920 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 567 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| CHEMBL338118 | 116920 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 567 | 6 | 2 | 5 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| 44273013 | 99524 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 543 | 7 | 2 | 6 | 2.2 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(NCCO)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL283126 | 99524 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 543 | 7 | 2 | 6 | 2.2 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(NCCO)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 10394512 | 117078 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 652 | 11 | 3 | 7 | 2.3 | Cn1cnc(CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| CHEMBL338921 | 117078 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 652 | 11 | 3 | 7 | 2.3 | Cn1cnc(CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| 44352114 | 22071 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 517 | 8 | 3 | 5 | 2.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CCCO)C2 | 10.1021/jm00077a002 | |||
| CHEMBL132165 | 22071 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 517 | 8 | 3 | 5 | 2.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CCCO)C2 | 10.1021/jm00077a002 | |||
| 10393719 | 22330 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 595 | 8 | 2 | 5 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)CC1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| CHEMBL132391 | 22330 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 595 | 8 | 2 | 5 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CCNC(=O)CC1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| 5280343 | 188382 | None | 69 | Human | Binding | pIC50 | = | 5.2 | 5.2 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL1520590 | 188382 | None | 69 | Human | Binding | pIC50 | = | 5.2 | 5.2 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL50 | 188382 | None | 69 | Human | Binding | pIC50 | = | 5.2 | 5.2 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| 3793 | 205667 | None | 50 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 45039617 | 205667 | None | 50 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| CHEMBL64391 | 205667 | None | 50 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 10790546 | 110710 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 470 | 5 | 2 | 4 | 4.9 | CC(=O)Nc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL325819 | 110710 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 470 | 5 | 2 | 4 | 4.9 | CC(=O)Nc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 2984025 | 12896 | None | 4 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 346 | 3 | 1 | 3 | 4.1 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccco1 | 10.1021/jm960133o | |||
| CHEMBL118892 | 12896 | None | 4 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 346 | 3 | 1 | 3 | 4.1 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccco1 | 10.1021/jm960133o | |||
| 11764606 | 117428 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 630 | 9 | 0 | 7 | 3.3 | Cn1cnc(CC(=O)N(CCS(C)(=O)=O)[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| CHEMBL339756 | 117428 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 630 | 9 | 0 | 7 | 3.3 | Cn1cnc(CC(=O)N(CCS(C)(=O)=O)[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| 2981862 | 113396 | None | 4 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 401 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccc([N+](=O)[O-])cc1 | 10.1021/jm960133o | |||
| CHEMBL331647 | 113396 | None | 4 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 401 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccc([N+](=O)[O-])cc1 | 10.1021/jm960133o | |||
| 10414380 | 116129 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1ccccn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL335634 | 116129 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 521 | 6 | 1 | 4 | 4.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)Cc1ccccn1)C2 | 10.1021/jm00077a002 | |||
| 44352124 | 117116 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 512 | 7 | 2 | 5 | 3.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CCC#N)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339124 | 117116 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 512 | 7 | 2 | 5 | 3.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CCC#N)C2 | 10.1021/jm00077a002 | |||
| 15340668 | 206227 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 407 | 3 | 1 | 3 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL68033 | 206227 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 407 | 3 | 1 | 3 | 5.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3-c3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 10483586 | 20704 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 591 | 7 | 1 | 6 | 2.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CCS(C)(=O)=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL130891 | 20704 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 591 | 7 | 1 | 6 | 2.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CCS(C)(=O)=O)C1=O)C2 | 10.1021/jm00077a002 | |||
| 11757440 | 116993 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 556 | 7 | 1 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(CCC(=O)O)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL338503 | 116993 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 556 | 7 | 1 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(CCC(=O)O)C1=O)C2 | 10.1021/jm00077a002 | |||
| 53378840 | 149803 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 532 | 6 | 1 | 7 | 5.3 | O=c1n(Cc2cnc(-c3cccc(Cl)c3Cl)o2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3947893 | 149803 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 532 | 6 | 1 | 7 | 5.3 | O=c1n(Cc2cnc(-c3cccc(Cl)c3Cl)o2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 10322392 | 4693 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 468 | 3 | 1 | 2 | 6.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL103406 | 4693 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 468 | 3 | 1 | 2 | 6.7 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.02.103 | |||
| 10393965 | 22063 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 610 | 7 | 3 | 8 | 2.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CC(=O)Nc3nn[nH]n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL132157 | 22063 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 610 | 7 | 3 | 8 | 2.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)NC(CC(=O)Nc3nn[nH]n3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44352123 | 118155 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 566 | 8 | 3 | 6 | 1.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CCS(N)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL340639 | 118155 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 566 | 8 | 3 | 6 | 1.6 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)C(N)CCS(N)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| 15307968 | 103110 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 432 | 3 | 1 | 2 | 6.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL307271 | 103110 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 432 | 3 | 1 | 2 | 6.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 10619160 | 11849 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.8 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)c1 | 10.1021/jm960133o | |||
| CHEMBL118220 | 11849 | None | 0 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.8 | Cc1cccc(C(=O)Nc2ccc(C(=O)N3CCCc4ccccc43)cc2)c1 | 10.1021/jm960133o | |||
| 44352453 | 18974 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 535 | 6 | 2 | 5 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1cccnc1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128726 | 18974 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 535 | 6 | 2 | 5 | 3.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)c1cccnc1)C2 | 10.1021/jm00077a002 | |||
| 19699097 | 120068 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 446 | 3 | 2 | 4 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL350090 | 120068 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 446 | 3 | 2 | 4 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL435021 | 216122 | None | 2 | Rat | Binding | pIC50 | = | 6.2 | 6.2 | - | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CNCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 9871426 | 117075 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)CC1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL338901 | 117075 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)CC1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44352757 | 118518 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL341173 | 118518 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44378885 | 120171 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 625 | 7 | 1 | 6 | 6.4 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1Cc2ccc(CN3CCN(C)CC3)n2Cc2ccccc21 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL351019 | 120171 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 625 | 7 | 1 | 6 | 6.4 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1Cc2ccc(CN3CCN(C)CC3)n2Cc2ccccc21 | 10.1016/s0960-894x(00)00095-0 | |||
| 18917534 | 206752 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 485 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1Br | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL71355 | 206752 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 485 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1)c1ccccc1Br | 10.1016/s0960-894x(03)00388-3 | |||
| 10392505 | 108648 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | 4 | 2 | ChEMBL | 539 | 3 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1C(F)(F)F | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL320416 | 108648 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | 4 | 2 | ChEMBL | 539 | 3 | 1 | 3 | 6.6 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1C(F)(F)F | 10.1016/s0960-894x(02)00649-2 | |||
| 11490514 | 130757 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 622 | 10 | 1 | 6 | 7.1 | CN1CCN(CCCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL368354 | 130757 | None | 0 | Rat | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 622 | 10 | 1 | 6 | 7.1 | CN1CCN(CCCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 44294175 | 101894 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 520 | 3 | 1 | 4 | 5.8 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(Br)ccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL300433 | 101894 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 520 | 3 | 1 | 4 | 5.8 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1cc(Br)ccc1Cl | 10.1016/s0960-894x(99)00279-6 | |||
| 9959838 | 165641 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 574 | 6 | 1 | 4 | 7.3 | CN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1Cl)C2 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL424163 | 165641 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 574 | 6 | 1 | 4 | 7.3 | CN(C)Cc1ccc2n1Cc1ccccc1N(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1Cl)C2 | 10.1016/s0960-894x(00)00095-0 | |||
| 10831734 | 118946 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 350 | 2 | 0 | 2 | 5.1 | O=C(c1ccc(-n2cccc2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| CHEMBL342250 | 118946 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 350 | 2 | 0 | 2 | 5.1 | O=C(c1ccc(-n2cccc2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| 67409800 | 146986 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 497 | 6 | 1 | 7 | 4.2 | O=c1n(Cc2cnn(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3925572 | 146986 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 497 | 6 | 1 | 7 | 4.2 | O=c1n(Cc2cnn(-c3ccccc3Cl)c2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 56848491 | 152508 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 651 | 9 | 3 | 8 | 4.7 | CC(C)(C)OC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| CHEMBL3970631 | 152508 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 651 | 9 | 3 | 8 | 4.7 | CC(C)(C)OC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1C(F)(F)F | nan | |||
| 10595343 | 114489 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.9 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1 | 10.1021/jm960133o | |||
| CHEMBL333201 | 114489 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 370 | 3 | 1 | 2 | 4.9 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1 | 10.1021/jm960133o | |||
| 44332273 | 169220 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 450 | 3 | 1 | 2 | 6.6 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.02.103 | |||
| CHEMBL440147 | 169220 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 450 | 3 | 1 | 2 | 6.6 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC3(C=CCCC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.02.103 | |||
| 10626339 | 128716 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 543 | 6 | 1 | 4 | 7.7 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL366790 | 128716 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 543 | 6 | 1 | 4 | 7.7 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 5280343 | 188382 | None | 69 | Human | Binding | pIC50 | = | 5.2 | 5.2 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL1520590 | 188382 | None | 69 | Human | Binding | pIC50 | = | 5.2 | 5.2 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| CHEMBL50 | 188382 | None | 69 | Human | Binding | pIC50 | = | 5.2 | 5.2 | -147 | 32 | ChEMBL | 302 | 1 | 5 | 7 | 2.0 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 10.1021/jm301749y | |||
| 9981665 | 118541 | None | 4 | Rat | Binding | pIC50 | = | 4.2 | 4.2 | -77 | 6 | ChEMBL | 459 | 5 | 2 | 4 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CC(=O)O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL341339 | 118541 | None | 4 | Rat | Binding | pIC50 | = | 4.2 | 4.2 | -77 | 6 | ChEMBL | 459 | 5 | 2 | 4 | 3.4 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CC(=O)O)C2 | 10.1021/jm00077a002 | |||
| 11798122 | 114596 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 458 | 5 | 1 | 5 | 4.9 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL333597 | 114596 | None | 0 | Rat | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 458 | 5 | 1 | 5 | 4.9 | CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 11238362 | 169011 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 562 | 6 | 2 | 4 | 6.5 | CCOc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL438523 | 169011 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 562 | 6 | 2 | 4 | 6.5 | CCOc1cc(C(=O)N2CC[C@]3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 19699097 | 120068 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 446 | 3 | 2 | 4 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| CHEMBL350090 | 120068 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 446 | 3 | 2 | 4 | 5.0 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc32)cc1 | 10.1016/s0960-894x(00)00084-6 | |||
| 977621 | 10091 | None | 7 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 322 | 4 | 1 | 2 | 4.0 | CCCC(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL115434 | 10091 | None | 7 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 322 | 4 | 1 | 2 | 4.0 | CCCC(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| 44273173 | 99079 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 555 | 7 | 0 | 5 | 4.0 | CCN(CC)[C@@H]1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL280202 | 99079 | None | 0 | Rat | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 555 | 7 | 0 | 5 | 4.0 | CCN(CC)[C@@H]1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 44335241 | 168101 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 575 | 4 | 1 | 3 | 8.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(CC5)N4Cc4cc(Cl)ccc43)cc2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL432009 | 168101 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 575 | 4 | 1 | 3 | 8.0 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(CC5)N4Cc4cc(Cl)ccc43)cc2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL2112250 | 211696 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2cccc3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 44273034 | 99102 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 557 | 7 | 2 | 6 | 2.3 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(NCC(=O)O)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL280356 | 99102 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 557 | 7 | 2 | 6 | 2.3 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CC(NCC(=O)O)C1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 14969534 | 167987 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 412 | 2 | 0 | 2 | 4.0 | O=C(c1ccc(Br)cc1)N1CCC(N2C(=O)CCc3ccccc32)CC1 | 10.1021/jm00066a010 | |||
| CHEMBL431159 | 167987 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 412 | 2 | 0 | 2 | 4.0 | O=C(c1ccc(Br)cc1)N1CCC(N2C(=O)CCc3ccccc32)CC1 | 10.1021/jm00066a010 | |||
| 9986160 | 117434 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 608 | 7 | 2 | 6 | 3.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(CC(=O)Nc3ncc[nH]3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339768 | 117434 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 608 | 7 | 2 | 6 | 3.1 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(CC(=O)Nc3ncc[nH]3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL2112655 | 211703 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 44352146 | 117281 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 513 | 5 | 2 | 5 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CN1C(=O)CNC1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL339433 | 117281 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 513 | 5 | 2 | 5 | 2.5 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CN1C(=O)CNC1=O)C2 | 10.1021/jm00077a002 | |||
| 44352491 | 118293 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 549 | 8 | 2 | 5 | 2.7 | C[S+]([O-])CCC(N)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL340915 | 118293 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 549 | 8 | 2 | 5 | 2.7 | C[S+]([O-])CCC(N)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL2112651 | 211701 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 10369550 | 118540 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 524 | 6 | 1 | 5 | 3.6 | Cn1cncc1CC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL341338 | 118540 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 524 | 6 | 1 | 5 | 3.6 | Cn1cncc1CC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 44444760 | 154709 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL399288 | 154709 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 518 | 4 | 2 | 3 | 6.1 | O=C(O)C1=CC2(CC1)CCN(C(=O)c1ccc(NC(=O)c3cc(F)ccc3Cl)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 10501216 | 113196 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 401 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cccc([N+](=O)[O-])c1 | 10.1021/jm960133o | |||
| CHEMBL331424 | 113196 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 401 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cccc([N+](=O)[O-])c1 | 10.1021/jm960133o | |||
| 10713341 | 12960 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 357 | 3 | 1 | 3 | 3.9 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cccnc1 | 10.1021/jm960133o | |||
| CHEMBL118933 | 12960 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 357 | 3 | 1 | 3 | 3.9 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cccnc1 | 10.1021/jm960133o | |||
| 10599369 | 114876 | None | 0 | Rat | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 443 | 5 | 1 | 4 | 5.0 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL334082 | 114876 | None | 0 | Rat | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 443 | 5 | 1 | 4 | 5.0 | COc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1 | 10.1021/jm960133o | |||
| 21837089 | 103865 | None | 0 | Rat | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 451 | 5 | 1 | 4 | 5.3 | CCOc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL309096 | 103865 | None | 0 | Rat | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 451 | 5 | 1 | 4 | 5.3 | CCOc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 14969514 | 205770 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 368 | 2 | 0 | 2 | 3.9 | O=C(c1ccc(Cl)cc1)N1CCC(N2C(=O)CCc3ccccc32)CC1 | 10.1021/jm00066a010 | |||
| CHEMBL64811 | 205770 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 368 | 2 | 0 | 2 | 3.9 | O=C(c1ccc(Cl)cc1)N1CCC(N2C(=O)CCc3ccccc32)CC1 | 10.1021/jm00066a010 | |||
| 10548205 | 12712 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 386 | 3 | 1 | 3 | 5.3 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)Oc1ccccc1 | 10.1021/jm960133o | |||
| CHEMBL118760 | 12712 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 386 | 3 | 1 | 3 | 5.3 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)Oc1ccccc1 | 10.1021/jm960133o | |||
| 10075696 | 21548 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 530 | 8 | 3 | 5 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131650 | 21548 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 530 | 8 | 3 | 5 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C2 | 10.1021/jm00077a002 | |||
| 3793 | 205667 | None | 50 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 45039617 | 205667 | None | 50 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| CHEMBL64391 | 205667 | None | 50 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 9828129 | 116685 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL336825 | 116685 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 522 | 6 | 2 | 4 | 6.6 | O=C(O)C[C@@H]1CCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc2S1 | 10.1016/j.bmcl.2003.08.051 | |||
| 44352783 | 116845 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 508 | 6 | 2 | 4 | 6.5 | O=C(Nc1ccc(C(=O)N2CCC(CCO)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL337725 | 116845 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 508 | 6 | 2 | 4 | 6.5 | O=C(Nc1ccc(C(=O)N2CCC(CCO)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| 23598598 | 4969 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL104839 | 4969 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 608 | 7 | 2 | 4 | 6.3 | Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCC3(C=C(C(=O)NCCN4CCCCC4)CC3)Cc3ccccc32)cc1 | 10.1016/j.bmcl.2004.04.016 | |||
| 54582950 | 63057 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| CHEMBL1788220 | 63057 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2004.04.016 | |||
| 56848555 | 151838 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 560 | 9 | 4 | 7 | 2.5 | NC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| CHEMBL3964694 | 151838 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 560 | 9 | 4 | 7 | 2.5 | NC(=O)NC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1ccccc1Cl | nan | |||
| 9848300 | 120122 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 487 | 4 | 2 | 3 | 6.1 | O=C(Nc1ccc(C(=O)N2CCCC3C(=O)Nc4cccc2c43)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| CHEMBL350576 | 120122 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 487 | 4 | 2 | 3 | 6.1 | O=C(Nc1ccc(C(=O)N2CCCC3C(=O)Nc4cccc2c43)cc1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(02)01059-4 | |||
| 10743659 | 208160 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 489 | 3 | 1 | 3 | 6.6 | Cc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1NC(=O)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL82376 | 208160 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 489 | 3 | 1 | 3 | 6.6 | Cc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1NC(=O)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| 44444762 | 154819 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL399888 | 154819 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 612 | 8 | 2 | 4 | 6.6 | CN(C)CCNC(=O)C1=C[C@@]2(CC1)CCN(C(=O)c1ccc(NC(=O)c3ccccc3-c3ccccc3)cc1)c1ccccc1C2 | 10.1016/j.bmcl.2007.09.059 | |||
| 11262100 | 61794 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 624 | 13 | 1 | 6 | 7.3 | CN(C)CCN(C)CCCCOc1cc(C(=O)N2CCCCc3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL177248 | 61794 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 624 | 13 | 1 | 6 | 7.3 | CN(C)CCN(C)CCCCOc1cc(C(=O)N2CCCCc3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 11422294 | 62326 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 636 | 8 | 1 | 6 | 6.6 | CN(C)C1CCN(C(=O)COc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL177885 | 62326 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 636 | 8 | 1 | 6 | 6.6 | CN(C)C1CCN(C(=O)COc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 86690917 | 150499 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 555 | 8 | 2 | 9 | 2.7 | NC(=O)Cn1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nc1-c1ccccc1Cl | nan | |||
| CHEMBL3953766 | 150499 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 555 | 8 | 2 | 9 | 2.7 | NC(=O)Cn1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nc1-c1ccccc1Cl | nan | |||
| 18917553 | 101517 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 484 | 4 | 1 | 4 | 6.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(99)00279-6 | |||
| CHEMBL297705 | 101517 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 484 | 4 | 1 | 4 | 6.0 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1)c1ccccc1-c1ccccc1 | 10.1016/s0960-894x(99)00279-6 | |||
| 10673699 | 106740 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 527 | 3 | 1 | 3 | 6.8 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1cccc(C(F)(F)F)c1F | 10.1021/jm980179c | |||
| CHEMBL314344 | 106740 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 527 | 3 | 1 | 3 | 6.8 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1cccc(C(F)(F)F)c1F | 10.1021/jm980179c | |||
| 10673295 | 104952 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 509 | 3 | 1 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| CHEMBL311230 | 104952 | None | 0 | Rat | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 509 | 3 | 1 | 3 | 6.9 | O=C(Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1)c1ccc(Cl)cc1Cl | 10.1021/jm980179c | |||
| 86690931 | 149117 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 543 | 6 | 1 | 7 | 5.1 | O=c1n(Cc2cc(-c3cccc(Cl)c3Cl)ncn2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3942564 | 149117 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 543 | 6 | 1 | 7 | 5.1 | O=c1n(Cc2cc(-c3cccc(Cl)c3Cl)ncn2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 71146879 | 146223 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 498 | 6 | 2 | 7 | 3.8 | O=c1n(Cc2nnc(-c3ccccc3Cl)[nH]2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| CHEMBL3919631 | 146223 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 498 | 6 | 2 | 7 | 3.8 | O=c1n(Cc2nnc(-c3ccccc3Cl)[nH]2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F | nan | |||
| 44378675 | 168741 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 671 | 6 | 1 | 5 | 7.4 | CN(C)C1CCN(C(=O)c2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| CHEMBL436241 | 168741 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 671 | 6 | 1 | 5 | 7.4 | CN(C)C1CCN(C(=O)c2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 | 10.1016/s0960-894x(00)00095-0 | |||
| 10569977 | 30986 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 351 | 2 | 0 | 3 | 4.5 | O=C(c1ccc(-n2cccn2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| CHEMBL139863 | 30986 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 351 | 2 | 0 | 3 | 4.5 | O=C(c1ccc(-n2cccn2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| 3537 | 4004 | None | 22 | Human | Binding | pIC50 | = | 7.1 | 7.1 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2005.10.107 | |||
| 5311500 | 4004 | None | 22 | Human | Binding | pIC50 | = | 7.1 | 7.1 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL363910 | 4004 | None | 22 | Human | Binding | pIC50 | = | 7.1 | 7.1 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2005.10.107 | |||
| 11262100 | 61794 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 624 | 13 | 1 | 6 | 7.3 | CN(C)CCN(C)CCCCOc1cc(C(=O)N2CCCCc3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL177248 | 61794 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 624 | 13 | 1 | 6 | 7.3 | CN(C)CCN(C)CCCCOc1cc(C(=O)N2CCCCc3sccc32)ccc1NC(=O)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 10626339 | 128716 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 543 | 6 | 1 | 4 | 7.7 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| CHEMBL366790 | 128716 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 543 | 6 | 1 | 4 | 7.7 | O=C(Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)c3sccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm030287l | |||
| 10578000 | 168605 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 524 | 7 | 1 | 5 | 6.1 | CN(C)CCN1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm030287l | |||
| CHEMBL435331 | 168605 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 524 | 7 | 1 | 5 | 6.1 | CN(C)CCN1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccsc21 | 10.1021/jm030287l | |||
| 3537 | 4004 | None | 22 | Human | Binding | pIC50 | = | 7.1 | 7.1 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2007.08.053 | |||
| 5311500 | 4004 | None | 22 | Human | Binding | pIC50 | = | 7.1 | 7.1 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2007.08.053 | |||
| CHEMBL363910 | 4004 | None | 22 | Human | Binding | pIC50 | = | 7.1 | 7.1 | 3 | 3 | ChEMBL | 402 | 2 | 0 | 4 | 4.8 | Cc1ccn(n1)c1ccc(c(c1)Cl)C(=O)N1Cc2cccn2Cc2c1cccc2 | 10.1016/j.bmcl.2007.08.053 | |||
| 3793 | 205667 | None | 50 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 45039617 | 205667 | None | 50 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| CHEMBL64391 | 205667 | None | 50 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 704 | 11 | 0 | 12 | 5.6 | CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O | 10.1021/jm301749y | |||
| 14969540 | 100862 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 362 | 3 | 0 | 2 | 3.8 | CCc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| CHEMBL293184 | 100862 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 362 | 3 | 0 | 2 | 3.8 | CCc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| CHEMBL2112249 | 211695 | None | 2 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 11764710 | 116503 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 638 | 11 | 4 | 6 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL336082 | 116503 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 638 | 11 | 4 | 6 | 2.3 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)Cc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 5099582 | 110569 | None | 6 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 322 | 3 | 1 | 2 | 3.9 | CC(C)C(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL324935 | 110569 | None | 6 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 322 | 3 | 1 | 2 | 3.9 | CC(C)C(=O)Nc1ccc(C(=O)N2CCCc3ccccc32)cc1 | 10.1021/jm960133o | |||
| CHEMBL52813 | 218195 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | -23 | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O | 10.1021/jm00099a019 | |||||
| 10741034 | 13941 | None | 0 | Rat | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 424 | 3 | 1 | 2 | 5.8 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cc(Cl)cc(Cl)c1 | 10.1021/jm960133o | |||
| CHEMBL119651 | 13941 | None | 0 | Rat | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 424 | 3 | 1 | 2 | 5.8 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1cc(Cl)cc(Cl)c1 | 10.1021/jm960133o | |||
| 14969542 | 203008 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 390 | 5 | 0 | 2 | 4.6 | CCCCc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| CHEMBL59900 | 203008 | None | 0 | Rat | Binding | pIC50 | = | 4.1 | 4.1 | - | 0 | ChEMBL | 390 | 5 | 0 | 2 | 4.6 | CCCCc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1 | 10.1021/jm00066a010 | |||
| 44273417 | 99561 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 555 | 7 | 0 | 5 | 4.0 | CCN(CC)[C@H]1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL283317 | 99561 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 555 | 7 | 0 | 5 | 4.0 | CCN(CC)[C@H]1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 10370127 | 18878 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 542 | 6 | 2 | 5 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CN1CC[C@H](N)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128228 | 18878 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 542 | 6 | 2 | 5 | 2.2 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CN1CC[C@H](N)C1=O)C2 | 10.1021/jm00077a002 | |||
| 44352796 | 21483 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 510 | 6 | 1 | 3 | 7.5 | O=C(Nc1ccc(C(=O)N2CCC(CCF)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| CHEMBL131566 | 21483 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 510 | 6 | 1 | 3 | 7.5 | O=C(Nc1ccc(C(=O)N2CCC(CCF)Sc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2003.08.051 | |||
| 15307967 | 102346 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 432 | 3 | 1 | 2 | 6.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL303376 | 102346 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 432 | 3 | 1 | 2 | 6.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2c3ccccc3CCc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 15307988 | 206820 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 450 | 3 | 1 | 3 | 6.6 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Sc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| CHEMBL71712 | 206820 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 450 | 3 | 1 | 3 | 6.6 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Sc3ccccc32)cc1 | 10.1016/s0960-894x(03)00388-3 | |||
| 10393977 | 168624 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 611 | 10 | 3 | 5 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)N(CCC(=O)O)CCc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| CHEMBL435409 | 168624 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 611 | 10 | 3 | 5 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)N(CCC(=O)O)CCc1c[nH]cn1)C2 | 10.1021/jm00077a002 | |||
| 44273459 | 73953 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 482 | 4 | 0 | 4 | 3.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C=CC1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL20205 | 73953 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 482 | 4 | 0 | 4 | 3.4 | CC1(C)C2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)C=CC1=O)C2 | 10.1016/0960-894X(94)00469-V | |||
| 10030575 | 22126 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 554 | 5 | 2 | 4 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)NC1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| CHEMBL132210 | 22126 | None | 0 | Rat | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 554 | 5 | 2 | 4 | 3.9 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)NC1CN3CCC1CC3)C2 | 10.1021/jm00077a002 | |||
| 44273355 | 74973 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 587 | 8 | 0 | 6 | 3.9 | CN(C)CCSC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| CHEMBL20319 | 74973 | None | 0 | Rat | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 587 | 8 | 0 | 6 | 3.9 | CN(C)CCSC1CC(=O)N([C@H]2CC3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O | 10.1016/0960-894X(94)00469-V | |||
| 10043741 | 118245 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm020133q | |||
| CHEMBL340893 | 118245 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm020133q | |||
| 56848489 | 144970 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 637 | 11 | 3 | 8 | 4.0 | CCNC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| CHEMBL3909988 | 144970 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 637 | 11 | 3 | 8 | 4.0 | CCNC(=O)OCC(CNC(=O)Cn1nc(-c2ccc(Cl)cc2)n(C[C@H](O)C(F)(F)F)c1=O)c1cccc(C(F)(F)F)c1 | nan | |||
| 15307998 | 101151 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 438 | 3 | 1 | 3 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccsc3Cc3ccccc32)cc1 | 10.1016/s0960-894x(99)00278-4 | |||
| CHEMBL295014 | 101151 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 438 | 3 | 1 | 3 | 6.1 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2Cc3ccsc3Cc3ccccc32)cc1 | 10.1016/s0960-894x(99)00278-4 | |||
| 10043741 | 118245 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| CHEMBL340893 | 118245 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.9 | O=C(c1ccc(N2CCCC2)cc1Cl)N1CCCCc2ccccc21 | 10.1021/jm000108p | |||
| 11158261 | 129718 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 692 | 12 | 1 | 6 | 8.1 | CCN(CC)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| CHEMBL367323 | 129718 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 692 | 12 | 1 | 6 | 8.1 | CCN(CC)C1CCN(C(=O)CCCOc2cc(C(=O)N3CCCCc4sccc43)ccc2NC(=O)c2ccccc2-c2ccccc2)CC1 | 10.1021/jm030287l | |||
| 44376291 | 97147 | None | 0 | Pig | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1115 | 19 | 14 | 17 | -4.8 | NC(=O)CC[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSSC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1016/S0960-894X(97)00050-4 | |||
| CHEMBL267405 | 97147 | None | 0 | Pig | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1115 | 19 | 14 | 17 | -4.8 | NC(=O)CC[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSSC[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1016/S0960-894X(97)00050-4 | |||
| 9888109 | 74380 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 415 | 2 | 1 | 5 | 5.1 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL202447 | 74380 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 415 | 2 | 1 | 5 | 5.1 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL2112249 | 211695 | None | 2 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00099a019 | |||||
| 11261339 | 154710 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CCC3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| CHEMBL399289 | 154710 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 548 | 5 | 2 | 4 | 6.1 | COc1cc(C(=O)N2CCC3(C=C(C(=O)O)CC3)Cc3ccccc32)ccc1NC(=O)c1cc(F)ccc1Cl | 10.1016/j.bmcl.2007.09.059 | |||
| 44352371 | 21332 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 593 | 9 | 3 | 7 | 1.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C(N)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL131388 | 21332 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 593 | 9 | 3 | 7 | 1.8 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(CNC(=O)C(N)CCS(C)(=O)=O)C2 | 10.1021/jm00077a002 | |||
| 10345259 | 117021 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 484 | 4 | 0 | 3 | 4.5 | CC1CCC(=O)N1[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| CHEMBL338635 | 117021 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 484 | 4 | 0 | 3 | 4.5 | CC1CCC(=O)N1[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C | 10.1021/jm00077a002 | |||
| 9887157 | 73968 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 399 | 2 | 1 | 5 | 4.6 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(F)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| CHEMBL202106 | 73968 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 399 | 2 | 1 | 5 | 4.6 | Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Nc4ccccc43)c(F)c2)n1 | 10.1016/j.bmcl.2005.10.107 | |||
| 10370697 | 118451 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 565 | 6 | 1 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| CHEMBL341049 | 118451 | None | 0 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 565 | 6 | 1 | 5 | 3.7 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](N1C(=O)CN(Cc3c[nH]cn3)C1=O)C2 | 10.1021/jm00077a002 | |||
| 10098332 | 22455 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 524 | 6 | 1 | 5 | 3.6 | Cn1cnc(CC(=O)N[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| CHEMBL132496 | 22455 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 524 | 6 | 1 | 5 | 3.6 | Cn1cnc(CC(=O)N[C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)c1 | 10.1021/jm00077a002 | |||
| 10599903 | 14576 | None | 0 | Rat | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 456 | 4 | 3 | 3 | 4.7 | CNC(=O)NC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| CHEMBL120449 | 14576 | None | 0 | Rat | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 456 | 4 | 3 | 3 | 4.7 | CNC(=O)NC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc21 | 10.1021/jm960133o | |||
| 22405327 | 140363 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 409 | 3 | 0 | 4 | 5.3 | O=C(c1ccc(-c2ccccc2[N+](=O)[O-])cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| CHEMBL380579 | 140363 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 409 | 3 | 0 | 4 | 5.3 | O=C(c1ccc(-c2ccccc2[N+](=O)[O-])cc1)N1Cc2cccn2Cc2ccccc21 | 10.1016/j.bmcl.2005.08.007 | |||
| 10435004 | 18895 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 473 | 6 | 2 | 4 | 3.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CCN)C2 | 10.1021/jm00077a002 | |||
| CHEMBL128328 | 18895 | None | 0 | Rat | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 473 | 6 | 2 | 4 | 3.0 | CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CCN)C2 | 10.1021/jm00077a002 | |||
| 11070458 | 17794 | None | 2 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(C)NC(=O)C[C@@H]1CCCN(C(=O)c2ccc(N3CCCC3)cc2Cl)c2ccccc21 | 10.1021/jm020133q | |||
| CHEMBL125878 | 17794 | None | 2 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 453 | 5 | 1 | 3 | 5.4 | CC(C)NC(=O)C[C@@H]1CCCN(C(=O)c2ccc(N3CCCC3)cc2Cl)c2ccccc21 | 10.1021/jm020133q | |||
| 10642000 | 114456 | None | 7 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 356 | 3 | 1 | 2 | 4.5 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccccc1 | 10.1021/jm960133o | |||
| CHEMBL333139 | 114456 | None | 7 | Rat | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 356 | 3 | 1 | 2 | 4.5 | O=C(Nc1ccc(C(=O)N2CCCc3ccccc32)cc1)c1ccccc1 | 10.1021/jm960133o | |||
| 71457081 | 82407 | None | 0 | Human | Binding | pKd | = | 8.9 | 8.9 | 64 | 3 | ChEMBL | 1309 | 24 | 5 | 14 | 10.2 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 71482251 | 82407 | None | 0 | Human | Binding | pKd | = | 8.9 | 8.9 | 64 | 3 | ChEMBL | 1309 | 24 | 5 | 14 | 10.2 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| CHEMBL2172289 | 82407 | None | 0 | Human | Binding | pKd | = | 8.9 | 8.9 | 64 | 3 | ChEMBL | 1309 | 24 | 5 | 14 | 10.2 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 44386183 | 156185 | None | 0 | Bovine | Binding | pKd | = | 8.9 | 8.9 | - | 1 | ChEMBL | 1013 | 18 | 12 | 14 | -3.5 | CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00151a016 | |||
| CHEMBL406303 | 156185 | None | 0 | Bovine | Binding | pKd | = | 8.9 | 8.9 | - | 1 | ChEMBL | 1013 | 18 | 12 | 14 | -3.5 | CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00151a016 | |||
| 2168 | 3976 | None | 29 | Rat | Binding | pKd | = | 8.8 | 8.8 | -4 | 9 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(99)00041-4 | |||||
| 2810 | 3976 | None | 29 | Rat | Binding | pKd | = | 8.8 | 8.8 | -4 | 9 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(99)00041-4 | |||||
| 644077 | 3976 | None | 29 | Rat | Binding | pKd | = | 8.8 | 8.8 | -4 | 9 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(99)00041-4 | |||||
| 644077.0 | 3976 | None | 29 | Rat | Binding | pKd | = | 8.8 | 8.8 | -4 | 9 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(99)00041-4 | |||||
| CHEMBL373742 | 3976 | None | 29 | Rat | Binding | pKd | = | 8.8 | 8.8 | -4 | 9 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(99)00041-4 | |||||
| DB00067 | 3976 | None | 29 | Rat | Binding | pKd | = | 8.8 | 8.8 | -4 | 9 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(99)00041-4 | |||||
| 2168 | 3976 | None | 29 | Bovine | Binding | pKd | = | 8.8 | 8.8 | -7 | 9 | ChEMBL | None | None | None | None | 10.1021/jm00028a008 | |||||
| 2810 | 3976 | None | 29 | Bovine | Binding | pKd | = | 8.8 | 8.8 | -7 | 9 | ChEMBL | None | None | None | None | 10.1021/jm00028a008 | |||||
| 644077 | 3976 | None | 29 | Bovine | Binding | pKd | = | 8.8 | 8.8 | -7 | 9 | ChEMBL | None | None | None | None | 10.1021/jm00028a008 | |||||
| 644077.0 | 3976 | None | 29 | Bovine | Binding | pKd | = | 8.8 | 8.8 | -7 | 9 | ChEMBL | None | None | None | None | 10.1021/jm00028a008 | |||||
| CHEMBL373742 | 3976 | None | 29 | Bovine | Binding | pKd | = | 8.8 | 8.8 | -7 | 9 | ChEMBL | None | None | None | None | 10.1021/jm00028a008 | |||||
| DB00067 | 3976 | None | 29 | Bovine | Binding | pKd | = | 8.8 | 8.8 | -7 | 9 | ChEMBL | None | None | None | None | 10.1021/jm00028a008 | |||||
| CHEMBL265119 | 213095 | None | 0 | Bovine | Binding | pKd | = | 8 | 8.0 | - | 1 | ChEMBL | None | None | None | CN(CC(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||||
| 71461726 | 79723 | None | 0 | Pig | Binding | pKd | = | 7 | 7.0 | -257 | 2 | ChEMBL | 1186 | 20 | 11 | 15 | 0.9 | COc1ccc(C[C@@H]2NC(=O)C3(CCCC3)CSSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc3ccc(O)cc3)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00079a020 | |||
| CHEMBL2115369 | 79723 | None | 0 | Pig | Binding | pKd | = | 7 | 7.0 | -257 | 2 | ChEMBL | 1186 | 20 | 11 | 15 | 0.9 | COc1ccc(C[C@@H]2NC(=O)C3(CCCC3)CSSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc3ccc(O)cc3)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00079a020 | |||
| 118718752 | 115455 | None | 0 | Rat | Binding | pKd | = | 6 | 6.0 | -26 | 3 | ChEMBL | 1136 | 18 | 11 | 14 | -0.5 | CCN1C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]1Cc1ccc(O)cc1 | 10.1021/jm00010a020 | |||
| CHEMBL3350124 | 115455 | None | 0 | Rat | Binding | pKd | = | 6 | 6.0 | -26 | 3 | ChEMBL | 1136 | 18 | 11 | 14 | -0.5 | CCN1C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]1Cc1ccc(O)cc1 | 10.1021/jm00010a020 | |||
| 71451749 | 82406 | None | 0 | Human | Binding | pKd | = | 8.0 | 8.0 | 38 | 2 | ChEMBL | 1205 | 25 | 7 | 15 | 9.2 | O=C(CCC(=O)NC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc21)NCc1cn(CCOCCOCCOCCNC(=S)Nc2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)nn1 | 10.1021/jm3006146 | |||
| CHEMBL2172288 | 82406 | None | 0 | Human | Binding | pKd | = | 8.0 | 8.0 | 38 | 2 | ChEMBL | 1205 | 25 | 7 | 15 | 9.2 | O=C(CCC(=O)NC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc21)NCc1cn(CCOCCOCCOCCNC(=S)Nc2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)nn1 | 10.1021/jm3006146 | |||
| CHEMBL413706 | 215542 | None | 0 | Bovine | Binding | pKd | = | 7.0 | 7.0 | - | 1 | ChEMBL | None | None | None | C[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)N(C)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||||
| 118718753 | 115457 | None | 0 | Rat | Binding | pKd | = | 5.9 | 5.9 | -43 | 3 | ChEMBL | 1074 | 18 | 11 | 15 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00010a020 | |||
| CHEMBL3350126 | 115457 | None | 0 | Rat | Binding | pKd | = | 5.9 | 5.9 | -43 | 3 | ChEMBL | 1074 | 18 | 11 | 15 | -1.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00010a020 | |||
| 44320759 | 160869 | None | 0 | Bovine | Binding | pKd | = | 6.9 | 6.9 | -8 | 2 | ChEMBL | 1036 | 22 | 12 | 15 | -4.4 | CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm00028a008 | |||
| CHEMBL411420 | 160869 | None | 0 | Bovine | Binding | pKd | = | 6.9 | 6.9 | -8 | 2 | ChEMBL | 1036 | 22 | 12 | 15 | -4.4 | CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm00028a008 | |||
| 136961687 | 118656 | None | 0 | Human | Binding | pKd | = | 6.9 | 6.9 | -77 | 3 | ChEMBL | 1053 | 21 | 7 | 12 | 6.4 | O=C(CCCCCNC(=O)c1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1)NCCNC(=O)CCc1ccc(S(=O)(=O)N(CC(=O)N/N=C2\C(=O)Nc3ccccc32)c2ccc(Cl)cc2)cc1 | 10.1021/jm501395b | |||
| CHEMBL3416749 | 118656 | None | 0 | Human | Binding | pKd | = | 6.9 | 6.9 | -77 | 3 | ChEMBL | 1053 | 21 | 7 | 12 | 6.4 | O=C(CCCCCNC(=O)c1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1)NCCNC(=O)CCc1ccc(S(=O)(=O)N(CC(=O)N/N=C2\C(=O)Nc3ccccc32)c2ccc(Cl)cc2)cc1 | 10.1021/jm501395b | |||
| CHEMBL2370617 | 212346 | None | 0 | Rat | Binding | pKd | = | 7.8 | 7.8 | -3 | 3 | ChEMBL | None | None | None | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00010a020 | |||||
| 56678404 | 63350 | None | 0 | Bovine | Binding | pKd | = | 6.7 | 6.7 | 1 | 2 | ChEMBL | 1060 | 20 | 12 | 14 | -3.1 | CC[C@H](C)[C@@H]1NC(=O)CC2(CCCCC2)SSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm00028a008 | |||
| CHEMBL1793955 | 63350 | None | 0 | Bovine | Binding | pKd | = | 6.7 | 6.7 | 1 | 2 | ChEMBL | 1060 | 20 | 12 | 14 | -3.1 | CC[C@H](C)[C@@H]1NC(=O)CC2(CCCCC2)SSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm00028a008 | |||
| 71455302 | 82408 | None | 0 | Human | Binding | pKd | = | 8.6 | 8.6 | 234 | 3 | ChEMBL | 1441 | 33 | 5 | 17 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 71482380 | 82408 | None | 0 | Human | Binding | pKd | = | 8.6 | 8.6 | 234 | 3 | ChEMBL | 1441 | 33 | 5 | 17 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| CHEMBL2172290 | 82408 | None | 0 | Human | Binding | pKd | = | 8.6 | 8.6 | 234 | 3 | ChEMBL | 1441 | 33 | 5 | 17 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 71462477 | 82409 | None | 0 | Human | Binding | pKd | = | 8.6 | 8.6 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 71482382 | 82409 | None | 0 | Human | Binding | pKd | = | 8.6 | 8.6 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| CHEMBL2172291 | 82409 | None | 0 | Human | Binding | pKd | = | 8.6 | 8.6 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| CHEMBL269715 | 213261 | None | 0 | Bovine | Binding | pKd | = | 7.7 | 7.7 | - | 1 | ChEMBL | None | None | None | C[C@H](C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)N(C)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||||
| 70693557 | 78387 | None | 0 | Rat | Binding | pKd | = | 5.6 | 5.6 | -6 | 2 | ChEMBL | 1018 | 18 | 12 | 14 | -4.5 | CC[C@H](C)[C@H]1NC(=O)[C@@]2(CCc3ccccc3C2)NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| CHEMBL2110163 | 78387 | None | 0 | Rat | Binding | pKd | = | 5.6 | 5.6 | -6 | 2 | ChEMBL | 1018 | 18 | 12 | 14 | -4.5 | CC[C@H](C)[C@H]1NC(=O)[C@@]2(CCc3ccccc3C2)NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| 44320761 | 141554 | None | 0 | Bovine | Binding | pKd | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 1110 | 20 | 13 | 15 | -3.2 | CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC2(CCCCC2)CC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00028a008 | |||
| CHEMBL384292 | 141554 | None | 0 | Bovine | Binding | pKd | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 1110 | 20 | 13 | 15 | -3.2 | CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC2(CCCCC2)CC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00028a008 | |||
| 44321207 | 96897 | None | 0 | Bovine | Binding | pKd | = | 6.6 | 6.6 | - | 1 | ChEMBL | 1110 | 20 | 13 | 15 | -3.2 | CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@H]1CSSC2(CCCCC2)CC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00028a008 | |||
| CHEMBL265264 | 96897 | None | 0 | Bovine | Binding | pKd | = | 6.6 | 6.6 | - | 1 | ChEMBL | 1110 | 20 | 13 | 15 | -3.2 | CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@H]1CSSC2(CCCCC2)CC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00028a008 | |||
| CHEMBL2370976 | 212431 | None | 10 | Rat | Binding | pKd | = | 7.6 | 7.6 | -3 | 3 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00010a020 | |||||
| 118718751 | 115454 | None | 0 | Rat | Binding | pKd | = | 5.5 | 5.5 | -213 | 3 | ChEMBL | 1151 | 19 | 12 | 15 | -2.3 | CN1C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]1Cc1ccc(O)cc1 | 10.1021/jm00010a020 | |||
| CHEMBL3350123 | 115454 | None | 0 | Rat | Binding | pKd | = | 5.5 | 5.5 | -213 | 3 | ChEMBL | 1151 | 19 | 12 | 15 | -2.3 | CN1C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]1Cc1ccc(O)cc1 | 10.1021/jm00010a020 | |||
| 44320718 | 168997 | None | 0 | Bovine | Binding | pKd | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 1139 | 22 | 12 | 15 | -2.5 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00028a008 | |||
| CHEMBL438387 | 168997 | None | 0 | Bovine | Binding | pKd | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 1139 | 22 | 12 | 15 | -2.5 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00028a008 | |||
| 44373714 | 96771 | None | 0 | Rat | Binding | pKd | = | 8.5 | 8.5 | 1 | 2 | ChEMBL | 1148 | 32 | 14 | 16 | -3.1 | CC[C@H](C)[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(=O)oc2cc(OC)ccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)O | 10.1016/s0960-894x(99)00041-4 | |||
| CHEMBL264208 | 96771 | None | 0 | Rat | Binding | pKd | = | 8.5 | 8.5 | 1 | 2 | ChEMBL | 1148 | 32 | 14 | 16 | -3.1 | CC[C@H](C)[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(=O)oc2cc(OC)ccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)O | 10.1016/s0960-894x(99)00041-4 | |||
| 136961688 | 118657 | None | 0 | Human | Binding | pKd | = | 7.5 | 7.5 | -21 | 3 | ChEMBL | 1206 | 23 | 5 | 13 | 7.4 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCNC(=O)CCc2ccc(S(=O)(=O)N(CC(=O)N/N=C3\C(=O)Nc4ccccc43)c3ccc(Cl)cc3)cc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| CHEMBL3416750 | 118657 | None | 0 | Human | Binding | pKd | = | 7.5 | 7.5 | -21 | 3 | ChEMBL | 1206 | 23 | 5 | 13 | 7.4 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCNC(=O)CCc2ccc(S(=O)(=O)N(CC(=O)N/N=C3\C(=O)Nc4ccccc43)c3ccc(Cl)cc3)cc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| 44321133 | 161929 | None | 0 | Bovine | Binding | pKd | = | 6.5 | 6.5 | -38 | 2 | ChEMBL | 1060 | 20 | 12 | 14 | -3.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00028a008 | |||
| CHEMBL414582 | 161929 | None | 0 | Bovine | Binding | pKd | = | 6.5 | 6.5 | -38 | 2 | ChEMBL | 1060 | 20 | 12 | 14 | -3.1 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00028a008 | |||
| 118718383 | 115409 | None | 0 | Rat | Binding | pKd | = | 5.5 | 5.5 | -173 | 3 | ChEMBL | 1000 | 14 | 11 | 13 | 0.2 | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2cc3ccccc3[nH]2)NC(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| CHEMBL3349464 | 115409 | None | 0 | Rat | Binding | pKd | = | 5.5 | 5.5 | -173 | 3 | ChEMBL | 1000 | 14 | 11 | 13 | 0.2 | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2cc3ccccc3[nH]2)NC(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| 118718384 | 115410 | None | 0 | Rat | Binding | pKd | = | 5.5 | 5.5 | -154 | 3 | ChEMBL | 1154 | 18 | 12 | 16 | -0.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| CHEMBL3349465 | 115410 | None | 0 | Rat | Binding | pKd | = | 5.5 | 5.5 | -154 | 3 | ChEMBL | 1154 | 18 | 12 | 16 | -0.4 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| 10463677 | 115413 | None | 1 | Rat | Binding | pKd | = | 5.5 | 5.5 | -363 | 3 | ChEMBL | 991 | 15 | 10 | 14 | -0.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CC2(CCCCC2)SSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| CHEMBL3349468 | 115413 | None | 1 | Rat | Binding | pKd | = | 5.5 | 5.5 | -363 | 3 | ChEMBL | 991 | 15 | 10 | 14 | -0.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CC2(CCCCC2)SSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| 44386245 | 168908 | None | 0 | Bovine | Binding | pKd | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1027 | 18 | 12 | 14 | -3.1 | CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(C)[C@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00151a016 | |||
| CHEMBL437631 | 168908 | None | 0 | Bovine | Binding | pKd | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1027 | 18 | 12 | 14 | -3.1 | CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(C)[C@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00151a016 | |||
| 44321188 | 162000 | None | 0 | Bovine | Binding | pKd | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 1105 | 22 | 12 | 15 | -2.7 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm00028a008 | |||
| CHEMBL415230 | 162000 | None | 0 | Bovine | Binding | pKd | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 1105 | 22 | 12 | 15 | -2.7 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1 | 10.1021/jm00028a008 | |||
| 145947801 | 167815 | None | 0 | Human | Binding | pKd | = | 6.5 | 6.5 | -190 | 2 | ChEMBL | 1381 | 42 | 2 | 22 | 7.7 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCc2nnc(N3CC(Oc4ccc(F)cc4Cl)C3)n2-c2ccc(OC)nc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| CHEMBL3416754 | 167815 | None | 0 | Human | Binding | pKd | = | 6.5 | 6.5 | -190 | 2 | ChEMBL | 1381 | 42 | 2 | 22 | 7.7 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCc2nnc(N3CC(Oc4ccc(F)cc4Cl)C3)n2-c2ccc(OC)nc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| CHEMBL4302530 | 167815 | None | 0 | Human | Binding | pKd | = | 6.5 | 6.5 | -190 | 2 | ChEMBL | 1381 | 42 | 2 | 22 | 7.7 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCc2nnc(N3CC(Oc4ccc(F)cc4Cl)C3)n2-c2ccc(OC)nc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| 118718386 | 115412 | None | 0 | Rat | Binding | pKd | = | 5.4 | 5.4 | -186 | 3 | ChEMBL | 991 | 14 | 10 | 14 | -0.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| CHEMBL3349467 | 115412 | None | 0 | Rat | Binding | pKd | = | 5.4 | 5.4 | -186 | 3 | ChEMBL | 991 | 14 | 10 | 14 | -0.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC1=O | 10.1021/jm00010a020 | |||
| 44373744 | 51188 | None | 0 | Rat | Binding | pKd | = | 6.4 | 6.4 | -52 | 2 | ChEMBL | 993 | 20 | 12 | 14 | -4.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| CHEMBL157988 | 51188 | None | 0 | Rat | Binding | pKd | = | 6.4 | 6.4 | -52 | 2 | ChEMBL | 993 | 20 | 12 | 14 | -4.2 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| 44320760 | 208843 | None | 0 | Bovine | Binding | pKd | = | 6.4 | 6.4 | -52 | 2 | ChEMBL | 992 | 20 | 12 | 14 | -4.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00028a008 | |||
| CHEMBL87636 | 208843 | None | 0 | Bovine | Binding | pKd | = | 6.4 | 6.4 | -52 | 2 | ChEMBL | 992 | 20 | 12 | 14 | -4.8 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00028a008 | |||
| CHEMBL410025 | 215256 | None | 0 | Bovine | Binding | pKd | = | 7.4 | 7.4 | - | 1 | ChEMBL | None | None | None | CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||||
| 118718749 | 115452 | None | 0 | Rat | Binding | pKd | = | 7.3 | 7.3 | -5 | 3 | ChEMBL | 1136 | 18 | 11 | 14 | -0.5 | CCN1C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]1Cc1ccc(O)cc1 | 10.1021/jm00010a020 | |||
| CHEMBL3350119 | 115452 | None | 0 | Rat | Binding | pKd | = | 7.3 | 7.3 | -5 | 3 | ChEMBL | 1136 | 18 | 11 | 14 | -0.5 | CCN1C(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]1Cc1ccc(O)cc1 | 10.1021/jm00010a020 | |||
| 44373715 | 155791 | None | 0 | Rat | Binding | pKd | = | 5.3 | 5.3 | -131 | 2 | ChEMBL | 1031 | 20 | 13 | 14 | -4.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CCSSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| CHEMBL405165 | 155791 | None | 0 | Rat | Binding | pKd | = | 5.3 | 5.3 | -131 | 2 | ChEMBL | 1031 | 20 | 13 | 14 | -4.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CCSSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| 145947419 | 167757 | None | 0 | Human | Binding | pKd | = | 6.3 | 6.3 | -323 | 2 | ChEMBL | 1204 | 30 | 2 | 18 | 7.6 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCc2nnc(N3CC(Oc4ccc(F)cc4Cl)C3)n2-c2ccc(OC)nc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| CHEMBL3416753 | 167757 | None | 0 | Human | Binding | pKd | = | 6.3 | 6.3 | -323 | 2 | ChEMBL | 1204 | 30 | 2 | 18 | 7.6 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCc2nnc(N3CC(Oc4ccc(F)cc4Cl)C3)n2-c2ccc(OC)nc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| CHEMBL4301807 | 167757 | None | 0 | Human | Binding | pKd | = | 6.3 | 6.3 | -323 | 2 | ChEMBL | 1204 | 30 | 2 | 18 | 7.6 | CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3cc(S(=O)(=O)[O-])ccc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCc2nnc(N3CC(Oc4ccc(F)cc4Cl)C3)n2-c2ccc(OC)nc2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm501395b | |||
| 44385836 | 160792 | None | 0 | Bovine | Binding | pKd | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1056 | 20 | 13 | 15 | -4.5 | C[C@H](C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)N(C)C(=O)[C@@H]1CSSCCC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||
| CHEMBL411357 | 160792 | None | 0 | Bovine | Binding | pKd | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1056 | 20 | 13 | 15 | -4.5 | C[C@H](C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)N(C)C(=O)[C@@H]1CSSCCC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||
| 70693566 | 78401 | None | 0 | Rat | Binding | pKd | = | 5.3 | 5.3 | -2 | 2 | ChEMBL | 1018 | 18 | 12 | 14 | -4.5 | CC[C@H](C)[C@H]1NC(=O)[C@]2(CCc3ccccc3C2)NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| CHEMBL2110297 | 78401 | None | 0 | Rat | Binding | pKd | = | 5.3 | 5.3 | -2 | 2 | ChEMBL | 1018 | 18 | 12 | 14 | -4.5 | CC[C@H](C)[C@H]1NC(=O)[C@]2(CCc3ccccc3C2)NC(=O)CCSSC[C@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1016/s0960-894x(99)00041-4 | |||
| 10011419 | 115456 | None | 0 | Rat | Binding | pKd | = | 7.3 | 7.3 | -2 | 3 | ChEMBL | 1092 | 17 | 11 | 13 | -1.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00010a020 | |||
| CHEMBL3350125 | 115456 | None | 0 | Rat | Binding | pKd | = | 7.3 | 7.3 | -2 | 3 | ChEMBL | 1092 | 17 | 11 | 13 | -1.0 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00010a020 | |||
| 44294474 | 97065 | None | 0 | Rat | Binding | pKd | = | 8.1 | 8.1 | 1 | 3 | ChEMBL | 1092 | 17 | 11 | 13 | -1.0 | CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC1=O | 10.1021/jm00010a020 | |||
| CHEMBL266643 | 97065 | None | 0 | Rat | Binding | pKd | = | 8.1 | 8.1 | 1 | 3 | ChEMBL | 1092 | 17 | 11 | 13 | -1.0 | CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)CC2(CCCCC2)SSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC1=O | 10.1021/jm00010a020 | |||
| 44386247 | 161778 | None | 0 | Bovine | Binding | pKd | = | 8.1 | 8.1 | - | 1 | ChEMBL | 1042 | 20 | 13 | 15 | -4.9 | CN(CC(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||
| CHEMBL413249 | 161778 | None | 0 | Bovine | Binding | pKd | = | 8.1 | 8.1 | - | 1 | ChEMBL | 1042 | 20 | 13 | 15 | -4.9 | CN(CC(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSCCC(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00151a016 | |||
| 44321134 | 112625 | None | 0 | Bovine | Binding | pKd | = | 6.1 | 6.1 | -45 | 2 | ChEMBL | 963 | 16 | 9 | 14 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCSSC[C@H](C(=O)N2CCC[C@H]2C(=O)N(C)CC(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00028a008 | |||
| CHEMBL330022 | 112625 | None | 0 | Bovine | Binding | pKd | = | 6.1 | 6.1 | -45 | 2 | ChEMBL | 963 | 16 | 9 | 14 | -3.3 | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCSSC[C@H](C(=O)N2CCC[C@H]2C(=O)N(C)CC(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm00028a008 | |||
| CHEMBL217517 | 211835 | None | 0 | Bovine | Binding | pKd | = | 8.0 | 8.0 | - | 1 | ChEMBL | None | None | None | CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)CSSC[C@@H](C(=O)N(C)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00151a016 | |||||
| CHEMBL2371674 | 212566 | None | 0 | Bovine | Binding | pKd | = | 8.0 | 8.0 | - | 1 | ChEMBL | None | None | None | CC(C)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00151a016 | |||||
| 44321206 | 96856 | None | 0 | Bovine | Binding | pKd | = | 7.0 | 7.0 | -13 | 2 | ChEMBL | 1094 | 20 | 12 | 14 | -2.9 | CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC2(CCCCC2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00028a008 | |||
| CHEMBL265017 | 96856 | None | 0 | Bovine | Binding | pKd | = | 7.0 | 7.0 | -13 | 2 | ChEMBL | 1094 | 20 | 12 | 14 | -2.9 | CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC2(CCCCC2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm00028a008 | |||
| 44419039 | 137483 | None | 0 | Rat | Binding | pKi | = | 9.7 | 9.7 | -1 | 8 | ChEMBL | 1096 | 20 | 14 | 15 | -4.6 | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm060928n | |||
| CHEMBL375324 | 137483 | None | 0 | Rat | Binding | pKi | = | 9.7 | 9.7 | -1 | 8 | ChEMBL | 1096 | 20 | 14 | 15 | -4.6 | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm060928n | |||
| 44419026 | 168602 | None | 15 | Rat | Binding | pKi | = | 9.6 | 9.6 | 1230 | 2 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| CHEMBL435323 | 168602 | None | 15 | Rat | Binding | pKi | = | 9.6 | 9.6 | 1230 | 2 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| 2181 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.5 | 9.5 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 2182 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.5 | 9.5 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 27991 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.5 | 9.5 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 27991.0 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.5 | 9.5 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| CHEMBL1429 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.5 | 9.5 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| CHEMBL264448 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.5 | 9.5 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| DB00035 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.5 | 9.5 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 44419025 | 84330 | None | 0 | Rat | Binding | pKi | = | 9.5 | 9.5 | -1 | 8 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| CHEMBL221436 | 84330 | None | 0 | Rat | Binding | pKi | = | 9.5 | 9.5 | -1 | 8 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| 151171 | 1164 | None | 41 | Human | Binding | pKi | = | 9.4 | 9.4 | -1 | 6 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 151171.0 | 1164 | None | 41 | Human | Binding | pKi | = | 9.4 | 9.4 | -1 | 6 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 216322 | 1164 | None | 41 | Human | Binding | pKi | = | 9.4 | 9.4 | -1 | 6 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 2203 | 1164 | None | 41 | Human | Binding | pKi | = | 9.4 | 9.4 | -1 | 6 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 732 | 1164 | None | 41 | Human | Binding | pKi | = | 9.4 | 9.4 | -1 | 6 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1755 | 1164 | None | 41 | Human | Binding | pKi | = | 9.4 | 9.4 | -1 | 6 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| DB00872 | 1164 | None | 41 | Human | Binding | pKi | = | 9.4 | 9.4 | -1 | 6 | ChEMBL | 498 | 4 | 2 | 3 | 6.5 | Cc1[nH]c2c(n1)c1ccccc1N(CC2)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 44520886 | 188927 | None | 0 | Rat | Binding | pKi | = | 9.4 | 9.4 | - | 1 | ChEMBL | 628 | 7 | 2 | 4 | 7.4 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL506235 | 188927 | None | 0 | Rat | Binding | pKi | = | 9.4 | 9.4 | - | 1 | ChEMBL | 628 | 7 | 2 | 4 | 7.4 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 216237 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| 216237.0 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| 2226 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| 4110 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| 443894 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| 443894.0 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| CHEMBL344159 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| DB06212 | 3843 | None | 51 | Human | Binding | pKi | = | 9.4 | 9.4 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/jm000108p | |||
| 2168 | 3976 | None | 29 | Rat | Binding | pKi | = | 9.4 | 9.4 | -4 | 9 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 2810 | 3976 | None | 29 | Rat | Binding | pKi | = | 9.4 | 9.4 | -4 | 9 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 644077 | 3976 | None | 29 | Rat | Binding | pKi | = | 9.4 | 9.4 | -4 | 9 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 644077.0 | 3976 | None | 29 | Rat | Binding | pKi | = | 9.4 | 9.4 | -4 | 9 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| CHEMBL373742 | 3976 | None | 29 | Rat | Binding | pKi | = | 9.4 | 9.4 | -4 | 9 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| DB00067 | 3976 | None | 29 | Rat | Binding | pKi | = | 9.4 | 9.4 | -4 | 9 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| CHEMBL2371605 | 212564 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | - | 1 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||||
| 10411308 | 203691 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL603708 | 203691 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.8b00697 | |||
| 10411308 | 203691 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm3006146 | |||
| CHEMBL603708 | 203691 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm3006146 | |||
| 10411308 | 203691 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm901084f | |||
| CHEMBL603708 | 203691 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 2 | 3 | ChEMBL | 446 | 4 | 1 | 2 | 6.6 | O=C(Nc1ccc(C(=O)N2CCCCc3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/jm901084f | |||
| 121301508 | 176323 | None | 5 | Human | Binding | pKi | = | 9.2 | 9.2 | 1 | 3 | ChEMBL | 542 | 7 | 2 | 9 | 3.6 | C[C@H](O)c1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nn1-c1cccc(Cl)c1 | 10.6019/CHEMBL5463729 | |||
| CHEMBL4594444 | 176323 | None | 5 | Human | Binding | pKi | = | 9.2 | 9.2 | 1 | 3 | ChEMBL | 542 | 7 | 2 | 9 | 3.6 | C[C@H](O)c1nc(Cn2nc(-c3ccc(Cl)cc3)n(C[C@H](O)C(F)(F)F)c2=O)nn1-c1cccc(Cl)c1 | 10.6019/CHEMBL5463729 | |||
| 135413562 | 2205 | None | 13 | Human | Binding | pKi | = | 9.2 | 9.2 | -1 | 5 | ChEMBL | 624 | 14 | 3 | 7 | 1.1 | CN(CCCNC(=O)CCc1ccc(cc1)S(=O)(=O)N(c1ccc(cc1)Cl)CC(=O)NNC1=c2ccccc2=NC1=O)C | 10.1021/jm901812z | |||
| 2194 | 2205 | None | 13 | Human | Binding | pKi | = | 9.2 | 9.2 | -1 | 5 | ChEMBL | 624 | 14 | 3 | 7 | 1.1 | CN(CCCNC(=O)CCc1ccc(cc1)S(=O)(=O)N(c1ccc(cc1)Cl)CC(=O)NNC1=c2ccccc2=NC1=O)C | 10.1021/jm901812z | |||
| CHEMBL445816 | 2205 | None | 13 | Human | Binding | pKi | = | 9.2 | 9.2 | -1 | 5 | ChEMBL | 624 | 14 | 3 | 7 | 1.1 | CN(CCCNC(=O)CCc1ccc(cc1)S(=O)(=O)N(c1ccc(cc1)Cl)CC(=O)NNC1=c2ccccc2=NC1=O)C | 10.1021/jm901812z | |||
| CHEMBL2371604 | 212563 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | - | 1 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCC(C)CC3)SSC[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||||
| 2205 | 4123 | None | 6 | Rat | Binding | pKi | = | 9.1 | 9.1 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1021/jm010544r | |||
| 9810140 | 4123 | None | 6 | Rat | Binding | pKi | = | 9.1 | 9.1 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1021/jm010544r | |||
| CHEMBL307483 | 4123 | None | 6 | Rat | Binding | pKi | = | 9.1 | 9.1 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1021/jm010544r | |||
| 2181 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.1 | 9.1 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 2182 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.1 | 9.1 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 27991 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.1 | 9.1 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 27991.0 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.1 | 9.1 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| CHEMBL1429 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.1 | 9.1 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| CHEMBL264448 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.1 | 9.1 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| DB00035 | 1331 | None | 29 | Rat | Binding | pKi | = | 9.1 | 9.1 | 1 | 8 | ChEMBL | None | None | None | None | 10.1021/jm060928n | |||||
| 71462477 | 82409 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 71482382 | 82409 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| CHEMBL2172291 | 82409 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 2198 | 3420 | None | 2 | Human | Binding | pKi | = | 9.1 | 9.1 | 46 | 2 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | Clc1cc(ccc1C(=O)N1C[C@H]2COCCN2Cc2c1cccc2)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 9807249 | 3420 | None | 2 | Human | Binding | pKi | = | 9.1 | 9.1 | 46 | 2 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | Clc1cc(ccc1C(=O)N1C[C@H]2COCCN2Cc2c1cccc2)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL1192593 | 3420 | None | 2 | Human | Binding | pKi | = | 9.1 | 9.1 | 46 | 2 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | Clc1cc(ccc1C(=O)N1C[C@H]2COCCN2Cc2c1cccc2)NC(=O)c1ccccc1c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44382498 | 96546 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | - | 1 | ChEMBL | 1093 | 17 | 10 | 13 | 0.6 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCC(C)CC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||
| CHEMBL262482 | 96546 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | - | 1 | ChEMBL | 1093 | 17 | 10 | 13 | 0.6 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCC(C)CC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||
| 44375638 | 168951 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 6 | 2 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||
| CHEMBL438014 | 168951 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 6 | 2 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||
| CHEMBL3084974 | 213445 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | - | 1 | ChEMBL | None | None | None | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCC(C)CC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||||
| 216237 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| 216237.0 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| 2226 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| 4110 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| 443894 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| 443894.0 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| CHEMBL344159 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| DB06212 | 3843 | None | 51 | Human | Binding | pKi | = | 9 | 9.0 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.1c00863 | |||
| 44382370 | 141637 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 3 | 2 | ChEMBL | 1079 | 17 | 10 | 13 | 0.3 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||
| CHEMBL384776 | 141637 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 3 | 2 | ChEMBL | 1079 | 17 | 10 | 13 | 0.3 | CCOc1ccc(C[C@@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00124a025 | |||
| 2205 | 4123 | None | 6 | Human | Binding | pKi | = | 8.9 | 8.9 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1021/jm010544r | |||
| 9810140 | 4123 | None | 6 | Human | Binding | pKi | = | 8.9 | 8.9 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1021/jm010544r | |||
| CHEMBL307483 | 4123 | None | 6 | Human | Binding | pKi | = | 8.9 | 8.9 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1021/jm010544r | |||
| 2205 | 4123 | None | 6 | Rat | Binding | pKi | = | 8.9 | 8.9 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1016/s0960-894x(01)00723-5 | |||
| 9810140 | 4123 | None | 6 | Rat | Binding | pKi | = | 8.9 | 8.9 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1016/s0960-894x(01)00723-5 | |||
| CHEMBL307483 | 4123 | None | 6 | Rat | Binding | pKi | = | 8.9 | 8.9 | -3 | 5 | ChEMBL | 648 | 6 | 1 | 4 | 7.2 | CN(C1CCN(CC1)C(=O)/C=C\1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(cc1)NC(=O)c1ccccc1c1ccccc1)C | 10.1016/s0960-894x(01)00723-5 | |||
| 44419025 | 84330 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | -4 | 8 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||
| CHEMBL221436 | 84330 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | -4 | 8 | ChEMBL | 1039 | 17 | 13 | 14 | -2.7 | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||
| 2168 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm1016208 | |||||
| 2810 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm1016208 | |||||
| 644077 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm1016208 | |||||
| 644077.0 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm1016208 | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm1016208 | |||||
| DB00067 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm1016208 | |||||
| CHEMBL408474 | 215175 | None | 0 | Pig | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | None | None | None | NCCCC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(=O)O | 10.1021/jm00150a003 | |||||
| 2168 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| 2810 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| 644077 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| 644077.0 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| DB00067 | 3976 | None | 29 | Human | Binding | pKi | = | 8.9 | 8.9 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| 44325703 | 111466 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 75 | 2 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(O)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL327242 | 111466 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 75 | 2 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(O)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 2168 | 3976 | None | 29 | Human | Binding | pKi | = | 8.8 | 8.8 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| 2810 | 3976 | None | 29 | Human | Binding | pKi | = | 8.8 | 8.8 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| 644077 | 3976 | None | 29 | Human | Binding | pKi | = | 8.8 | 8.8 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| 644077.0 | 3976 | None | 29 | Human | Binding | pKi | = | 8.8 | 8.8 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| CHEMBL373742 | 3976 | None | 29 | Human | Binding | pKi | = | 8.8 | 8.8 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| DB00067 | 3976 | None | 29 | Human | Binding | pKi | = | 8.8 | 8.8 | -15 | 9 | ChEMBL | None | None | None | None | 10.1021/jm3006146 | |||||
| CHEMBL2369831 | 212157 | None | 1 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 4 | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||||
| 44351500 | 117541 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 1 | 2 | ChEMBL | 995 | 16 | 10 | 12 | 0.4 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N[C@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| CHEMBL339943 | 117541 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 1 | 2 | ChEMBL | 995 | 16 | 10 | 12 | 0.4 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N[C@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| 44297505 | 165952 | None | 0 | Rat | Binding | pKi | = | 8.8 | 8.8 | -7 | 3 | ChEMBL | 1329 | 38 | 15 | 16 | -1.8 | CN(C(=O)CCc1ccc(N=[N+]=[N-])cc1)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/jm00038a013 | |||
| CHEMBL424905 | 165952 | None | 0 | Rat | Binding | pKi | = | 8.8 | 8.8 | -7 | 3 | ChEMBL | 1329 | 38 | 15 | 16 | -1.8 | CN(C(=O)CCc1ccc(N=[N+]=[N-])cc1)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/jm00038a013 | |||
| 216237 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 216237.0 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 2226 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 4110 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 443894 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 443894.0 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL344159 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| DB06212 | 3843 | None | 51 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 8 | ChEMBL | 448 | 3 | 2 | 3 | 5.7 | Clc1ccc2c(c1)C(O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C | 10.1021/acs.jmedchem.2c00011 | |||
| 16109443 | 141806 | None | 0 | Rat | Binding | pKi | = | 8.7 | 8.7 | -9 | 4 | ChEMBL | 1040 | 18 | 14 | 15 | -4.0 | N=C(N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| CHEMBL385739 | 141806 | None | 0 | Rat | Binding | pKi | = | 8.7 | 8.7 | -9 | 4 | ChEMBL | 1040 | 18 | 14 | 15 | -4.0 | N=C(N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| 44325362 | 209803 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 354 | 2 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(F)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL93603 | 209803 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 354 | 2 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccc(F)cc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 71455302 | 82408 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 234 | 3 | ChEMBL | 1441 | 33 | 5 | 17 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 71482380 | 82408 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 234 | 3 | ChEMBL | 1441 | 33 | 5 | 17 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| CHEMBL2172290 | 82408 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 234 | 3 | ChEMBL | 1441 | 33 | 5 | 17 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 44520857 | 179568 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 3 | 2 | ChEMBL | 562 | 5 | 2 | 6 | 5.2 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cccc(N)n4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL474072 | 179568 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 3 | 2 | ChEMBL | 562 | 5 | 2 | 6 | 5.2 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cccc(N)n4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 167184780 | 191290 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 566 | 8 | 2 | 4 | 7.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCc3ccncc3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL5189068 | 191290 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 566 | 8 | 2 | 4 | 7.3 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCc3ccncc3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| 168295452 | 192479 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 560 | 10 | 1 | 4 | 7.2 | CCN(CC)CCCN1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc21 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5207405 | 192479 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 560 | 10 | 1 | 4 | 7.2 | CCN(CC)CCCN1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3-c3ccccc3)cc2)c2ccccc21 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL2370641 | 212363 | None | 0 | Pig | Binding | pKi | = | 8 | 8.0 | -1 | 2 | ChEMBL | None | None | None | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N3CCC[C@H]3C(=O)NCCCCN)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||||
| CHEMBL2371440 | 212505 | None | 0 | Pig | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | None | None | None | CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm00399a009 | |||||
| 44325732 | 165521 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 533 | 4 | 1 | 4 | 6.5 | Cc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CC2CSCCN2Cc2ccccc21 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL423868 | 165521 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 533 | 4 | 1 | 4 | 6.5 | Cc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CC2CSCCN2Cc2ccccc21 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325543 | 209743 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 553 | 4 | 1 | 4 | 6.8 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3cccc(Cl)c32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL93195 | 209743 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 553 | 4 | 1 | 4 | 6.8 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3cccc(Cl)c32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325731 | 209746 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 537 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(F)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL93205 | 209746 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 537 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(F)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44297449 | 169363 | None | 0 | Rat | Binding | pKi | = | 8 | 8.0 | -22 | 3 | ChEMBL | 1315 | 37 | 15 | 16 | -2.2 | CN(C(=O)Cc1cccc(N=[N+]=[N-])c1)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/jm00038a013 | |||
| CHEMBL441195 | 169363 | None | 0 | Rat | Binding | pKi | = | 8 | 8.0 | -22 | 3 | ChEMBL | 1315 | 37 | 15 | 16 | -2.2 | CN(C(=O)Cc1cccc(N=[N+]=[N-])c1)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/jm00038a013 | |||
| 145976546 | 163735 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 7 | 2 | ChEMBL | 381 | 2 | 1 | 4 | 4.3 | Cc1ccn(-c2ccc(C(=O)N3CCCC(O)c4ccccc43)c(Cl)c2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4204008 | 163735 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 7 | 2 | ChEMBL | 381 | 2 | 1 | 4 | 4.3 | Cc1ccn(-c2ccc(C(=O)N3CCCC(O)c4ccccc43)c(Cl)c2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| 44419030 | 161708 | None | 18 | Rat | Binding | pKi | = | 7 | 7.0 | -630 | 4 | ChEMBL | 1025 | 18 | 11 | 14 | -1.5 | CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| CHEMBL412972 | 161708 | None | 18 | Rat | Binding | pKi | = | 7 | 7.0 | -630 | 4 | ChEMBL | 1025 | 18 | 11 | 14 | -1.5 | CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm060928n | |||
| 10303620 | 208734 | None | 0 | Rat | Binding | pKi | = | 6 | 6.0 | -954 | 4 | ChEMBL | 577 | 12 | 0 | 6 | 7.8 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCN1CCC(N2CCCCC2)CC1 | 10.1021/jm010544r | |||
| CHEMBL86949 | 208734 | None | 0 | Rat | Binding | pKi | = | 6 | 6.0 | -954 | 4 | ChEMBL | 577 | 12 | 0 | 6 | 7.8 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCN1CCC(N2CCCCC2)CC1 | 10.1021/jm010544r | |||
| 11092056 | 107094 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | -354 | 2 | ChEMBL | 481 | 9 | 0 | 6 | 5.3 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| CHEMBL315524 | 107094 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | -354 | 2 | ChEMBL | 481 | 9 | 0 | 6 | 5.3 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| 44321415 | 112378 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | -269 | 2 | ChEMBL | 467 | 8 | 0 | 6 | 4.9 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| CHEMBL329209 | 112378 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | -269 | 2 | ChEMBL | 467 | 8 | 0 | 6 | 4.9 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| 46890484 | 7031 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -93 | 2 | ChEMBL | 381 | 2 | 0 | 1 | 6.4 | Cc1ccccc1-c1ccc(C(=O)N2C[C@@]3(C)C[C@@H]2CC(C)(C)C3)c(Cl)c1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1084822 | 7031 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -93 | 2 | ChEMBL | 381 | 2 | 0 | 1 | 6.4 | Cc1ccccc1-c1ccc(C(=O)N2C[C@@]3(C)C[C@@H]2CC(C)(C)C3)c(Cl)c1 | 10.1016/j.bmcl.2010.04.068 | |||
| 16109439 | 137329 | None | 0 | Rat | Binding | pKi | = | 6.0 | 6.0 | -104 | 5 | ChEMBL | 1023 | 15 | 11 | 14 | -1.7 | NC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm060928n | |||
| CHEMBL375187 | 137329 | None | 0 | Rat | Binding | pKi | = | 6.0 | 6.0 | -104 | 5 | ChEMBL | 1023 | 15 | 11 | 14 | -1.7 | NC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O | 10.1021/jm060928n | |||
| 46890486 | 7033 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -28 | 2 | ChEMBL | 361 | 2 | 0 | 1 | 6.0 | Cc1ccccc1-c1ccc(C(=O)N2C[C@@]3(C)C[C@@H]2CC(C)(C)C3)cc1C | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1084824 | 7033 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -28 | 2 | ChEMBL | 361 | 2 | 0 | 1 | 6.0 | Cc1ccccc1-c1ccc(C(=O)N2C[C@@]3(C)C[C@@H]2CC(C)(C)C3)cc1C | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL2369847 | 212168 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -112 | 4 | ChEMBL | None | None | None | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm030611c | |||||
| 46890528 | 7034 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -199 | 2 | ChEMBL | 411 | 3 | 0 | 2 | 6.4 | COc1cc(-c2ccccc2C)c(Cl)cc1C(=O)N1C[C@]2(C)C[C@H]1CC(C)(C)C2 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1084825 | 7034 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -199 | 2 | ChEMBL | 411 | 3 | 0 | 2 | 6.4 | COc1cc(-c2ccccc2C)c(Cl)cc1C(=O)N1C[C@]2(C)C[C@H]1CC(C)(C)C2 | 10.1016/j.bmcl.2010.04.068 | |||
| 168294940 | 192496 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 576 | 7 | 1 | 5 | 5.3 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCOCC3)c3ccccc32)cc1)c1ccccc1Br | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5207597 | 192496 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 576 | 7 | 1 | 5 | 5.3 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCOCC3)c3ccccc32)cc1)c1ccccc1Br | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5081323 | 217231 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -2691 | 2 | ChEMBL | None | None | None | Cc1ccc2c(c1)CC(O)Cc1nnc([C@H]3CC[C@H](Oc4ccccn4)CC3)n1-2 | 10.1021/acs.jmedchem.1c00863 | |||||
| CHEMBL2369835 | 212159 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -7 | 4 | ChEMBL | None | None | None | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm030611c | |||||
| 44520864 | 172740 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 5 | 2 | ChEMBL | 603 | 5 | 1 | 6 | 6.8 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4nc5ccccc5s4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL449517 | 172740 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 5 | 2 | ChEMBL | 603 | 5 | 1 | 6 | 6.8 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4nc5ccccc5s4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 44520858 | 174522 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 4 | 2 | ChEMBL | 590 | 6 | 1 | 6 | 5.7 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cccc(N(C)C)n4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL455279 | 174522 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 4 | 2 | ChEMBL | 590 | 6 | 1 | 6 | 5.7 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cccc(N(C)C)n4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 44520863 | 181962 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 553 | 5 | 1 | 6 | 5.7 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4nccs4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL477868 | 181962 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 553 | 5 | 1 | 6 | 5.7 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4nccs4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 44520862 | 189715 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 548 | 5 | 1 | 6 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccncn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL514772 | 189715 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 548 | 5 | 1 | 6 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccncn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 44520871 | 192722 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 513 | 5 | 2 | 5 | 3.5 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCC(N)=O)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL521597 | 192722 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 513 | 5 | 2 | 5 | 3.5 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCC(N)=O)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 44520875 | 12478 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 609 | 6 | 1 | 5 | 7.0 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(-n3ccc(-c4ccccc4)n3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186237 | 12478 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 609 | 6 | 1 | 5 | 7.0 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(-n3ccc(-c4ccccc4)n3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL455418 | 12478 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 609 | 6 | 1 | 5 | 7.0 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(-n3ccc(-c4ccccc4)n3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 44520883 | 12699 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 564 | 5 | 1 | 4 | 6.5 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1187505 | 12699 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 564 | 5 | 1 | 4 | 6.5 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL505517 | 12699 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 564 | 5 | 1 | 4 | 6.5 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 164946750 | 190235 | None | 1 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 574 | 8 | 2 | 5 | 6.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCOCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL5173331 | 190235 | None | 1 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 574 | 8 | 2 | 5 | 6.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCOCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| 44351384 | 117061 | None | 0 | Pig | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 980 | 18 | 10 | 13 | 2.2 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)NCCCCCNC(N)C=N)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| CHEMBL338798 | 117061 | None | 0 | Pig | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 980 | 18 | 10 | 13 | 2.2 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)NCCCCCNC(N)C=N)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| 44351279 | 161537 | None | 0 | Pig | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 1055 | 14 | 8 | 12 | 3.1 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N3CCCC3C(=O)NCc3cccc(CN)c3)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| CHEMBL412732 | 161537 | None | 0 | Pig | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 1055 | 14 | 8 | 12 | 3.1 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N3CCCC3C(=O)NCc3cccc(CN)c3)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| 44325689 | 209318 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 44 | 2 | ChEMBL | 553 | 4 | 1 | 4 | 6.8 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL90657 | 209318 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 44 | 2 | ChEMBL | 553 | 4 | 1 | 4 | 6.8 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325505 | 209902 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 562 | 2 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(F)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL94133 | 209902 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 562 | 2 | ChEMBL | 555 | 4 | 1 | 4 | 6.3 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(F)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL1790551 | 211359 | None | 0 | Rat | Binding | pKi | = | 6.0 | 6.0 | -229 | 2 | ChEMBL | None | None | None | CC[C@@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2C[C@@H](CN(C)C)C=NN2C(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00171a003 | |||||
| 44361403 | 33853 | None | 1 | Rat | Binding | pKi | = | 5.0 | 5.0 | -457 | 5 | ChEMBL | 491 | 5 | 0 | 5 | 4.1 | CC(=O)N1CCCC(COc2ccc(C(=O)N3CCC(N4C(=O)OCc5ccccc54)CC3)cc2)C1 | 10.1021/jm00023a002 | |||
| CHEMBL142324 | 33853 | None | 1 | Rat | Binding | pKi | = | 5.0 | 5.0 | -457 | 5 | ChEMBL | 491 | 5 | 0 | 5 | 4.1 | CC(=O)N1CCCC(COc2ccc(C(=O)N3CCC(N4C(=O)OCc5ccccc54)CC3)cc2)C1 | 10.1021/jm00023a002 | |||
| 44361387 | 119478 | None | 0 | Rat | Binding | pKi | = | 5.0 | 5.0 | -724 | 5 | ChEMBL | 505 | 6 | 0 | 5 | 4.6 | CC(=O)N1CCCCC1CCOc1ccc(C(=O)N2CCC(N3C(=O)OCc4ccccc43)CC2)cc1 | 10.1021/jm00023a002 | |||
| CHEMBL344752 | 119478 | None | 0 | Rat | Binding | pKi | = | 5.0 | 5.0 | -724 | 5 | ChEMBL | 505 | 6 | 0 | 5 | 4.6 | CC(=O)N1CCCCC1CCOc1ccc(C(=O)N2CCC(N3C(=O)OCc4ccccc43)CC2)cc1 | 10.1021/jm00023a002 | |||
| 10863737 | 209088 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | -1202 | 2 | ChEMBL | 477 | 11 | 0 | 6 | 6.7 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCn1ccnc1 | 10.1021/jm010544r | |||
| CHEMBL89177 | 209088 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | -1202 | 2 | ChEMBL | 477 | 11 | 0 | 6 | 6.7 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCn1ccnc1 | 10.1021/jm010544r | |||
| CHEMBL2369837 | 212161 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | -6165 | 4 | ChEMBL | None | None | None | NCCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||||
| 11366713 | 137309 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -2511 | 8 | ChEMBL | 1054 | 19 | 13 | 15 | -3.9 | NCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||
| CHEMBL375096 | 137309 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -2511 | 8 | ChEMBL | 1054 | 19 | 13 | 15 | -3.9 | NCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||
| 145974638 | 164689 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -7 | 3 | ChEMBL | 347 | 2 | 1 | 4 | 3.7 | Cc1ccn(-c2ccc(C(=O)N3CCCC(O)c4ccccc43)cc2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4215696 | 164689 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -7 | 3 | ChEMBL | 347 | 2 | 1 | 4 | 3.7 | Cc1ccn(-c2ccc(C(=O)N3CCCC(O)c4ccccc43)cc2)n1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL2369830 | 212156 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -275 | 4 | ChEMBL | None | None | None | CCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||||
| 46890572 | 7360 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1148 | 2 | ChEMBL | 420 | 4 | 1 | 3 | 4.8 | CNC(=O)c1cccc(-c2ccc(C(=O)N3C[C@]4(C)C[C@H]3CC(C)(C)C4)cc2OC)c1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1086294 | 7360 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1148 | 2 | ChEMBL | 420 | 4 | 1 | 3 | 4.8 | CNC(=O)c1cccc(-c2ccc(C(=O)N3C[C@]4(C)C[C@H]3CC(C)(C)C4)cc2OC)c1 | 10.1016/j.bmcl.2010.04.068 | |||
| 10208389 | 78662 | None | 0 | Rat | Binding | pKi | = | 4.9 | 4.9 | -8128 | 4 | ChEMBL | 523 | 11 | 0 | 6 | 6.4 | Cc1cccc(OCCCCCCN2CCN(C)CC2)c1-n1c(C)nnc1-c1ccc(-c2ccccc2)cc1 | 10.1021/jm010544r | |||
| CHEMBL2112339 | 78662 | None | 0 | Rat | Binding | pKi | = | 4.9 | 4.9 | -8128 | 4 | ChEMBL | 523 | 11 | 0 | 6 | 6.4 | Cc1cccc(OCCCCCCN2CCN(C)CC2)c1-n1c(C)nnc1-c1ccc(-c2ccccc2)cc1 | 10.1021/jm010544r | |||
| 44520865 | 189234 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 6 | 2 | ChEMBL | 586 | 5 | 2 | 5 | 6.1 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4nc5ccccc5[nH]4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL510500 | 189234 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 6 | 2 | ChEMBL | 586 | 5 | 2 | 5 | 6.1 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4nc5ccccc5[nH]4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 167183380 | 190683 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 587 | 8 | 2 | 5 | 5.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCN(C)CC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL5180200 | 190683 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 587 | 8 | 2 | 5 | 5.9 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCN(C)CC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| 10674616 | 191544 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 572 | 8 | 1 | 4 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCCCC3)c3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5192961 | 191544 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 572 | 8 | 1 | 4 | 7.3 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCCCC3)c3ccccc32)cc1)c1ccccc1-c1ccccc1 | 10.1021/acs.jmedchem.2c00567 | |||
| 168290973 | 191988 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 588 | 8 | 1 | 5 | 6.5 | Cc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CCCN(CCCN2CCOCC2)c2ccccc21 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5199628 | 191988 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 588 | 8 | 1 | 5 | 6.5 | Cc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CCCN(CCCN2CCOCC2)c2ccccc21 | 10.1021/acs.jmedchem.2c00567 | |||
| 44294575 | 82145 | None | 0 | Pig | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00150a003 | |||
| CHEMBL216606 | 82145 | None | 0 | Pig | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1136 | 19 | 11 | 14 | -0.6 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00150a003 | |||
| 44294542 | 96536 | None | 0 | Pig | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1079 | 17 | 10 | 13 | 0.3 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00150a003 | |||
| CHEMBL262423 | 96536 | None | 0 | Pig | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1079 | 17 | 10 | 13 | 0.3 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](CCCN=C(N)N)C(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00150a003 | |||
| 71460754 | 82419 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1141 | 17 | 2 | 11 | 9.7 | CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)N4CCN(CCC(=O)NC5CCCN(C(=O)c6ccc(NC(=O)c7ccccc7-c7ccccc7)cc6)c6ccccc65)CC4)cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1 | 10.1021/jm3006146 | |||
| CHEMBL2172392 | 82419 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1141 | 17 | 2 | 11 | 9.7 | CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)N4CCN(CCC(=O)NC5CCCN(C(=O)c6ccc(NC(=O)c7ccccc7-c7ccccc7)cc6)c6ccccc65)CC4)cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1 | 10.1021/jm3006146 | |||
| 44419028 | 96962 | None | 16 | Rat | Binding | pKi | = | 7.9 | 7.9 | -10 | 8 | ChEMBL | 1093 | 18 | 12 | 14 | -1.6 | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm060928n | |||
| CHEMBL265858 | 96962 | None | 16 | Rat | Binding | pKi | = | 7.9 | 7.9 | -10 | 8 | ChEMBL | 1093 | 18 | 12 | 14 | -1.6 | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm060928n | |||
| 10615 | 572 | None | 35 | Human | Binding | pKi | = | 5.9 | 5.9 | -1288249 | 4 | ChEMBL | 409 | 3 | 0 | 6 | 4.4 | CN1Cc2cc(Cl)ccc2n2c(C1)nnc2[C@@H]1CC[C@H](CC1)Oc1ccccn1 | 10.1021/acs.jmedchem.1c00863 | |||
| 46200932 | 572 | None | 35 | Human | Binding | pKi | = | 5.9 | 5.9 | -1288249 | 4 | ChEMBL | 409 | 3 | 0 | 6 | 4.4 | CN1Cc2cc(Cl)ccc2n2c(C1)nnc2[C@@H]1CC[C@H](CC1)Oc1ccccn1 | 10.1021/acs.jmedchem.1c00863 | |||
| CHEMBL4297183 | 572 | None | 35 | Human | Binding | pKi | = | 5.9 | 5.9 | -1288249 | 4 | ChEMBL | 409 | 3 | 0 | 6 | 4.4 | CN1Cc2cc(Cl)ccc2n2c(C1)nnc2[C@@H]1CC[C@H](CC1)Oc1ccccn1 | 10.1021/acs.jmedchem.1c00863 | |||
| DB14823 | 572 | None | 35 | Human | Binding | pKi | = | 5.9 | 5.9 | -1288249 | 4 | ChEMBL | 409 | 3 | 0 | 6 | 4.4 | CN1Cc2cc(Cl)ccc2n2c(C1)nnc2[C@@H]1CC[C@H](CC1)Oc1ccccn1 | 10.1021/acs.jmedchem.1c00863 | |||
| 46890529 | 6737 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -47 | 2 | ChEMBL | 411 | 3 | 0 | 2 | 6.4 | COc1cc(-c2ccccc2C)c(Cl)cc1C(=O)N1C[C@@]2(C)C[C@@H]1CC(C)(C)C2 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1083730 | 6737 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -47 | 2 | ChEMBL | 411 | 3 | 0 | 2 | 6.4 | COc1cc(-c2ccccc2C)c(Cl)cc1C(=O)N1C[C@@]2(C)C[C@@H]1CC(C)(C)C2 | 10.1016/j.bmcl.2010.04.068 | |||
| 145976648 | 163938 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 293 | 3 | 0 | 1 | 4.6 | CCCc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4206482 | 163938 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 293 | 3 | 0 | 1 | 4.6 | CCCc1ccc(C(=O)N2CCCCc3ccccc32)cc1 | 10.1021/acs.jmedchem.8b00697 | |||
| 172441826 | 195060 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 440 | 3 | 0 | 4 | 7.1 | Cc1ccccc1/N=N\c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/acs.jmedchem.2c01625 | |||
| CHEMBL5395776 | 195060 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 440 | 3 | 0 | 4 | 7.1 | Cc1ccccc1/N=N\c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/acs.jmedchem.2c01625 | |||
| 46890152 | 6755 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 457 | 2 | 0 | 2 | 7.9 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2ccc(-c3csc4ccccc34)c(Cl)c2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1083765 | 6755 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 457 | 2 | 0 | 2 | 7.9 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2ccc(-c3csc4ccccc34)c(Cl)c2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| 10164478 | 209143 | None | 0 | Rat | Binding | pKi | = | 5.9 | 5.9 | -1174 | 4 | ChEMBL | 509 | 11 | 0 | 6 | 6.1 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| CHEMBL89552 | 209143 | None | 0 | Rat | Binding | pKi | = | 5.9 | 5.9 | -1174 | 4 | ChEMBL | 509 | 11 | 0 | 6 | 6.1 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| 118734336 | 118664 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1 | 2 | ChEMBL | 418 | 3 | 1 | 3 | 4.4 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC[S@@+]([O-])c3ccccc32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| CHEMBL3416770 | 118664 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1 | 2 | ChEMBL | 418 | 3 | 1 | 3 | 4.4 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC[S@@+]([O-])c3ccccc32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| 11569194 | 72131 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -316 | 2 | ChEMBL | 479 | 7 | 2 | 3 | 3.5 | CC(C)C[C@@H]1C(=O)N[C@H](C2Cc3ccccc3C2)C(=O)N1[C@@H](C(=O)NC(C)C)c1ccc(F)cc1 | 10.1021/jm901812z | |||
| CHEMBL197793 | 72131 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -316 | 2 | ChEMBL | 479 | 7 | 2 | 3 | 3.5 | CC(C)C[C@@H]1C(=O)N[C@H](C2Cc3ccccc3C2)C(=O)N1[C@@H](C(=O)NC(C)C)c1ccc(F)cc1 | 10.1021/jm901812z | |||
| 25212177 | 174933 | None | 7 | Human | Binding | pKi | = | 4.9 | 4.9 | -2818 | 4 | ChEMBL | 463 | 7 | 0 | 7 | 3.9 | COc1ccc(N(Cc2ccc(-c3ccccc3C)cn2)S(=O)(=O)c2cn(C)c(C)n2)cn1 | 10.1016/j.bmcl.2008.11.018 | |||
| CHEMBL456263 | 174933 | None | 7 | Human | Binding | pKi | = | 4.9 | 4.9 | -2818 | 4 | ChEMBL | 463 | 7 | 0 | 7 | 3.9 | COc1ccc(N(Cc2ccc(-c3ccccc3C)cn2)S(=O)(=O)c2cn(C)c(C)n2)cn1 | 10.1016/j.bmcl.2008.11.018 | |||
| 44520849 | 204170 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -1 | 2 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL606464 | 204170 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -1 | 2 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 168289573 | 191948 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 572 | 8 | 2 | 4 | 7.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCCCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| CHEMBL5198918 | 191948 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 572 | 8 | 2 | 4 | 7.2 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(NCCCN3CCCCC3)c3cc(Cl)ccc32)c(C)c1 | 10.1021/acs.jmedchem.2c00011 | |||
| 168286187 | 191597 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 587 | 8 | 1 | 5 | 6.1 | CN1CCN(CCCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccccc32)CC1 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5193621 | 191597 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 587 | 8 | 1 | 5 | 6.1 | CN1CCN(CCCN2CCCN(C(=O)c3ccc(NC(=O)c4ccccc4-c4ccccc4)cc3)c3ccccc32)CC1 | 10.1021/acs.jmedchem.2c00567 | |||
| 44335329 | 167941 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 561 | 4 | 1 | 3 | 7.6 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(C5)N4Cc4cc(Cl)ccc43)cc2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL430841 | 167941 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 561 | 4 | 1 | 3 | 7.6 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(C5)N4Cc4cc(Cl)ccc43)cc2)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| 44325704 | 112370 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 64 | 2 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(O)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL329141 | 112370 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 64 | 2 | ChEMBL | 553 | 4 | 2 | 5 | 5.8 | O=C(Nc1ccc(C(=O)N2C[C@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1cc(O)ccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44316235 | 160522 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -2 | 4 | ChEMBL | 1011 | 16 | 12 | 14 | -3.6 | C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||
| CHEMBL411148 | 160522 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -2 | 4 | ChEMBL | 1011 | 16 | 12 | 14 | -3.6 | C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC1=O | 10.1021/jm030611c | |||
| 9938406 | 93370 | None | 1 | Human | Binding | pKi | = | 6.9 | 6.9 | -181 | 6 | ChEMBL | 589 | 7 | 0 | 6 | 4.7 | CC(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)OCc5ccccc54)CC3)c(OCC(F)(F)F)c2)CC1 | 10.1016/s0960-894x(99)00181-x | |||
| CHEMBL24526 | 93370 | None | 1 | Human | Binding | pKi | = | 6.9 | 6.9 | -181 | 6 | ChEMBL | 589 | 7 | 0 | 6 | 4.7 | CC(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)OCc5ccccc54)CC3)c(OCC(F)(F)F)c2)CC1 | 10.1016/s0960-894x(99)00181-x | |||
| 46890101 | 7305 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -181 | 2 | ChEMBL | 414 | 3 | 0 | 3 | 6.0 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1cccc2cccnc12 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1086070 | 7305 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -181 | 2 | ChEMBL | 414 | 3 | 0 | 3 | 6.0 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1cccc2cccnc12 | 10.1016/j.bmcl.2010.04.068 | |||
| 53349471 | 118667 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -22 | 2 | ChEMBL | 413 | 3 | 1 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCN(C)c3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| CHEMBL3416774 | 118667 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -22 | 2 | ChEMBL | 413 | 3 | 1 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCN(C)c3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| 44351328 | 19399 | None | 0 | Pig | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 909 | 10 | 7 | 11 | 2.3 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N3CCCC3O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| CHEMBL129274 | 19399 | None | 0 | Pig | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 909 | 10 | 7 | 11 | 2.3 | CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N3CCCC3O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1 | 10.1021/jm00122a017 | |||
| 44419039 | 137483 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1023 | 8 | ChEMBL | 1096 | 20 | 14 | 15 | -4.6 | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm030611c | |||
| CHEMBL375324 | 137483 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1023 | 8 | ChEMBL | 1096 | 20 | 14 | 15 | -4.6 | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm030611c | |||
| 46890187 | 7256 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 3 | 2 | ChEMBL | 451 | 2 | 0 | 1 | 7.9 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2cc(Cl)c(-c3cccc4ccccc34)cc2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1085851 | 7256 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 3 | 2 | ChEMBL | 451 | 2 | 0 | 1 | 7.9 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2cc(Cl)c(-c3cccc4ccccc34)cc2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| 172452353 | 196440 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 440 | 3 | 0 | 4 | 7.1 | Cc1cccc(/N=N\c2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)c(Cl)c2)c1 | 10.1021/acs.jmedchem.2c01625 | |||
| CHEMBL5424001 | 196440 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 440 | 3 | 0 | 4 | 7.1 | Cc1cccc(/N=N\c2ccc(C(=O)N3Cc4cccn4Cc4ccccc43)c(Cl)c2)c1 | 10.1021/acs.jmedchem.2c01625 | |||
| 168272611 | 190495 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 574 | 8 | 1 | 5 | 6.2 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCOCC3)c3ccccc32)cc1)c1ccc(-c2ccccc2)cc1 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5177490 | 190495 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 574 | 8 | 1 | 5 | 6.2 | O=C(Nc1ccc(C(=O)N2CCCN(CCCN3CCOCC3)c3ccccc32)cc1)c1ccc(-c2ccccc2)cc1 | 10.1021/acs.jmedchem.2c00567 | |||
| 44314081 | 207425 | None | 0 | Rat | Binding | pKi | = | 5.9 | 5.9 | -2 | 2 | ChEMBL | 620 | 8 | 1 | 6 | 7.0 | Cc1occc1C(=O)Nc1ccc(C(=O)N(C)c2ccccc2Oc2cccc(C(=O)N3CCC(N4CCCCC4)CC3)c2)cc1 | 10.1016/s0960-894x(01)00723-5 | |||
| CHEMBL76498 | 207425 | None | 0 | Rat | Binding | pKi | = | 5.9 | 5.9 | -2 | 2 | ChEMBL | 620 | 8 | 1 | 6 | 7.0 | Cc1occc1C(=O)Nc1ccc(C(=O)N(C)c2ccccc2Oc2cccc(C(=O)N3CCC(N4CCCCC4)CC3)c2)cc1 | 10.1016/s0960-894x(01)00723-5 | |||
| 44275104 | 97340 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1737 | 4 | ChEMBL | 1127 | 32 | 14 | 14 | -3.9 | CN(C(=O)Cc1ccc(O)cc1)[C@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(N)=O | 10.1021/jm9804782 | |||
| CHEMBL269012 | 97340 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1737 | 4 | ChEMBL | 1127 | 32 | 14 | 14 | -3.9 | CN(C(=O)Cc1ccc(O)cc1)[C@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(N)=O | 10.1021/jm9804782 | |||
| CHEMBL2369836 | 212160 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -2630 | 4 | ChEMBL | None | None | None | NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1 | 10.1021/jm030611c | |||||
| 44520860 | 179726 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 548 | 5 | 1 | 6 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cnccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL474274 | 179726 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 548 | 5 | 1 | 6 | 5.0 | Cc1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4cnccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 44520880 | 12581 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.0 | CC1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186825 | 12581 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.0 | CC1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL479918 | 12581 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.0 | CC1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2008.09.039 | |||
| 44520882 | 12585 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186831 | 12585 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL480104 | 12585 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | O=C(/C=C1/c2ccccc2N(C(=O)c2ccc(N3CCCCC3)cc2Cl)CCC1(F)F)NCc1ccccn1 | 10.1016/j.bmc.2008.09.039 | |||
| 44520852 | 202164 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 2 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL593325 | 202164 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 2 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 44520851 | 202255 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL594026 | 202255 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 503 | 5 | 2 | 4 | 4.4 | C[C@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(Cl)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 71453576 | 82412 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1357 | 31 | 4 | 17 | 9.0 | CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)NCCOCCOCCOCCn3cc(CNC(=O)CCC(=O)NC4CCCN(C(=O)c5ccc(NC(=O)c6ccccc6-c6ccccc6)cc5)c5ccccc54)nn3)c3ccc(=[N+](CC)CC)cc-3oc2c1 | 10.1021/jm3006146 | |||
| CHEMBL2172294 | 82412 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1357 | 31 | 4 | 17 | 9.0 | CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)NCCOCCOCCOCCn3cc(CNC(=O)CCC(=O)NC4CCCN(C(=O)c5ccc(NC(=O)c6ccccc6-c6ccccc6)cc5)c5ccccc54)nn3)c3ccc(=[N+](CC)CC)cc-3oc2c1 | 10.1021/jm3006146 | |||
| 71462477 | 82409 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 71482382 | 82409 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| CHEMBL2172291 | 82409 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1573 | 42 | 5 | 20 | 10.3 | CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(CCCC(=O)NCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCC(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc43)nn2)c2cc(S(=O)(=O)O)ccc21 | 10.1021/jm3006146 | |||
| 56665480 | 63228 | None | 0 | Rat | Binding | pKi | = | 6.9 | 6.9 | -91 | 2 | ChEMBL | 754 | 6 | 2 | 8 | 3.5 | CC[C@@H](C)[C@@H]1/N=C(\S)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCC=NN2C(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00171a003 | |||
| CHEMBL1790544 | 63228 | None | 0 | Rat | Binding | pKi | = | 6.9 | 6.9 | -91 | 2 | ChEMBL | 754 | 6 | 2 | 8 | 3.5 | CC[C@@H](C)[C@@H]1/N=C(\S)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCC=NN2C(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00171a003 | |||
| 137637867 | 156312 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -50 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC[C@@H](O)c3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| CHEMBL4064556 | 156312 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -50 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC[C@@H](O)c3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| 70685417 | 73675 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -141 | 3 | ChEMBL | 707 | 9 | 0 | 6 | 4.3 | CS(=O)(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)CCc5ccccc54)CC3)c(OC/C=C/I)c2)CC1 | 10.1016/j.bmc.2012.02.019 | |||
| CHEMBL2017867 | 73675 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -141 | 3 | ChEMBL | 707 | 9 | 0 | 6 | 4.3 | CS(=O)(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)CCc5ccccc54)CC3)c(OC/C=C/I)c2)CC1 | 10.1016/j.bmc.2012.02.019 | |||
| 10929819 | 107000 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | -371 | 2 | ChEMBL | 565 | 15 | 0 | 6 | 7.7 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| CHEMBL314908 | 107000 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | -371 | 2 | ChEMBL | 565 | 15 | 0 | 6 | 7.7 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| 10208389 | 78662 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | -10000 | 4 | ChEMBL | 523 | 11 | 0 | 6 | 6.4 | Cc1cccc(OCCCCCCN2CCN(C)CC2)c1-n1c(C)nnc1-c1ccc(-c2ccccc2)cc1 | 10.1021/jm010544r | |||
| CHEMBL2112339 | 78662 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | -10000 | 4 | ChEMBL | 523 | 11 | 0 | 6 | 6.4 | Cc1cccc(OCCCCCCN2CCN(C)CC2)c1-n1c(C)nnc1-c1ccc(-c2ccccc2)cc1 | 10.1021/jm010544r | |||
| 46890707 | 6729 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -19 | 2 | ChEMBL | 419 | 3 | 0 | 3 | 6.6 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1csc2ccccc12 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1083703 | 6729 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -19 | 2 | ChEMBL | 419 | 3 | 0 | 3 | 6.6 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1csc2ccccc12 | 10.1016/j.bmcl.2010.04.068 | |||
| 9807250 | 78378 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 2 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | O=C(Nc1ccc(C(=O)N2C[C@@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL2093899 | 78378 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 2 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | O=C(Nc1ccc(C(=O)N2C[C@@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL2110044 | 78378 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 2 | ChEMBL | 537 | 4 | 1 | 4 | 6.1 | O=C(Nc1ccc(C(=O)N2C[C@@H]3COCCN3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44325733 | 209747 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 549 | 5 | 1 | 5 | 6.2 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CC2CSCCN2Cc2ccccc21 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL93209 | 209747 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 549 | 5 | 1 | 5 | 6.2 | COc1cc(NC(=O)c2ccccc2-c2ccccc2)ccc1C(=O)N1CC2CSCCN2Cc2ccccc21 | 10.1016/j.bmcl.2004.03.083 | |||
| 9938406 | 93370 | None | 1 | Rat | Binding | pKi | = | 6.8 | 6.8 | -213 | 6 | ChEMBL | 589 | 7 | 0 | 6 | 4.7 | CC(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)OCc5ccccc54)CC3)c(OCC(F)(F)F)c2)CC1 | 10.1016/s0960-894x(99)00181-x | |||
| CHEMBL24526 | 93370 | None | 1 | Rat | Binding | pKi | = | 6.8 | 6.8 | -213 | 6 | ChEMBL | 589 | 7 | 0 | 6 | 4.7 | CC(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)OCc5ccccc54)CC3)c(OCC(F)(F)F)c2)CC1 | 10.1016/s0960-894x(99)00181-x | |||
| CHEMBL1790548 | 211357 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -50 | 2 | ChEMBL | None | None | None | CC[C@@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCNN2C(=O)[C@H]2CCCNN2C1=O | 10.1021/jm00171a003 | |||||
| CHEMBL1790548 | 211357 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -50 | 2 | ChEMBL | None | None | None | CC[C@@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCNN2C(=O)[C@H]2CCCNN2C1=O | 10.1021/jm00171a003 | |||||
| 2042 | 2983 | None | 40 | Human | Binding | pKi | = | 5.8 | 5.8 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm501395b | |||||
| 2174 | 2983 | None | 40 | Human | Binding | pKi | = | 5.8 | 5.8 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm501395b | |||||
| 2176 | 2983 | None | 40 | Human | Binding | pKi | = | 5.8 | 5.8 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm501395b | |||||
| 439302 | 2983 | None | 40 | Human | Binding | pKi | = | 5.8 | 5.8 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm501395b | |||||
| 439302.0 | 2983 | None | 40 | Human | Binding | pKi | = | 5.8 | 5.8 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm501395b | |||||
| CHEMBL395429 | 2983 | None | 40 | Human | Binding | pKi | = | 5.8 | 5.8 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm501395b | |||||
| DB00107 | 2983 | None | 40 | Human | Binding | pKi | = | 5.8 | 5.8 | -831 | 8 | ChEMBL | None | None | None | None | 10.1021/jm501395b | |||||
| 54585227 | 61207 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -912 | 4 | ChEMBL | 1042 | 18 | 12 | 15 | -1.9 | CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C(O)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm1016208 | |||
| CHEMBL1765669 | 61207 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -912 | 4 | ChEMBL | 1042 | 18 | 12 | 15 | -1.9 | CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C(O)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm1016208 | |||
| 44520856 | 189135 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 577 | 6 | 1 | 6 | 5.6 | COc1cccc(CNC(=O)/C=C2/c3ccccc3N(C(=O)c3ccc(-n4ccc(C)n4)cc3Cl)CCC2(F)F)n1 | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL509183 | 189135 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 577 | 6 | 1 | 6 | 5.6 | COc1cccc(CNC(=O)/C=C2/c3ccccc3N(C(=O)c3ccc(-n4ccc(C)n4)cc3Cl)CCC2(F)F)n1 | 10.1016/j.bmc.2009.03.001 | |||
| 44520881 | 12582 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | CC1CCCN1c1ccc(C(=O)N2CCC(F)(F)/C(=C\C(=O)NCc3ccccn3)c3ccccc32)c(Cl)c1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186826 | 12582 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | CC1CCCN1c1ccc(C(=O)N2CCC(F)(F)/C(=C\C(=O)NCc3ccccn3)c3ccccc32)c(Cl)c1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL479919 | 12582 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 550 | 5 | 1 | 4 | 6.1 | CC1CCCN1c1ccc(C(=O)N2CCC(F)(F)/C(=C\C(=O)NCc3ccccn3)c3ccccc32)c(Cl)c1 | 10.1016/j.bmc.2008.09.039 | |||
| 44520850 | 202320 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| CHEMBL594488 | 202320 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 537 | 5 | 2 | 4 | 4.7 | C[C@@H]1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCCO)c4ccccc43)c(C(F)(F)F)c2)C1 | 10.1016/j.bmc.2009.10.038 | |||
| 71455306 | 82420 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 1204 | 26 | 3 | 13 | 9.7 | CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)NCCOCCOCCOCCC(=O)NC4CCCN(C(=O)c5ccc(NC(=O)c6ccccc6-c6ccccc6)cc5)c5ccccc54)cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1 | 10.1021/jm3006146 | |||
| CHEMBL2172393 | 82420 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 1204 | 26 | 3 | 13 | 9.7 | CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)NCCOCCOCCOCCC(=O)NC4CCCN(C(=O)c5ccc(NC(=O)c6ccccc6-c6ccccc6)cc5)c5ccccc54)cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1 | 10.1021/jm3006146 | |||
| 132822146 | 157332 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -23 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3c(C)cccc32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| CHEMBL4076436 | 157332 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -23 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3c(C)cccc32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| 47177173 | 164537 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 3 | ChEMBL | 377 | 1 | 0 | 1 | 4.3 | O=C(c1ccc(I)cc1)N1CCCCc2ccccc21 | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4213812 | 164537 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 3 | ChEMBL | 377 | 1 | 0 | 1 | 4.3 | O=C(c1ccc(I)cc1)N1CCCCc2ccccc21 | 10.1021/acs.jmedchem.8b00697 | |||
| 44335356 | 5227 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 5 | 2 | ChEMBL | 385 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCNc3ccccc32)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL106229 | 5227 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 5 | 2 | ChEMBL | 385 | 3 | 2 | 3 | 4.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCNc3ccccc32)cc1 | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL1790542 | 211353 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -346 | 2 | ChEMBL | None | None | None | CC[C@@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCC(=O)NN2C(=O)[C@H]2CCC=NN2C1=O | 10.1021/jm00171a003 | |||||
| CHEMBL339118 | 214076 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -19 | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C1=O | 10.1021/jm00169a001 | |||||
| 44297525 | 96862 | None | 0 | Rat | Binding | pKi | = | 4.8 | 4.8 | -120226 | 3 | ChEMBL | 1329 | 38 | 15 | 16 | -1.8 | CN(C(=O)CCc1cccc(N=[N+]=[N-])c1)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/jm00038a013 | |||
| CHEMBL265048 | 96862 | None | 0 | Rat | Binding | pKi | = | 4.8 | 4.8 | -120226 | 3 | ChEMBL | 1329 | 38 | 15 | 16 | -1.8 | CN(C(=O)CCc1cccc(N=[N+]=[N-])c1)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O | 10.1021/jm00038a013 | |||
| 10444 | 2326 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | -7 | 3 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 139030525 | 2326 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | -7 | 3 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 145711714 | 2326 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | -7 | 3 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| CHEMBL4204210 | 2326 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | -7 | 3 | ChEMBL | 531 | 4 | 2 | 6 | 4.2 | Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C | 10.1021/acs.jmedchem.8b00697 | |||
| 53239961 | 66640 | None | 0 | Rat | Binding | pKi | = | 6.8 | 6.8 | -2 | 2 | ChEMBL | 491 | 2 | 3 | 5 | 5.1 | Nc1nc(-c2ccc3c(c2)C(=Cc2cc(Br)c(O)c(Br)c2)C(=O)N3)cs1 | 10.1016/s0960-894x(01)00723-5 | |||
| CHEMBL1794053 | 66640 | None | 0 | Rat | Binding | pKi | = | 6.8 | 6.8 | -2 | 2 | ChEMBL | 491 | 2 | 3 | 5 | 5.1 | Nc1nc(-c2ccc3c(c2)C(=Cc2cc(Br)c(O)c(Br)c2)C(=O)N3)cs1 | 10.1016/s0960-894x(01)00723-5 | |||
| CHEMBL1852697 | 66640 | None | 0 | Rat | Binding | pKi | = | 6.8 | 6.8 | -2 | 2 | ChEMBL | 491 | 2 | 3 | 5 | 5.1 | Nc1nc(-c2ccc3c(c2)C(=Cc2cc(Br)c(O)c(Br)c2)C(=O)N3)cs1 | 10.1016/s0960-894x(01)00723-5 | |||
| 172452804 | 196725 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 458 | 3 | 0 | 4 | 7.2 | Cc1ccc(F)cc1/N=N\c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/acs.jmedchem.2c01625 | |||
| CHEMBL5430804 | 196725 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 458 | 3 | 0 | 4 | 7.2 | Cc1ccc(F)cc1/N=N\c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1 | 10.1021/acs.jmedchem.2c01625 | |||
| 44325377 | 111651 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1ccc(-c2ccccc2)c(C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL328227 | 111651 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 567 | 5 | 1 | 5 | 6.1 | COc1ccc(-c2ccccc2)c(C(=O)Nc2ccc(C(=O)N3C[C@H]4COCCN4Cc4ccccc43)c(Cl)c2)c1 | 10.1016/j.bmcl.2004.03.083 | |||
| 132822145 | 159636 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -26 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| CHEMBL4102459 | 159636 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -26 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| 44520885 | 12454 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 565 | 5 | 1 | 5 | 4.9 | CN1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)CC1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1186071 | 12454 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 565 | 5 | 1 | 5 | 4.9 | CN1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)CC1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL448269 | 12454 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 565 | 5 | 1 | 5 | 4.9 | CN1CCN(c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)CC1 | 10.1016/j.bmc.2008.09.039 | |||
| 46890154 | 6853 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 2 | ChEMBL | 423 | 2 | 0 | 2 | 7.3 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2ccc(-c3csc4ccccc34)cc2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1084070 | 6853 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 2 | ChEMBL | 423 | 2 | 0 | 2 | 7.3 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2ccc(-c3csc4ccccc34)cc2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| 46890214 | 7098 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | 417 | 2 | 0 | 1 | 7.2 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2ccc(-c3cccc4ccccc34)cc2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1085123 | 7098 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -1 | 2 | ChEMBL | 417 | 2 | 0 | 1 | 7.2 | CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2ccc(-c3cccc4ccccc34)cc2Cl)C1 | 10.1016/j.bmcl.2010.04.068 | |||
| 2200 | 3311 | None | 35 | Human | Binding | pKi | = | 6.8 | 6.8 | -177 | 6 | ChEMBL | 619 | 7 | 2 | 7 | 3.3 | COc1ccc(cc1OC)S(=O)(=O)N1c2ccc(cc2[C@]([C@@H]1C(=O)N1CCC[C@H]1C(=O)N)(O)c1ccccc1Cl)Cl | 10.1021/jm010544r | |||
| 3482 | 3311 | None | 35 | Human | Binding | pKi | = | 6.8 | 6.8 | -177 | 6 | ChEMBL | 619 | 7 | 2 | 7 | 3.3 | COc1ccc(cc1OC)S(=O)(=O)N1c2ccc(cc2[C@]([C@@H]1C(=O)N1CCC[C@H]1C(=O)N)(O)c1ccccc1Cl)Cl | 10.1021/jm010544r | |||
| 60943 | 3311 | None | 35 | Human | Binding | pKi | = | 6.8 | 6.8 | -177 | 6 | ChEMBL | 619 | 7 | 2 | 7 | 3.3 | COc1ccc(cc1OC)S(=O)(=O)N1c2ccc(cc2[C@]([C@@H]1C(=O)N1CCC[C@H]1C(=O)N)(O)c1ccccc1Cl)Cl | 10.1021/jm010544r | |||
| CHEMBL419667 | 3311 | None | 35 | Human | Binding | pKi | = | 6.8 | 6.8 | -177 | 6 | ChEMBL | 619 | 7 | 2 | 7 | 3.3 | COc1ccc(cc1OC)S(=O)(=O)N1c2ccc(cc2[C@]([C@@H]1C(=O)N1CCC[C@H]1C(=O)N)(O)c1ccccc1Cl)Cl | 10.1021/jm010544r | |||
| DB13929 | 3311 | None | 35 | Human | Binding | pKi | = | 6.8 | 6.8 | -177 | 6 | ChEMBL | 619 | 7 | 2 | 7 | 3.3 | COc1ccc(cc1OC)S(=O)(=O)N1c2ccc(cc2[C@]([C@@H]1C(=O)N1CCC[C@H]1C(=O)N)(O)c1ccccc1Cl)Cl | 10.1021/jm010544r | |||
| 10164478 | 209143 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -1698 | 4 | ChEMBL | 509 | 11 | 0 | 6 | 6.1 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| CHEMBL89552 | 209143 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -1698 | 4 | ChEMBL | 509 | 11 | 0 | 6 | 6.1 | Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCCCCCCN1CCN(C)CC1 | 10.1021/jm010544r | |||
| 137648906 | 157474 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -22 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC[C@@H](O)c3c(C)cccc32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| CHEMBL4078185 | 157474 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -22 | 2 | ChEMBL | 414 | 3 | 2 | 3 | 5.0 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC[C@@H](O)c3c(C)cccc32)cc1 | 10.1021/acs.jmedchem.7b00422 | |||
| 44520868 | 182134 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -1 | 2 | ChEMBL | 498 | 5 | 1 | 4 | 5.4 | CCCNC(=O)/C=C1/c2ccccc2N(C(=O)c2ccc(-n3ccc(C)n3)cc2Cl)CCC1(F)F | 10.1016/j.bmc.2009.03.001 | |||
| CHEMBL478083 | 182134 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -1 | 2 | ChEMBL | 498 | 5 | 1 | 4 | 5.4 | CCCNC(=O)/C=C1/c2ccccc2N(C(=O)c2ccc(-n3ccc(C)n3)cc2Cl)CCC1(F)F | 10.1016/j.bmc.2009.03.001 | |||
| 44520874 | 12681 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 575 | 6 | 1 | 5 | 6.4 | CC(C)c1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL1187362 | 12681 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 575 | 6 | 1 | 5 | 6.4 | CC(C)c1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2008.09.039 | |||
| CHEMBL500371 | 12681 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 575 | 6 | 1 | 5 | 6.4 | CC(C)c1ccn(-c2ccc(C(=O)N3CCC(F)(F)/C(=C\C(=O)NCc4ccccn4)c4ccccc43)c(Cl)c2)n1 | 10.1016/j.bmc.2008.09.039 | |||
| 168277203 | 190748 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 588 | 8 | 1 | 5 | 6.5 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCN(CCCN4CCOCC4)c4ccccc43)cc2)cc1 | 10.1021/acs.jmedchem.2c00567 | |||
| CHEMBL5181318 | 190748 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 588 | 8 | 1 | 5 | 6.5 | Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCN(CCCN4CCOCC4)c4ccccc43)cc2)cc1 | 10.1021/acs.jmedchem.2c00567 | |||
| 44325545 | 209586 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 555 | 4 | 1 | 4 | 6.5 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccc(F)c(F)c32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| CHEMBL92187 | 209586 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 555 | 4 | 1 | 4 | 6.5 | O=C(Nc1ccc(C(=O)N2CC3CSCCN3Cc3ccc(F)c(F)c32)cc1)c1ccccc1-c1ccccc1 | 10.1016/j.bmcl.2004.03.083 | |||
| 44335386 | 108066 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 14 | 2 | ChEMBL | 489 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1F | 10.1016/s0960-894x(02)00649-2 | |||
| CHEMBL319433 | 108066 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 14 | 2 | ChEMBL | 489 | 3 | 1 | 3 | 5.7 | O=C(Nc1ccc(C(=O)N2C[C@@H]3C4CCC(C4)N3Cc3cc(Cl)ccc32)cc1)c1ccccc1F | 10.1016/s0960-894x(02)00649-2 | |||
| 57519948 | 73677 | None | 3 | Human | Binding | pKi | = | 5.8 | 5.8 | -112 | 3 | ChEMBL | 587 | 9 | 0 | 6 | 3.4 | CS(=O)(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)CCc5ccccc54)CC3)c(OCCF)c2)CC1 | 10.1016/j.bmcl.2013.07.045 | |||
| CHEMBL2017869 | 73677 | None | 3 | Human | Binding | pKi | = | 5.8 | 5.8 | -112 | 3 | ChEMBL | 587 | 9 | 0 | 6 | 3.4 | CS(=O)(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)CCc5ccccc54)CC3)c(OCCF)c2)CC1 | 10.1016/j.bmcl.2013.07.045 | |||
| 118734334 | 118661 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -10 | 2 | ChEMBL | 416 | 3 | 1 | 3 | 5.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCSc3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| CHEMBL3416767 | 118661 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -10 | 2 | ChEMBL | 416 | 3 | 1 | 3 | 5.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCSc3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| 57519948 | 73677 | None | 3 | Human | Binding | pKi | = | 5.8 | 5.8 | -112 | 3 | ChEMBL | 587 | 9 | 0 | 6 | 3.4 | CS(=O)(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)CCc5ccccc54)CC3)c(OCCF)c2)CC1 | 10.1016/j.bmc.2012.02.019 | |||
| CHEMBL2017869 | 73677 | None | 3 | Human | Binding | pKi | = | 5.8 | 5.8 | -112 | 3 | ChEMBL | 587 | 9 | 0 | 6 | 3.4 | CS(=O)(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)CCc5ccccc54)CC3)c(OCCF)c2)CC1 | 10.1016/j.bmc.2012.02.019 | |||
| CHEMBL52176 | 218088 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -229 | 2 | ChEMBL | None | None | None | CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H]2CCCCN2C(=O)[C@@H]2CCCCN2C1=O | 10.1021/jm00169a001 | |||||
| 10483105 | 90714 | None | 1 | Human | Binding | pKi | = | 6.7 | 6.7 | -34 | 4 | ChEMBL | 568 | 10 | 2 | 7 | 1.8 | CN[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1016/j.bmcl.2012.10.116 | |||
| CHEMBL2391300 | 90714 | None | 1 | Human | Binding | pKi | = | 6.7 | 6.7 | -34 | 4 | ChEMBL | 568 | 10 | 2 | 7 | 1.8 | CN[C@@H](CCS(C)(=O)=O)C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(c3ccccc3C)CC1)C2(C)C | 10.1016/j.bmcl.2012.10.116 | |||
| 46890614 | 6675 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -416 | 2 | ChEMBL | 397 | 3 | 0 | 2 | 6.1 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2010.04.068 | |||
| CHEMBL1083443 | 6675 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -416 | 2 | ChEMBL | 397 | 3 | 0 | 2 | 6.1 | COc1cc(C(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)ccc1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2010.04.068 | |||
| 118734334 | 118661 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 2 | ChEMBL | 416 | 3 | 1 | 3 | 5.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCSc3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| CHEMBL3416767 | 118661 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 2 | ChEMBL | 416 | 3 | 1 | 3 | 5.7 | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCSc3cccc(C)c32)cc1 | 10.1021/acs.jmedchem.5b00289 | |||
| 10304617 | 208685 | None | 0 | Rat | Binding | pKi | = | 5.7 | 5.7 | -1819 | 4 | ChEMBL | 625 | 8 | 0 | 6 | 7.9 | Cc1cccc(OCc2ccc(C(=O)N3CCC(N4CCCCC4)CC3)cc2)c1-n1c(C)nnc1-c1ccc(-c2ccccc2)cc1 | 10.1021/jm010544r | |||
| CHEMBL86667 | 208685 | None | 0 | Rat | Binding | pKi | = | 5.7 | 5.7 | -1819 | 4 | ChEMBL | 625 | 8 | 0 | 6 | 7.9 | Cc1cccc(OCc2ccc(C(=O)N3CCC(N4CCCCC4)CC3)cc2)c1-n1c(C)nnc1-c1ccc(-c2ccccc2)cc1 | 10.1021/jm010544r | |||
| 71451750 | 82410 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 1 | 2 | ChEMBL | 1295 | 30 | 4 | 17 | 7.6 | CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)NCCOCCOCCOCCn3cc(CNC(=O)CCC(=O)NC4CCCN(C(=O)c5ccc(NC(=O)c6ccccc6C)cc5)c5ccccc54)nn3)c3ccc(=[N+](CC)CC)cc-3oc2c1 | 10.1021/jm3006146 | |||
| CHEMBL2172292 | ||||||||||||||||||||||