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 |
|
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 11 | 11.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 11 | 11.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 11 | 11.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 11 | 11.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 11 | 11.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 11 | 11.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 25208097 | 184028 | None | 1 | Human | Functional | pEC50 | = | 10.6 | 10.6 | -1 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL481366 | 184028 | None | 1 | Human | Functional | pEC50 | = | 10.6 | 10.6 | -1 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/acs.jmedchem.8b00435 | |||
| 3917 | 3930 | None | 1 | Human | Functional | pEC50 | = | 10.6 | 10.6 | 3 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44430609 | 3930 | None | 1 | Human | Functional | pEC50 | = | 10.6 | 10.6 | 3 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL409969 | 3930 | None | 1 | Human | Functional | pEC50 | = | 10.6 | 10.6 | 3 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL1631926 | 211277 | None | 0 | Mouse | Functional | pEC50 | = | 10.4 | 10.4 | - | 1 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||||
| CHEMBL1631926 | 211277 | None | 0 | Mouse | Functional | pEC50 | = | 10.4 | 10.4 | - | 1 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||||
| CHEMBL264846 | 213091 | None | 0 | Human | Functional | pEC50 | = | 10.2 | 10.2 | 12 | 3 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 44388462 | 161947 | None | 0 | Human | Functional | pEC50 | = | 10.2 | 10.2 | 6 | 3 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL414782 | 161947 | None | 0 | Human | Functional | pEC50 | = | 10.2 | 10.2 | 6 | 3 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(02)00652-2 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(02)00652-2 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(02)00652-2 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(02)00652-2 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(02)00652-2 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(02)00652-2 | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2004.08.001 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2004.08.001 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2004.08.001 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2004.08.001 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2004.08.001 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 10.1 | 10.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2004.08.001 | |||||
| 44388461 | 159934 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 6 | 3 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL410653 | 159934 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 6 | 3 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 24822630 | 97916 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 8 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 4.1 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL272215 | 97916 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 8 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 4.1 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL593215 | 97916 | None | 0 | Human | Functional | pEC50 | = | 10 | 10.0 | 8 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 4.1 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Cl)c(Cl)c1 | 10.1016/j.bmc.2009.07.069 | |||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.9 | 9.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| CHEMBL409204 | 215211 | None | 0 | Human | Functional | pEC50 | = | 9.9 | 9.9 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| CHEMBL261997 | 212983 | None | 6 | Human | Functional | pEC50 | = | 9.8 | 9.8 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| CHEMBL2372052 | 212633 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](CN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 2 | 5 | ChEMBL | None | None | None | None | 10.1039/C4MD00082J | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 2 | 5 | ChEMBL | None | None | None | None | 10.1039/C4MD00082J | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 2 | 5 | ChEMBL | None | None | None | None | 10.1039/C4MD00082J | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 2 | 5 | ChEMBL | None | None | None | None | 10.1039/C4MD00082J | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 2 | 5 | ChEMBL | None | None | None | None | 10.1039/C4MD00082J | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.7 | 9.7 | 2 | 5 | ChEMBL | None | None | None | None | 10.1039/C4MD00082J | |||||
| CHEMBL265801 | 213122 | None | 0 | Human | Functional | pEC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(N)=O | 10.1021/jm010221v | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01976 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01976 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01976 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01976 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01976 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.6 | 9.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.5b01976 | |||||
| 44388466 | 96554 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 1938 | 69 | 33 | 31 | -14.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL262544 | 96554 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | 1938 | 69 | 33 | 31 | -14.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL412537 | 215462 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1cccc(F)c1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| CHEMBL405648 | 215032 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| CHEMBL1627325 | 211270 | None | 0 | Human | Functional | pEC50 | = | 9.6 | 9.6 | -8 | 8 | ChEMBL | None | None | None | CSCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(C)(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O | 10.1021/jm900604g | |||||
| CHEMBL427791 | 215843 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(C#N)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| 44388467 | 169508 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 4 | 2 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL442297 | 169508 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 4 | 2 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 1682 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm010221v | |||||
| 6324645 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm010221v | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm010221v | |||||
| CHEMBL1631909 | 211271 | None | 0 | Mouse | Functional | pEC50 | = | 9.4 | 9.4 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||||
| CHEMBL1631909 | 211271 | None | 0 | Mouse | Functional | pEC50 | = | 9.4 | 9.4 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm900604g | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm900604g | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm900604g | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm900604g | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm900604g | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm900604g | |||||
| 12419 | 2474 | None | 22 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 87 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 10.1021/jm7012979 | |||
| 24800108 | 2474 | None | 22 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 87 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 10.1021/jm7012979 | |||
| CHEMBL481512 | 2474 | None | 22 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 87 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 10.1021/jm7012979 | |||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| 44388462 | 161947 | None | 0 | Mouse | Functional | pEC50 | = | 9.4 | 9.4 | -6 | 3 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL414782 | 161947 | None | 0 | Mouse | Functional | pEC50 | = | 9.4 | 9.4 | -6 | 3 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL263588 | 213038 | None | 0 | Human | Functional | pEC50 | = | 9.3 | 9.3 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 25208097 | 184028 | None | 1 | Human | Functional | pEC50 | = | 9.3 | 9.3 | -1 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL481366 | 184028 | None | 1 | Human | Functional | pEC50 | = | 9.3 | 9.3 | -1 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| 1682 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.3 | 9.3 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| 6324645 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.3 | 9.3 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.3 | 9.3 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.0c02062 | |||||
| 3917 | 3930 | None | 1 | Mouse | Functional | pEC50 | = | 9.2 | 9.2 | -3 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44430609 | 3930 | None | 1 | Mouse | Functional | pEC50 | = | 9.2 | 9.2 | -3 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL409969 | 3930 | None | 1 | Mouse | Functional | pEC50 | = | 9.2 | 9.2 | -3 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL429363 | 215987 | None | 0 | Human | Functional | pEC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL1631923 | 211275 | None | 0 | Mouse | Functional | pEC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CC(=O)NCCCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc3ccccc3)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N2)CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm101139f | |||||
| CHEMBL1631923 | 211275 | None | 0 | Mouse | Functional | pEC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CC(=O)NCCCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc3ccccc3)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N2)CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O | 10.1021/jm101139f | |||||
| 3917 | 3930 | None | 1 | Guinea pig | Functional | pEC50 | = | 9.2 | 9.2 | -4 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44430609 | 3930 | None | 1 | Guinea pig | Functional | pEC50 | = | 9.2 | 9.2 | -4 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL409969 | 3930 | None | 1 | Guinea pig | Functional | pEC50 | = | 9.2 | 9.2 | -4 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL1162359 | 210976 | None | 0 | Human | Functional | pEC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm800394v | |||||
| 44388461 | 159934 | None | 0 | Mouse | Functional | pEC50 | = | 9.1 | 9.1 | -6 | 3 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL410653 | 159934 | None | 0 | Mouse | Functional | pEC50 | = | 9.1 | 9.1 | -6 | 3 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL414767 | 215614 | None | 0 | Human | Functional | pEC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 1682 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm800394v | |||||
| 6324645 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm800394v | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm800394v | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL507847 | 217045 | None | 0 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL1631926 | 211277 | None | 0 | Mouse | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||||
| CHEMBL428668 | 215926 | None | 0 | Human | Functional | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1F)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| 44388467 | 169508 | None | 0 | Mouse | Functional | pEC50 | = | 9.0 | 9.0 | -4 | 2 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL442297 | 169508 | None | 0 | Mouse | Functional | pEC50 | = | 9.0 | 9.0 | -4 | 2 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 44388462 | 161947 | None | 0 | Guinea pig | Functional | pEC50 | = | 9.0 | 9.0 | -14 | 3 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL414782 | 161947 | None | 0 | Guinea pig | Functional | pEC50 | = | 9.0 | 9.0 | -14 | 3 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 16143911 | 467 | None | 15 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1689 | 467 | None | 15 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL505874 | 467 | None | 15 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL511107 | 218083 | None | 0 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 16143911 | 467 | None | 15 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 1689 | 467 | None | 15 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL505874 | 467 | None | 15 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 9.0 | 9.0 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1682 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm010092i | |||||
| 6324645 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm010092i | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Functional | pEC50 | = | 9.0 | 9.0 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm010092i | |||||
| 44388461 | 159934 | None | 0 | Guinea pig | Functional | pEC50 | = | 9.0 | 9.0 | -9 | 3 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL410653 | 159934 | None | 0 | Guinea pig | Functional | pEC50 | = | 9.0 | 9.0 | -9 | 3 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL506825 | 216701 | None | 0 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 25207950 | 183902 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | 120 | 3 | ChEMBL | 430 | 4 | 1 | 4 | 6.3 | CC1(N2CCC(n3c(-c4cccc(CN)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL480426 | 183902 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | 120 | 3 | ChEMBL | 430 | 4 | 1 | 4 | 6.3 | CC1(N2CCC(n3c(-c4cccc(CN)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| 11956520 | 120629 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | -6 | 2 | ChEMBL | 359 | 2 | 2 | 2 | 4.5 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)NCCc1c3ccccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3326228 | 120629 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | -6 | 2 | ChEMBL | 359 | 2 | 2 | 2 | 4.5 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)NCCc1c3ccccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3545629 | 120629 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | -6 | 2 | ChEMBL | 359 | 2 | 2 | 2 | 4.5 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)NCCc1c3ccccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL556388 | 218225 | None | 0 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL559130 | 218233 | None | 0 | Rat | Functional | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 25208095 | 191318 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | 47 | 4 | ChEMBL | 422 | 3 | 0 | 4 | 6.0 | CN1CCC[C@@H](c2nc3ccccc3n2C2CCN(C3(C)CCCCCCC3)CC2)C1 | 10.1021/jm7012979 | |||
| CHEMBL518950 | 191318 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | 47 | 4 | ChEMBL | 422 | 3 | 0 | 4 | 6.0 | CN1CCC[C@@H](c2nc3ccccc3n2C2CCN(C3(C)CCCCCCC3)CC2)C1 | 10.1021/jm7012979 | |||
| CHEMBL406097 | 215055 | None | 0 | Human | Functional | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(Br)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2010.07.034 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2010.07.034 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2010.07.034 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2010.07.034 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2010.07.034 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2010.07.034 | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm7012979 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm7012979 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm7012979 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm7012979 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm7012979 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm7012979 | |||||
| CHEMBL1162358 | 210975 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CCCCNC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm800394v | |||||
| 25208101 | 184029 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 181 | 2 | ChEMBL | 479 | 4 | 0 | 5 | 6.2 | CC1(N2CCC(n3c(-c4cccc(S(C)(=O)=O)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL481367 | 184029 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 181 | 2 | ChEMBL | 479 | 4 | 0 | 5 | 6.2 | CC1(N2CCC(n3c(-c4cccc(S(C)(=O)=O)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| 25208245 | 184050 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 478 | 2 | ChEMBL | 453 | 3 | 0 | 3 | 7.6 | CC1(N2CCC(n3c(-c4ccc(F)c(Cl)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL481547 | 184050 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 478 | 2 | ChEMBL | 453 | 3 | 0 | 3 | 7.6 | CC1(N2CCC(n3c(-c4ccc(F)c(Cl)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| 25208099 | 188477 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 8 | 4 | ChEMBL | 422 | 3 | 0 | 4 | 6.0 | CN1CCC[C@H](c2nc3ccccc3n2C2CCN(C3(C)CCCCCCC3)CC2)C1 | 10.1021/jm7012979 | |||
| CHEMBL501331 | 188477 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 8 | 4 | ChEMBL | 422 | 3 | 0 | 4 | 6.0 | CN1CCC[C@H](c2nc3ccccc3n2C2CCN(C3(C)CCCCCCC3)CC2)C1 | 10.1021/jm7012979 | |||
| 11464846 | 77623 | None | 19 | Human | Functional | pEC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 440 | 4 | 1 | 5 | 3.6 | CNC(=O)Cn1c(=O)n(C2CCN([C@@H]3Cc4cccc5cccc3c45)CC2)c2ccccc21 | 10.1021/jm201629q | |||
| CHEMBL2088035 | 77623 | None | 19 | Human | Functional | pEC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 440 | 4 | 1 | 5 | 3.6 | CNC(=O)Cn1c(=O)n(C2CCN([C@@H]3Cc4cccc5cccc3c45)CC2)c2ccccc21 | 10.1021/jm201629q | |||
| CHEMBL5073561 | 216787 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | 107 | 2 | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL264846 | 213091 | None | 0 | Guinea pig | Functional | pEC50 | = | 8.7 | 8.7 | -12 | 3 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| CHEMBL437915 | 216200 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/jm010092i | |||||
| CHEMBL5070802 | 216732 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL5080536 | 217179 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL5093093 | 217896 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | None | None | None | CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL504872 | 216673 | None | 0 | Rat | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 134563332 | 196530 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | 2 | 3 | ChEMBL | 367 | 5 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CCN)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5426012 | 196530 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | 2 | 3 | ChEMBL | 367 | 5 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CCN)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL262224 | 212993 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | None | None | None | Cc1ccc(C[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)O)cc1 | 10.1021/jm010221v | |||||
| 9927928 | 90503 | None | 0 | Human | Functional | pEC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 340 | 2 | 0 | 2 | 4.5 | O=C1CCc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387199 | 90503 | None | 0 | Human | Functional | pEC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 340 | 2 | 0 | 2 | 4.5 | O=C1CCc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL507653 | 216932 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm800394v | |||||
| 44574791 | 178682 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 464 | 5 | 1 | 3 | 7.1 | O/N=C/C1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL467119 | 178682 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 464 | 5 | 1 | 3 | 7.1 | O/N=C/C1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| 71624265 | 90492 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | 5 | 2 | ChEMBL | 340 | 4 | 0 | 2 | 4.4 | CCC[C@H]1CC[C@@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387188 | 90492 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | 5 | 2 | ChEMBL | 340 | 4 | 0 | 2 | 4.4 | CCC[C@H]1CC[C@@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL442305 | 216371 | None | 0 | Rat | Functional | pEC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| CHEMBL504540 | 216668 | None | 0 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL526352 | 218172 | None | 0 | Rat | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 16131448 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 1681 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 1688 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 44361543 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 56947112 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| CHEMBL396460 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 1682 | 2852 | None | 17 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 6324645 | 2852 | None | 17 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| CHEMBL384755 | 2852 | None | 17 | Mouse | Functional | pEC50 | = | 8.0 | 8.0 | -7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 76324308 | 103372 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | 48 | 2 | ChEMBL | 496 | 6 | 1 | 2 | 6.6 | NC(=O)[C@]1(Cc2ccc(F)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084526 | 103372 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | 48 | 2 | ChEMBL | 496 | 6 | 1 | 2 | 6.6 | NC(=O)[C@]1(Cc2ccc(F)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| 16131448 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 1681 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 1688 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 44361543 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 56947112 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| CHEMBL396460 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 1682 | 2852 | None | 17 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 6324645 | 2852 | None | 17 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| CHEMBL384755 | 2852 | None | 17 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm101139f | |||||
| 10406239 | 120624 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -10 | 2 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500116x | |||
| CHEMBL3326224 | 120624 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -10 | 2 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500116x | |||
| CHEMBL3326226 | 120624 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -10 | 2 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500116x | |||
| CHEMBL3545624 | 120624 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -10 | 2 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500116x | |||
| 56658044 | 65727 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -20 | 4 | ChEMBL | 519 | 6 | 2 | 5 | 5.2 | CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)CC1CC4CCC1C4)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| CHEMBL1834413 | 65727 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -20 | 4 | ChEMBL | 519 | 6 | 2 | 5 | 5.2 | CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)CC1CC4CCC1C4)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| CHEMBL5079432 | 217105 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -38 | 2 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)c1ccccc1 | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL442305 | 216371 | None | 0 | Rat | Functional | pEC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| 9820782 | 143340 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | Cc1ccccc1C(c1ccccc1C)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL389665 | 143340 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 371 | 4 | 1 | 2 | 5.4 | Cc1ccccc1C(c1ccccc1C)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| 9848990 | 189274 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| 9848990.0 | 189274 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| CHEMBL2368861 | 189274 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| CHEMBL511142 | 189274 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| 134563650 | 169948 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 354 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CO)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4439997 | 169948 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 354 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CO)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 134563650 | 169948 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 354 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CO)c4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL4439997 | 169948 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 354 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CO)c4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 44426843 | 85761 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 403 | 6 | 1 | 4 | 4.8 | COc1ccccc1C(c1ccccc1OC)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL228964 | 85761 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 403 | 6 | 1 | 4 | 4.8 | COc1ccccc1C(c1ccccc1OC)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| 11164004 | 108607 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 352 | 2 | 0 | 2 | 4.4 | O=C1Cc2ccccc2N1C1CCN(C2CCCC3CCCCC32)CC1 | 10.1021/jm034249d | |||
| CHEMBL320182 | 108607 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 352 | 2 | 0 | 2 | 4.4 | O=C1Cc2ccccc2N1C1CCN(C2CCCC3CCCCC32)CC1 | 10.1021/jm034249d | |||
| 10042904 | 210865 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 340 | 3 | 0 | 2 | 4.3 | CC(C)[C@H]1CC[C@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1021/jm034249d | |||
| CHEMBL99738 | 210865 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 340 | 3 | 0 | 2 | 4.3 | CC(C)[C@H]1CC[C@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1021/jm034249d | |||
| CHEMBL5078005 | 217015 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL525604 | 218147 | None | 0 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 10385808 | 66163 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 38 | 2 | ChEMBL | 391 | 3 | 1 | 3 | 3.5 | CC(C)C1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184127 | 66163 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 38 | 2 | ChEMBL | 391 | 3 | 1 | 3 | 3.5 | CC(C)C1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 8868 | 3547 | None | 23 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 57 | 3 | ChEMBL | 397 | 4 | 1 | 2 | 5.9 | Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1 | 10.1016/j.bmcl.2009.03.031 | |||
| 9887077 | 3547 | None | 23 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 57 | 3 | ChEMBL | 397 | 4 | 1 | 2 | 5.9 | Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL513136 | 3547 | None | 23 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 57 | 3 | ChEMBL | 397 | 4 | 1 | 2 | 5.9 | Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1 | 10.1016/j.bmcl.2009.03.031 | |||
| 49843555 | 57324 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 288 | 2 | ChEMBL | 451 | 4 | 2 | 6 | 3.8 | OCC1(N2CCC(n3c(N4CC5CNCC5C4)nc4ccccc43)CC2)CCCCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650844 | 57324 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 288 | 2 | ChEMBL | 451 | 4 | 2 | 6 | 3.8 | OCC1(N2CCC(n3c(N4CC5CNCC5C4)nc4ccccc43)CC2)CCCCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL438398 | 216231 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | CCC(CC)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL437192 | 216169 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | CCCC(CCC)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 9842289 | 120547 | None | 0 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 369 | 2 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2 | 10.1016/s0960-894x(00)00111-6 | |||
| CHEMBL354291 | 120547 | None | 0 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 369 | 2 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2 | 10.1016/s0960-894x(00)00111-6 | |||
| CHEMBL389521 | 214887 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -11 | 2 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||||
| 1679 | 268 | None | 20 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 9963005 | 268 | None | 20 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| CHEMBL437723 | 268 | None | 20 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 11956680 | 120622 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -100 | 2 | ChEMBL | 376 | 2 | 2 | 3 | 4.7 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(O)ccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3325961 | 120622 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -100 | 2 | ChEMBL | 376 | 2 | 2 | 3 | 4.7 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(O)ccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3545622 | 120622 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -100 | 2 | ChEMBL | 376 | 2 | 2 | 3 | 4.7 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(O)ccc3[nH]c12 | 10.1021/ml500117c | |||
| 134563655 | 174322 | None | 4 | Human | Functional | pEC50 | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 353 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4548515 | 174322 | None | 4 | Human | Functional | pEC50 | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 353 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 134563655 | 174322 | None | 4 | Human | Functional | pEC50 | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 353 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN)c4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL4548515 | 174322 | None | 4 | Human | Functional | pEC50 | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 353 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN)c4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 9803475 | 77624 | None | 27 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 443 | 5 | 0 | 5 | 3.7 | COC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3cccc4ccccc34)CC2)C1=O | 10.1021/jm201629q | |||
| CHEMBL2088036 | 77624 | None | 27 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 443 | 5 | 0 | 5 | 3.7 | COC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3cccc4ccccc34)CC2)C1=O | 10.1021/jm201629q | |||
| CHEMBL5087383 | 217581 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -7 | 2 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 90655976 | 111072 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 438 | 7 | 0 | 2 | 6.2 | CCC1C(=O)N(C2CCN(CCC(c3ccccc3)c3ccccc3)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262549 | 111072 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 438 | 7 | 0 | 2 | 6.2 | CCC1C(=O)N(C2CCN(CCC(c3ccccc3)c3ccccc3)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| 118718276 | 115378 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 482 | 6 | 1 | 2 | 7.0 | NC[C@]1(Cc2ccc(F)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| CHEMBL3349260 | 115378 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 482 | 6 | 1 | 2 | 7.0 | NC[C@]1(Cc2ccc(F)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| 22562137 | 90502 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1 | 2 | ChEMBL | 354 | 3 | 0 | 2 | 4.6 | CC(C)C1CCC(N2CCC(N3C(=O)CCc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387198 | 90502 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -1 | 2 | ChEMBL | 354 | 3 | 0 | 2 | 4.6 | CC(C)C1CCC(N2CCC(N3C(=O)CCc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| 118718277 | 115379 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 524 | 7 | 1 | 2 | 7.2 | CC(=O)NC[C@]1(Cc2ccc(F)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| CHEMBL3349261 | 115379 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 524 | 7 | 1 | 2 | 7.2 | CC(=O)NC[C@]1(Cc2ccc(F)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL389521 | 214887 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | -11 | 2 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||||
| 25208247 | 184051 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 676 | 2 | ChEMBL | 440 | 3 | 1 | 3 | 7.3 | CC1(N2CCC(n3c(-c4ccc5cc[nH]c5c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL481548 | 184051 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 676 | 2 | ChEMBL | 440 | 3 | 1 | 3 | 7.3 | CC1(N2CCC(n3c(-c4ccc5cc[nH]c5c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| 11848225 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/ml500117c | |||
| 11848225.0 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/ml500117c | |||
| 8866 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/ml500117c | |||
| CHEMBL2364605 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/ml500117c | |||
| CHEMBL3545616 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/ml500117c | |||
| CHEMBL3962932 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/ml500117c | |||
| DB12830 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/ml500117c | |||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.9 | 7.9 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL5086442 | 217518 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | COc1ccc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)cc1 | 10.1021/acs.jmedchem.0c02062 | |||||
| 44430604 | 168874 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL437382 | 168874 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| 53322001 | 56444 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1601 | 34 | 25 | 22 | -7.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CC(=O)NCCCC[C@@H](CC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O)C(=O)N2 | 10.1021/jm101139f | |||
| CHEMBL1631924 | 56444 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1601 | 34 | 25 | 22 | -7.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CC(=O)NCCCC[C@@H](CC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O)C(=O)N2 | 10.1021/jm101139f | |||
| CHEMBL265392 | 213103 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| 46227961 | 14125 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -954 | 4 | ChEMBL | 460 | 4 | 3 | 5 | 3.1 | Cc1ccc(C(=O)N[C@@H]2CC[C@@]3(O)[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL1198015 | 14125 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -954 | 4 | ChEMBL | 460 | 4 | 3 | 5 | 3.1 | Cc1ccc(C(=O)N[C@@H]2CC[C@@]3(O)[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL593214 | 14125 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -954 | 4 | ChEMBL | 460 | 4 | 3 | 5 | 3.1 | Cc1ccc(C(=O)N[C@@H]2CC[C@@]3(O)[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| 44574705 | 178892 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | 15 | 2 | ChEMBL | 451 | 5 | 1 | 2 | 6.6 | OCC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL468952 | 178892 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | 15 | 2 | ChEMBL | 451 | 5 | 1 | 2 | 6.6 | OCC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| 71624269 | 90496 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -2 | 3 | ChEMBL | 320 | 3 | 0 | 2 | 3.8 | CC(c1ccccc1)N1CCC(N2C(=O)Cc3ccccc32)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387192 | 90496 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -2 | 3 | ChEMBL | 320 | 3 | 0 | 2 | 3.8 | CC(c1ccccc1)N1CCC(N2C(=O)Cc3ccccc32)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| 129188462 | 176511 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 367 | 5 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4465668 | 176511 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 367 | 5 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4596017 | 176511 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 367 | 5 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 10385808 | 66163 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 38 | 2 | ChEMBL | 391 | 3 | 1 | 3 | 3.5 | CC(C)C1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184127 | 66163 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 38 | 2 | ChEMBL | 391 | 3 | 1 | 3 | 3.5 | CC(C)C1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 53322001 | 56444 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1601 | 34 | 25 | 22 | -7.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CC(=O)NCCCC[C@@H](CC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O)C(=O)N2 | 10.1021/jm101139f | |||
| CHEMBL1631924 | 56444 | None | 0 | Mouse | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1601 | 34 | 25 | 22 | -7.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CC(=O)NCCCC[C@@H](CC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O)C(=O)N2 | 10.1021/jm101139f | |||
| 42629117 | 178654 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 67 | 2 | ChEMBL | 482 | 5 | 1 | 2 | 6.3 | NC(=O)C1(c2ccc(F)cc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL466921 | 178654 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 67 | 2 | ChEMBL | 482 | 5 | 1 | 2 | 6.3 | NC(=O)C1(c2ccc(F)cc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| 122179052 | 121459 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 499 | 5 | 2 | 5 | 4.8 | CO[C@]12C=C[C@@]3(C[C@]1(C)[C@H](O)c1cccc(C)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581741 | 121459 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | ChEMBL | 499 | 5 | 2 | 5 | 4.8 | CO[C@]12C=C[C@@]3(C[C@]1(C)[C@H](O)c1cccc(C)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 76331525 | 103402 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 109 | 2 | ChEMBL | 542 | 6 | 1 | 3 | 7.7 | COC(=O)N[C@@]1(Cc2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084558 | 103402 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 109 | 2 | ChEMBL | 542 | 6 | 1 | 3 | 7.7 | COC(=O)N[C@@]1(Cc2ccc(Cl)cc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| 44430602 | 144543 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL390658 | 144543 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL556556 | 144543 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL2372051 | 212632 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | None | None | None | CC[C@](C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL2372364 | 212632 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | None | None | None | CC[C@](C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 81689704 | 121463 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 487 | 5 | 2 | 5 | 4.7 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1ccccc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581750 | 121463 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 487 | 5 | 2 | 5 | 4.7 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1ccccc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 6.8 | 6.8 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 9848990 | 189274 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 9848990.0 | 189274 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL2368861 | 189274 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL511142 | 189274 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -954 | 7 | ChEMBL | 467 | 4 | 2 | 5 | 4.4 | CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL524873 | 218116 | None | 0 | Rat | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 46227966 | 14184 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | -50 | 4 | ChEMBL | 502 | 4 | 3 | 5 | 4.1 | CC(C)(C)c1ccc(C(=O)N[C@@H]2CC[C@@]3(O)[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL1198704 | 14184 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | -50 | 4 | ChEMBL | 502 | 4 | 3 | 5 | 4.1 | CC(C)(C)c1ccc(C(=O)N[C@@H]2CC[C@@]3(O)[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL611932 | 14184 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | -50 | 4 | ChEMBL | 502 | 4 | 3 | 5 | 4.1 | CC(C)(C)c1ccc(C(=O)N[C@@H]2CC[C@@]3(O)[C@H]4Cc5ccc(O)c6c5[C@@]3(CCN4CC3CC3)[C@H]2O6)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL389521 | 214887 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | -11 | 2 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 9954388 | 99593 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -4 | 2 | ChEMBL | 429 | 2 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1CCc3c(Cl)ccc(Cl)c3C1)CC2 | 10.1021/jm991129q | |||
| CHEMBL283480 | 99593 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -4 | 2 | ChEMBL | 429 | 2 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1CCc3c(Cl)ccc(Cl)c3C1)CC2 | 10.1021/jm991129q | |||
| CHEMBL5081409 | 217235 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 134563496 | 174657 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 409 | 5 | 1 | 4 | 4.7 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CC(O)C4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4556227 | 174657 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 409 | 5 | 1 | 4 | 4.7 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CC(O)C4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 118718266 | 115368 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 479 | 6 | 0 | 3 | 6.6 | CN(C)C[C@]1(c2ccccn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| CHEMBL3349250 | 115368 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 479 | 6 | 0 | 3 | 6.6 | CN(C)C[C@]1(c2ccccn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| CHEMBL435511 | 216128 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CSSC[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm010092i | |||||
| 18782396 | 121749 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN(C1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3585388 | 121749 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN(C1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3586752 | 121749 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN(C1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| 44394284 | 66208 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 365 | 5 | 1 | 3 | 3.1 | CC(C)CCC(C)N1CCC(N2c3ccccc3CNS2(=O)=O)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184381 | 66208 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 365 | 5 | 1 | 3 | 3.1 | CC(C)CCC(C)N1CCC(N2c3ccccc3CNS2(=O)=O)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 44574588 | 178541 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 44 | 2 | ChEMBL | 443 | 4 | 1 | 2 | 6.9 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(C2CCCC2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL466067 | 178541 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 44 | 2 | ChEMBL | 443 | 4 | 1 | 2 | 6.9 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(C2CCCC2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| 44574585 | 178733 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 56 | 2 | ChEMBL | 469 | 4 | 1 | 2 | 7.0 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(c2cccc(F)c2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL467488 | 178733 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 56 | 2 | ChEMBL | 469 | 4 | 1 | 2 | 7.0 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(c2cccc(F)c2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| 11451023 | 107278 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 352 | 2 | 0 | 2 | 4.4 | O=C1Cc2ccccc2N1C1CCN(C2CCC3CCCCC3C2)CC1 | 10.1021/jm034249d | |||
| CHEMBL316699 | 107278 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 352 | 2 | 0 | 2 | 4.4 | O=C1Cc2ccccc2N1C1CCN(C2CCC3CCCCC3C2)CC1 | 10.1021/jm034249d | |||
| CHEMBL268394 | 213209 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCCC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL396972 | 214961 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 44394324 | 66176 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 9 | 2 | ChEMBL | 403 | 2 | 1 | 3 | 3.7 | O=S1(=O)NCc2ccccc2N1C1CCN(C2CCC3CCCCC3C2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184234 | 66176 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 9 | 2 | ChEMBL | 403 | 2 | 1 | 3 | 3.7 | O=S1(=O)NCc2ccccc2N1C1CCN(C2CCC3CCCCC3C2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 129188443 | 169640 | None | 4 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 324 | 3 | 0 | 2 | 5.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3ccc4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4435280 | 169640 | None | 4 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 324 | 3 | 0 | 2 | 5.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3ccc4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 129188443 | 169640 | None | 4 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 324 | 3 | 0 | 2 | 5.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3ccc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL4435280 | 169640 | None | 4 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 324 | 3 | 0 | 2 | 5.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3ccc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 122179061 | 121470 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 505 | 5 | 2 | 5 | 4.9 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1cccc(F)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581757 | 121470 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 505 | 5 | 2 | 5 | 4.9 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1cccc(F)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 44394283 | 66184 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 391 | 4 | 1 | 3 | 3.7 | CCCC1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184260 | 66184 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 391 | 4 | 1 | 3 | 3.7 | CCCC1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 10155966 | 189386 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 369 | 4 | 1 | 2 | 5.3 | OC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL511920 | 189386 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 369 | 4 | 1 | 2 | 5.3 | OC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1)c1ccccc1 | 10.1016/j.bmcl.2009.03.031 | |||
| 44394375 | 123751 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -2 | 2 | ChEMBL | 461 | 6 | 1 | 3 | 4.5 | O=S1(=O)NCc2ccccc2N1C1CCN(CCC(c2ccccc2)c2ccccc2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL362160 | 123751 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -2 | 2 | ChEMBL | 461 | 6 | 1 | 3 | 4.5 | O=S1(=O)NCc2ccccc2N1C1CCN(CCC(c2ccccc2)c2ccccc2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 10139672 | 125955 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 463 | 5 | 0 | 5 | 3.4 | COC(=O)CN1Cc2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL364844 | 125955 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 463 | 5 | 0 | 5 | 3.4 | COC(=O)CN1Cc2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2004.08.001 | |||
| 53325608 | 57327 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 439 | 4 | 1 | 6 | 3.9 | CN1CCN(c2nc3ccccc3n2C2CCN(C3(CO)CCCCCCC3)CC2)CC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650847 | 57327 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 439 | 4 | 1 | 6 | 3.9 | CN1CCN(c2nc3ccccc3n2C2CCN(C3(CO)CCCCCCC3)CC2)CC1 | 10.1016/j.bmc.2010.07.034 | |||
| 44456216 | 155490 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 979 | 32 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)CC)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL403588 | 155490 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 979 | 32 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)CC)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL398224 | 214979 | None | 0 | Mouse | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | None | None | None | CCC(CC)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL5093399 | 217915 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 10 | 2 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 134578494 | 196222 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 4 | 3 | ChEMBL | 425 | 6 | 1 | 4 | 5.7 | CCOC(=O)NCc1cc2ccccc2n1C1CCN([C@H]2CC[C@@H](C(C)C)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5419235 | 196222 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 4 | 3 | ChEMBL | 425 | 6 | 1 | 4 | 5.7 | CCOC(=O)NCc1cc2ccccc2n1C1CCN([C@H]2CC[C@@H](C(C)C)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 3655995 | 108801 | None | 1 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 11 | 2 | ChEMBL | 306 | 3 | 0 | 2 | 3.2 | O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL320874 | 108801 | None | 1 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 11 | 2 | ChEMBL | 306 | 3 | 0 | 2 | 3.2 | O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| 3655995 | 108801 | None | 1 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 11 | 2 | ChEMBL | 306 | 3 | 0 | 2 | 3.2 | O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1 | 10.1021/jm034249d | |||
| CHEMBL320874 | 108801 | None | 1 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 11 | 2 | ChEMBL | 306 | 3 | 0 | 2 | 3.2 | O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1 | 10.1021/jm034249d | |||
| 134563699 | 176180 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 440 | 7 | 2 | 3 | 5.3 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCCNC(N)=S)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4591048 | 176180 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 440 | 7 | 2 | 3 | 5.3 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCCNC(N)=S)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 44456187 | 95694 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 985 | 31 | 15 | 11 | -0.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL257921 | 95694 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 985 | 31 | 15 | 11 | -0.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 76320665 | 103393 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 102 | 2 | ChEMBL | 479 | 5 | 1 | 3 | 6.1 | CC(=O)N[C@@]1(c2ccccn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084549 | 103393 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 102 | 2 | ChEMBL | 479 | 5 | 1 | 3 | 6.1 | CC(=O)N[C@@]1(c2ccccn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL5070616 | 216729 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 20 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 44456141 | 95407 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 1043 | 31 | 15 | 11 | 0.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL256687 | 95407 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 1043 | 31 | 15 | 11 | 0.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 134563361 | 195627 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 4 | ChEMBL | 458 | 6 | 1 | 4 | 5.8 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNC(=O)c4cccnc4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5407403 | 195627 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 4 | ChEMBL | 458 | 6 | 1 | 4 | 5.8 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNC(=O)c4cccnc4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 44430602 | 144543 | None | 0 | Mouse | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL390658 | 144543 | None | 0 | Mouse | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL556556 | 144543 | None | 0 | Mouse | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL5081993 | 217269 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -2 | 3 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 9905428 | 4410 | None | 15 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 4 | 3 | ChEMBL | 326 | 2 | 0 | 2 | 4.2 | O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1021/jm034249d | |||
| CHEMBL101454 | 4410 | None | 15 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 4 | 3 | ChEMBL | 326 | 2 | 0 | 2 | 4.2 | O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1021/jm034249d | |||
| CHEMBL505824 | 216685 | None | 0 | Rat | Functional | pEC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL264846 | 213091 | None | 0 | Mouse | Functional | pEC50 | = | 8.6 | 8.6 | -17 | 3 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 25207948 | 183901 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | 18 | 2 | ChEMBL | 461 | 6 | 1 | 5 | 6.2 | CC1(N2CCC(n3c(-c4cccc(OCCO)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL480425 | 183901 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | 18 | 2 | ChEMBL | 461 | 6 | 1 | 5 | 6.2 | CC1(N2CCC(n3c(-c4cccc(OCCO)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL5074745 | 216818 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | 15 | 2 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL499157 | 216579 | None | 0 | Rat | Functional | pEC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL5081578 | 217242 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | None | None | None | CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 44248674 | 103455 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 442 | 4 | 0 | 2 | 6.8 | CN1CCCCC1[C@@H]1C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/jm9008218 | |||
| CHEMBL3084677 | 103455 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 442 | 4 | 0 | 2 | 6.8 | CN1CCCCC1[C@@H]1C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/jm9008218 | |||
| 45271534 | 197712 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 472 | 6 | 1 | 3 | 6.2 | OCCN1CCCCC1C1C[C@@H]2CC[C@@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/jm9008218 | |||
| CHEMBL551111 | 197712 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 472 | 6 | 1 | 3 | 6.2 | OCCN1CCCCC1C1C[C@@H]2CC[C@@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/jm9008218 | |||
| 45268153 | 198590 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 467 | 5 | 0 | 3 | 6.7 | N#CCN1CCCCC1C1C[C@@H]2CC[C@@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/jm9008218 | |||
| CHEMBL561115 | 198590 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 467 | 5 | 0 | 3 | 6.7 | N#CCN1CCCCC1C1C[C@@H]2CC[C@@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/jm9008218 | |||
| 45269032 | 198640 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 428 | 4 | 1 | 2 | 6.5 | Clc1ccccc1C(c1ccccc1Cl)N1[C@H]2CC[C@H]1CC(C1CCCCN1)C2 | 10.1021/jm9008218 | |||
| CHEMBL561373 | 198640 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 428 | 4 | 1 | 2 | 6.5 | Clc1ccccc1C(c1ccccc1Cl)N1[C@H]2CC[C@H]1CC(C1CCCCN1)C2 | 10.1021/jm9008218 | |||
| 44247589 | 103375 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 37 | 2 | ChEMBL | 483 | 5 | 1 | 3 | 5.7 | NC(=O)[C@@]1(c2ccc(F)cn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084529 | 103375 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 37 | 2 | ChEMBL | 483 | 5 | 1 | 3 | 5.7 | NC(=O)[C@@]1(c2ccc(F)cn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| 46227963 | 14181 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -3 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 3.8 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL1198701 | 14181 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -3 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 3.8 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL611929 | 14181 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -3 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 3.8 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| 9905428 | 4410 | None | 15 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 4 | 3 | ChEMBL | 326 | 2 | 0 | 2 | 4.2 | O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL101454 | 4410 | None | 15 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 4 | 3 | ChEMBL | 326 | 2 | 0 | 2 | 4.2 | O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| 9925137 | 120626 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | 2 | 2 | ChEMBL | 361 | 6 | 2 | 2 | 4.7 | CN(C)[C@]1(c2ccccc2)CC[C@@H](NCCc2c[nH]c3ccccc23)CC1 | 10.1021/ml500116x | |||
| CHEMBL3326222 | 120626 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | 2 | 2 | ChEMBL | 361 | 6 | 2 | 2 | 4.7 | CN(C)[C@]1(c2ccccc2)CC[C@@H](NCCc2c[nH]c3ccccc23)CC1 | 10.1021/ml500116x | |||
| CHEMBL3545626 | 120626 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | 2 | 2 | ChEMBL | 361 | 6 | 2 | 2 | 4.7 | CN(C)[C@]1(c2ccccc2)CC[C@@H](NCCc2c[nH]c3ccccc23)CC1 | 10.1021/ml500116x | |||
| 44394419 | 66232 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 377 | 2 | 1 | 3 | 3.4 | O=S1(=O)NCc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184451 | 66232 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 377 | 2 | 1 | 3 | 3.4 | O=S1(=O)NCc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 101886205 | 121752 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3585402 | 121752 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3586792 | 121752 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| 1684 | 3362 | None | 21 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(C21CCN(CC2)[C@H]1CC[C@H]2c3c1cccc3CCC2)c1ccccc1 | 10.1021/jm201629q | |||
| 9844019 | 3362 | None | 21 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(C21CCN(CC2)[C@H]1CC[C@H]2c3c1cccc3CCC2)c1ccccc1 | 10.1021/jm201629q | |||
| CHEMBL2088034 | 3362 | None | 21 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(C21CCN(CC2)[C@H]1CC[C@H]2c3c1cccc3CCC2)c1ccccc1 | 10.1021/jm201629q | |||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 86279209 | 111067 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 2 | ChEMBL | 414 | 3 | 0 | 2 | 5.9 | CCC1C(=O)N(C2CCN([C@H]3CC[C@@H]4CCCc5cccc3c54)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262544 | 111067 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 2 | ChEMBL | 414 | 3 | 0 | 2 | 5.9 | CCC1C(=O)N(C2CCN([C@H]3CC[C@@H]4CCCc5cccc3c54)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| 172439036 | 195311 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -467 | 3 | ChEMBL | 338 | 5 | 1 | 3 | 4.2 | Cc1ccc(C(CNC(=O)c2cc3ccccc3s2)N(C)C)cc1 | 10.1016/j.ejmech.2022.114728 | |||
| CHEMBL5400535 | 195311 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -467 | 3 | ChEMBL | 338 | 5 | 1 | 3 | 4.2 | Cc1ccc(C(CNC(=O)c2cc3ccccc3s2)N(C)C)cc1 | 10.1016/j.ejmech.2022.114728 | |||
| CHEMBL405645 | 215029 | None | 0 | Rat | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| 44394381 | 67001 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 25 | 2 | ChEMBL | 448 | 5 | 1 | 4 | 2.7 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CC(N)=O)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL186822 | 67001 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 25 | 2 | ChEMBL | 448 | 5 | 1 | 4 | 2.7 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CC(N)=O)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL507269 | 216774 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm800394v | |||||
| CHEMBL384866 | 214799 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(N)=O | 10.1021/jm010092i | |||||
| 134563683 | 195927 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 4 | ChEMBL | 431 | 6 | 1 | 4 | 4.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNS(C)(=O)=O)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5413519 | 195927 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 2 | 4 | ChEMBL | 431 | 6 | 1 | 4 | 4.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNS(C)(=O)=O)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 9844540 | 85753 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 411 | 4 | 1 | 2 | 6.1 | OC1(c2ccccc2)CCN(C(c2ccccc2Cl)c2ccccc2Cl)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL228911 | 85753 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 411 | 4 | 1 | 2 | 6.1 | OC1(c2ccccc2)CCN(C(c2ccccc2Cl)c2ccccc2Cl)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| 10274330 | 66694 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 430 | 4 | 0 | 4 | 3.8 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CC#N)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL185415 | 66694 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 430 | 4 | 0 | 4 | 3.8 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CC#N)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 9863568 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL388123 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL535844 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL541636 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| 53316968 | 57321 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 453 | 4 | 2 | 6 | 4.3 | CC1(C)CN(c2nc3ccccc3n2C2CCN(C3(CO)CCCCCCC3)CC2)CCN1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650841 | 57321 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 453 | 4 | 2 | 6 | 4.3 | CC1(C)CN(c2nc3ccccc3n2C2CCN(C3(CO)CCCCCCC3)CC2)CCN1 | 10.1016/j.bmc.2010.07.034 | |||
| 44456296 | 97773 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 909 | 31 | 15 | 11 | -2.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC=O)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL271478 | 97773 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 909 | 31 | 15 | 11 | -2.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC=O)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 44456298 | 168906 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 979 | 33 | 15 | 11 | -0.3 | CCCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL437601 | 168906 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 979 | 33 | 15 | 11 | -0.3 | CCCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL2372051 | 212632 | None | 0 | Mouse | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | None | None | None | CC[C@](C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL2372364 | 212632 | None | 0 | Mouse | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | None | None | None | CC[C@](C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 122179060 | 121469 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 521 | 5 | 2 | 5 | 5.4 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1cccc(Cl)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581756 | 121469 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 521 | 5 | 2 | 5 | 5.4 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1cccc(Cl)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 122179064 | 121473 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 477 | 5 | 2 | 6 | 4.3 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1ccoc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581762 | 121473 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 477 | 5 | 2 | 6 | 4.3 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1ccoc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL405645 | 215029 | None | 0 | Rat | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| CHEMBL427954 | 215857 | None | 0 | Rat | Functional | pEC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| 54756990 | 65725 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -2754 | 3 | ChEMBL | 543 | 7 | 2 | 5 | 5.7 | CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)CC(C)(C)c1ccccc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| CHEMBL1834411 | 65725 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -2754 | 3 | ChEMBL | 543 | 7 | 2 | 5 | 5.7 | CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)CC(C)(C)c1ccccc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/jm2003238 | |||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| CHEMBL5085090 | 217437 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 134563704 | 176739 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | 7 | 2 | ChEMBL | 381 | 6 | 1 | 3 | 5.4 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4451073 | 176739 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | 7 | 2 | ChEMBL | 381 | 6 | 1 | 3 | 5.4 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4597933 | 176739 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | 7 | 2 | ChEMBL | 381 | 6 | 1 | 3 | 5.4 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.6 | 7.6 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.6 | 7.6 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.6 | 7.6 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.6 | 7.6 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.6 | 7.6 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.6 | 7.6 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL424934 | 215788 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm010092i | |||||
| CHEMBL415781 | 215660 | None | 0 | Mouse | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL262928 | 213012 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(N)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| 10109899 | 85744 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 373 | 5 | 1 | 3 | 4.8 | COc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL228857 | 85744 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 373 | 5 | 1 | 3 | 4.8 | COc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL5094655 | 217995 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -1 | 2 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 9803475 | 77624 | None | 27 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 443 | 5 | 0 | 5 | 3.7 | COC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3cccc4ccccc34)CC2)C1=O | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL2088036 | 77624 | None | 27 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 443 | 5 | 0 | 5 | 3.7 | COC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3cccc4ccccc34)CC2)C1=O | 10.1021/acs.jmedchem.8b00435 | |||
| 10042904 | 163417 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 340 | 3 | 0 | 2 | 4.3 | CC(C)[C@H]1CC[C@@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1021/jm034249d | |||
| CHEMBL418980 | 163417 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 340 | 3 | 0 | 2 | 4.3 | CC(C)[C@H]1CC[C@@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1021/jm034249d | |||
| CHEMBL266667 | 213152 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 10042904 | 90491 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 2 | ChEMBL | 340 | 3 | 0 | 2 | 4.3 | CC(C)C1CCC(N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387187 | 90491 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 2 | 2 | ChEMBL | 340 | 3 | 0 | 2 | 4.3 | CC(C)C1CCC(N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL5094439 | 217985 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 5 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)c1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 25235412 | 103373 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 492 | 6 | 1 | 2 | 6.8 | CC(=O)NC[C@@]1(c2ccccc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084527 | 103373 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 492 | 6 | 1 | 2 | 6.8 | CC(=O)NC[C@@]1(c2ccccc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| 25235412 | 115394 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 492 | 6 | 1 | 2 | 6.8 | CC(=O)NC[C@]1(c2ccccc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| CHEMBL3349276 | 115394 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 492 | 6 | 1 | 2 | 6.8 | CC(=O)NC[C@]1(c2ccccc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| 44430588 | 86867 | None | 0 | Mouse | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL232245 | 86867 | None | 0 | Mouse | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL541911 | 86867 | None | 0 | Mouse | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| 44456220 | 155529 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 937 | 31 | 15 | 11 | -1.3 | CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL403807 | 155529 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 937 | 31 | 15 | 11 | -1.3 | CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 22558157 | 111070 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -1 | 3 | ChEMBL | 374 | 3 | 0 | 2 | 4.5 | CCC1C(=O)N(C2CCN(C3CCc4ccccc4C3)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262547 | 111070 | None | 0 | Human | Functional | pEC50 | = | 7.6 | 7.6 | -1 | 3 | ChEMBL | 374 | 3 | 0 | 2 | 4.5 | CCC1C(=O)N(C2CCN(C3CCc4ccccc4C3)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| 16665918 | 79780 | None | 0 | Human | Functional | pEC50 | = | 4.6 | 4.6 | - | 1 | ChEMBL | 370 | 2 | 1 | 1 | 5.9 | Fc1ccc2[nH]cc(C3CCN(C4Cc5cccc6cccc4c56)CC3)c2c1 | 10.1016/j.bmcl.2006.03.094 | |||
| CHEMBL211722 | 79780 | None | 0 | Human | Functional | pEC50 | = | 4.6 | 4.6 | - | 1 | ChEMBL | 370 | 2 | 1 | 1 | 5.9 | Fc1ccc2[nH]cc(C3CCN(C4Cc5cccc6cccc4c56)CC3)c2c1 | 10.1016/j.bmcl.2006.03.094 | |||
| 134578342 | 173164 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 438 | 8 | 2 | 4 | 4.7 | CCNCC(=O)NCc1cn(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc12 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4519453 | 173164 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 438 | 8 | 2 | 4 | 4.7 | CCNCC(=O)NCc1cn(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc12 | 10.1021/acs.jmedchem.9b02134 | |||
| 44181744 | 103428 | None | 6 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 77 | 2 | ChEMBL | 422 | 4 | 0 | 2 | 6.9 | Clc1ccccc1C(c1ccccc1Cl)N1[C@H]2CC[C@@H]1C[C@H](c1ccccn1)C2 | 10.1021/jm9008218 | |||
| CHEMBL3084634 | 103428 | None | 6 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 77 | 2 | ChEMBL | 422 | 4 | 0 | 2 | 6.9 | Clc1ccccc1C(c1ccccc1Cl)N1[C@H]2CC[C@@H]1C[C@H](c1ccccn1)C2 | 10.1021/jm9008218 | |||
| 11461888 | 4628 | None | 4 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 338 | 2 | 0 | 2 | 4.0 | O=C1Cc2ccccc2N1C1CCN(C2C3CCCC2CCC3)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL102900 | 4628 | None | 4 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 338 | 2 | 0 | 2 | 4.0 | O=C1Cc2ccccc2N1C1CCN(C2C3CCCC2CCC3)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| 11461888 | 4628 | None | 4 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 338 | 2 | 0 | 2 | 4.0 | O=C1Cc2ccccc2N1C1CCN(C2C3CCCC2CCC3)CC1 | 10.1021/jm034249d | |||
| CHEMBL102900 | 4628 | None | 4 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 338 | 2 | 0 | 2 | 4.0 | O=C1Cc2ccccc2N1C1CCN(C2C3CCCC2CCC3)CC1 | 10.1021/jm034249d | |||
| CHEMBL405948 | 215047 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 9863568 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL388123 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL535844 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL541636 | 142176 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL3809510 | 214735 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | CC[C@H](C)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(C)=O)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.5b01976 | |||||
| CHEMBL394588 | 214937 | None | 0 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | CCCC(CCC)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL442113 | 216368 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 129188464 | 195438 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 354 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CO)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5403724 | 195438 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 354 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CO)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL1631922 | 211274 | None | 0 | Mouse | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]2CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc3ccccc3)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N2)CCCCNC(=O)C[C@@H](C(N)=O)NC1=O | 10.1021/jm101139f | |||||
| CHEMBL1631922 | 211274 | None | 0 | Mouse | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]2CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc3ccccc3)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N2)CCCCNC(=O)C[C@@H](C(N)=O)NC1=O | 10.1021/jm101139f | |||||
| 25208249 | 184071 | None | 0 | Human | Functional | pEC50 | = | 8.5 | 8.5 | 1202 | 2 | ChEMBL | 441 | 3 | 0 | 4 | 7.6 | CC1(N2CCC(n3c(-c4cc5ccccc5o4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL481707 | 184071 | None | 0 | Human | Functional | pEC50 | = | 8.5 | 8.5 | 1202 | 2 | ChEMBL | 441 | 3 | 0 | 4 | 7.6 | CC1(N2CCC(n3c(-c4cc5ccccc5o4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL555757 | 218222 | None | 0 | Rat | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL526333 | 218170 | None | 0 | Rat | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL558807 | 218232 | None | 0 | Rat | Functional | pEC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 44551464 | 14183 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 1 | 4 | ChEMBL | 572 | 4 | 3 | 5 | 3.4 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(I)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL1198703 | 14183 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 1 | 4 | ChEMBL | 572 | 4 | 3 | 5 | 3.4 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(I)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL611931 | 14183 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 1 | 4 | ChEMBL | 572 | 4 | 3 | 5 | 3.4 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(I)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL5079758 | 217126 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 151 | 2 | ChEMBL | None | None | None | CCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL1631921 | 211273 | None | 0 | Mouse | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/jm101139f | |||||
| 1641 | 2728 | None | 8 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -11 | 7 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1016/j.bmc.2009.07.069 | |||
| 3829 | 2728 | None | 8 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -11 | 7 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1016/j.bmc.2009.07.069 | |||
| 5497186 | 2728 | None | 8 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -11 | 7 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL567175 | 2728 | None | 8 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -11 | 7 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL406718 | 215077 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(N)=O | 10.1021/jm010092i | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| CHEMBL455289 | 216472 | None | 0 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL1631925 | 211276 | None | 0 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||||
| CHEMBL1631925 | 211276 | None | 0 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||||
| CHEMBL5081139 | 217214 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 12 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(N)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 71624387 | 90499 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 3 | 2 | ChEMBL | 340 | 2 | 0 | 2 | 4.7 | CC1C(=O)N(C2CCN(C3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387195 | 90499 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 3 | 2 | ChEMBL | 340 | 2 | 0 | 2 | 4.7 | CC1C(=O)N(C2CCN(C3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| 10134217 | 66297 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 377 | 3 | 1 | 3 | 3.8 | CC(C)C1CCC(N2CCC(N3c4ccccc4NS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184698 | 66297 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 377 | 3 | 1 | 3 | 3.8 | CC(C)C1CCC(N2CCC(N3c4ccccc4NS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL269029 | 213234 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm800394v | |||||
| CHEMBL269029 | 213234 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 129188458 | 195467 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | 368 | 5 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CCO)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5404274 | 195467 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | 368 | 5 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CCO)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL265544 | 213112 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| 44456185 | 166716 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 951 | 32 | 15 | 11 | -0.9 | CCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL428076 | 166716 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 951 | 32 | 15 | 11 | -0.9 | CCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 5268 | 3656 | None | 31 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 379 | 3 | 1 | 5 | 2.3 | O=C1NCN(C21CCN(CC2)CC1COc2c(O1)cccc2)c1ccccc1 | 10.1039/C4MD00082J | |||
| 53 | 3656 | None | 31 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 379 | 3 | 1 | 5 | 2.3 | O=C1NCN(C21CCN(CC2)CC1COc2c(O1)cccc2)c1ccccc1 | 10.1039/C4MD00082J | |||
| CHEMBL300555 | 3656 | None | 31 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 379 | 3 | 1 | 5 | 2.3 | O=C1NCN(C21CCN(CC2)CC1COc2c(O1)cccc2)c1ccccc1 | 10.1039/C4MD00082J | |||
| CHEMBL505873 | 216687 | None | 0 | Rat | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 10137876 | 125116 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 435 | 5 | 1 | 4 | 3.2 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CCO)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL364398 | 125116 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 435 | 5 | 1 | 4 | 3.2 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CCO)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 9863568 | 142176 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL388123 | 142176 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL535844 | 142176 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| CHEMBL541636 | 142176 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 357 | 4 | 1 | 2 | 5.1 | Cc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1 | 10.1016/j.bmcl.2007.03.061 | |||
| 122179056 | 121465 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 501 | 5 | 2 | 5 | 5.0 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1cccc(C)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581752 | 121465 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 501 | 5 | 2 | 5 | 5.0 | CO[C@]12CC[C@@]3(C[C@]1(C)[C@H](O)c1cccc(C)c1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 10110916 | 66283 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 389 | 2 | 1 | 3 | 4.0 | O=S1(=O)Nc2ccccc2N1C1CCN(C2CCC3CCCCC3C2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184646 | 66283 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 389 | 2 | 1 | 3 | 4.0 | O=S1(=O)Nc2ccccc2N1C1CCN(C2CCC3CCCCC3C2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 44394487 | 65467 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 512 | 7 | 1 | 5 | 2.8 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CCNS(C)(=O)=O)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL182967 | 65467 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 512 | 7 | 1 | 5 | 2.8 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CCNS(C)(=O)=O)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 134563466 | 171395 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 412 | 5 | 2 | 3 | 4.8 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CNC(N)=S)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4460695 | 171395 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 412 | 5 | 2 | 3 | 4.8 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CNC(N)=S)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 44574789 | 178653 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 504 | 6 | 1 | 2 | 7.1 | O=C(NC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl)C1CC1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL466919 | 178653 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 504 | 6 | 1 | 2 | 7.1 | O=C(NC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl)C1CC1 | 10.1016/j.bmcl.2009.03.031 | |||
| 16131448 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1681 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1688 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44361543 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 56947112 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 7.5 | 7.5 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL1631920 | 211272 | None | 0 | Mouse | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | None | None | None | CC(=O)NCCCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O | 10.1021/jm101139f | |||||
| CHEMBL1631920 | 211272 | None | 0 | Mouse | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | None | None | None | CC(=O)NCCCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O | 10.1021/jm101139f | |||||
| 53316969 | 57330 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 3 | 3 | ChEMBL | 357 | 3 | 2 | 4 | 3.4 | O=c1[nH]c2ccccc2n1C1CCN(C2(CO)CCCCCCC2)CC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650851 | 57330 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 3 | 3 | ChEMBL | 357 | 3 | 2 | 4 | 3.4 | O=c1[nH]c2ccccc2n1C1CCN(C2(CO)CCCCCCC2)CC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL5091985 | 217829 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](CCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 10385808 | 66163 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 38 | 2 | ChEMBL | 391 | 3 | 1 | 3 | 3.5 | CC(C)C1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184127 | 66163 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 38 | 2 | ChEMBL | 391 | 3 | 1 | 3 | 3.5 | CC(C)C1CCC(N2CCC(N3c4ccccc4CNS3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 53322245 | 57328 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 9 | 3 | ChEMBL | 439 | 4 | 2 | 6 | 3.9 | CC1CN(c2nc3ccccc3n2C2CCN(C3(CO)CCCCCCC3)CC2)CCN1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650848 | 57328 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 9 | 3 | ChEMBL | 439 | 4 | 2 | 6 | 3.9 | CC1CN(c2nc3ccccc3n2C2CCN(C3(CO)CCCCCCC3)CC2)CCN1 | 10.1016/j.bmc.2010.07.034 | |||
| 9885005 | 57564 | None | 0 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 355 | 3 | 1 | 3 | 3.6 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)NCN3c2ccccc2)CC1 | 10.1016/s0960-894x(00)00111-6 | |||
| CHEMBL166387 | 57564 | None | 0 | Rat | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 355 | 3 | 1 | 3 | 3.6 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)NCN3c2ccccc2)CC1 | 10.1016/s0960-894x(00)00111-6 | |||
| 15512229 | 3385 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(C21CCN(CC2)[C@@H]1Cc2c3c1cccc3ccc2)c1ccccc1 | 10.1016/s0960-894x(99)00385-6 | |||
| 8864 | 3385 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(C21CCN(CC2)[C@@H]1Cc2c3c1cccc3ccc2)c1ccccc1 | 10.1016/s0960-894x(99)00385-6 | |||
| CHEMBL355202 | 3385 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(C21CCN(CC2)[C@@H]1Cc2c3c1cccc3ccc2)c1ccccc1 | 10.1016/s0960-894x(99)00385-6 | |||
| 1682 | 2852 | None | 17 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | -147 | 3 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.04.086 | |||||
| 6324645 | 2852 | None | 17 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | -147 | 3 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.04.086 | |||||
| CHEMBL384755 | 2852 | None | 17 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | -147 | 3 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.04.086 | |||||
| CHEMBL500773 | 216615 | None | 0 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL1631921 | 211273 | None | 0 | Mouse | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/jm101139f | |||||
| CHEMBL5081993 | 217269 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | -2 | 3 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL505632 | 216683 | None | 0 | Rat | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL1162357 | 210974 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CCCCNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm800394v | |||||
| CHEMBL443591 | 216387 | None | 0 | Human | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]1CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm010092i | |||||
| CHEMBL394774 | 214939 | None | 0 | Mouse | Functional | pEC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 3917 | 3930 | None | 1 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -28 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44430609 | 3930 | None | 1 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -28 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL409969 | 3930 | None | 1 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -28 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44388474 | 161136 | None | 0 | Human | Functional | pEC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 1970 | 69 | 33 | 31 | -15.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL411649 | 161136 | None | 0 | Human | Functional | pEC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 1970 | 69 | 33 | 31 | -15.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2022.114728 | |||||
| 10022859 | 99224 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 63 | 2 | ChEMBL | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(c2ccccc2)C12CCN(C1Cc3cccc4cccc1c34)CC2 | 10.1021/jm991129q | |||
| CHEMBL281274 | 99224 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 63 | 2 | ChEMBL | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(c2ccccc2)C12CCN(C1Cc3cccc4cccc1c34)CC2 | 10.1021/jm991129q | |||
| CHEMBL5070145 | 216715 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 90655973 | 111068 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 414 | 3 | 0 | 2 | 5.9 | CCC1C(=O)N(C2CCN([C@@H]3CC[C@@H]4CCCc5cccc3c54)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262545 | 111068 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 414 | 3 | 0 | 2 | 5.9 | CCC1C(=O)N(C2CCN([C@@H]3CC[C@@H]4CCCc5cccc3c54)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL219144 | 211867 | None | 0 | Rat | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| 122179050 | 121458 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 485 | 5 | 2 | 5 | 4.5 | CO[C@]12C=C[C@@]3(C[C@]1(C)[C@H](O)c1ccccc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581740 | 121458 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 485 | 5 | 2 | 5 | 4.5 | CO[C@]12C=C[C@@]3(C[C@]1(C)[C@H](O)c1ccccc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 16007142 | 139440 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 353 | 2 | 1 | 2 | 5.2 | c1cc2c3c(cccc3c1)C(N1CCC(c3c[nH]c4ncccc34)CC1)C2 | 10.1016/j.bmcl.2006.03.094 | |||
| CHEMBL379297 | 139440 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 353 | 2 | 1 | 2 | 5.2 | c1cc2c3c(cccc3c1)C(N1CCC(c3c[nH]c4ncccc34)CC1)C2 | 10.1016/j.bmcl.2006.03.094 | |||
| 122179585 | 121751 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 381 | 2 | 1 | 4 | 3.1 | O=C1NCN(c2ccccc2)C12CCN(C1CCOc3cccc(F)c31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3585401 | 121751 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 381 | 2 | 1 | 4 | 3.1 | O=C1NCN(c2ccccc2)C12CCN(C1CCOc3cccc(F)c31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3586789 | 121751 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 381 | 2 | 1 | 4 | 3.1 | O=C1NCN(c2ccccc2)C12CCN(C1CCOc3cccc(F)c31)CC2 | 10.1039/C4MD00082J | |||
| 12986253 | 120616 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -3 | 2 | ChEMBL | 379 | 7 | 2 | 2 | 4.3 | CN(C)[C@]1(c2ccccc2)CC[C@@H](NC(=O)NCCCc2ccccc2)CC1 | 10.1021/ml500116x | |||
| CHEMBL3325881 | 120616 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -3 | 2 | ChEMBL | 379 | 7 | 2 | 2 | 4.3 | CN(C)[C@]1(c2ccccc2)CC[C@@H](NC(=O)NCCCc2ccccc2)CC1 | 10.1021/ml500116x | |||
| CHEMBL3545610 | 120616 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -3 | 2 | ChEMBL | 379 | 7 | 2 | 2 | 4.3 | CN(C)[C@]1(c2ccccc2)CC[C@@H](NC(=O)NCCCc2ccccc2)CC1 | 10.1021/ml500116x | |||
| CHEMBL406010 | 215051 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | None | None | None | C[C@@H]1NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm010092i | |||||
| 76316935 | 103376 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 8 | 2 | ChEMBL | 499 | 5 | 1 | 3 | 6.2 | NC(=O)[C@@]1(c2ccc(Cl)cn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084530 | 103376 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | 8 | 2 | ChEMBL | 499 | 5 | 1 | 3 | 6.2 | NC(=O)[C@@]1(c2ccc(Cl)cn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| 44456140 | 168817 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 951 | 31 | 15 | 11 | -1.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL436852 | 168817 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 951 | 31 | 15 | 11 | -1.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 134578506 | 174404 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 437 | 5 | 1 | 4 | 5.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CCC(O)CC4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4550088 | 174404 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 437 | 5 | 1 | 4 | 5.5 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CCC(O)CC4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 172439036 | 195311 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -467 | 3 | ChEMBL | 338 | 5 | 1 | 3 | 4.2 | Cc1ccc(C(CNC(=O)c2cc3ccccc3s2)N(C)C)cc1 | 10.1016/j.ejmech.2022.114728 | |||
| CHEMBL5400535 | 195311 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -467 | 3 | ChEMBL | 338 | 5 | 1 | 3 | 4.2 | Cc1ccc(C(CNC(=O)c2cc3ccccc3s2)N(C)C)cc1 | 10.1016/j.ejmech.2022.114728 | |||
| 101886199 | 121750 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3585403 | 121750 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| CHEMBL3586777 | 121750 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 363 | 2 | 1 | 4 | 2.9 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCOc3ccccc31)CC2 | 10.1039/C4MD00082J | |||
| 73350483 | 90497 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 2 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN(C2CC[C@H]3CCCc4cccc2c43)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387193 | 90497 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 2 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN(C2CC[C@H]3CCCc4cccc2c43)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| 44456299 | 97532 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 979 | 31 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL270216 | 97532 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 979 | 31 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 44430590 | 161418 | None | 0 | Mouse | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL412461 | 161418 | None | 0 | Mouse | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL557791 | 161418 | None | 0 | Mouse | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| 155542684 | 173252 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 466 | 10 | 2 | 4 | 5.6 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CNC(=O)CCCCCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4521436 | 173252 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 466 | 10 | 2 | 4 | 5.6 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CNC(=O)CCCCCN)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 44574629 | 188948 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 458 | 4 | 2 | 3 | 4.9 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(C2CCNC2=O)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL506634 | 188948 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 458 | 4 | 2 | 3 | 4.9 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(C2CCNC2=O)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL5072525 | 216770 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL5090780 | 217770 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 118718291 | 115393 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 478 | 6 | 0 | 2 | 7.2 | CN(C)C[C@]1(c2ccccc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| CHEMBL3349275 | 115393 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 478 | 6 | 0 | 2 | 7.2 | CN(C)C[C@]1(c2ccccc2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2008.10.088 | |||
| 44394405 | 64588 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 505 | 5 | 0 | 5 | 4.6 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CC(=O)OC(C)(C)C)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL181545 | 64588 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 505 | 5 | 0 | 5 | 4.6 | CC(C)C1CCC(N2CCC(N3c4ccccc4CN(CC(=O)OC(C)(C)C)S3(=O)=O)CC2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 172459742 | 196409 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 432 | 6 | 2 | 4 | 3.8 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNS(N)(=O)=O)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5423260 | 196409 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 432 | 6 | 2 | 4 | 3.8 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNS(N)(=O)=O)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 44394344 | 66200 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 383 | 2 | 1 | 3 | 2.5 | O=S1(=O)NCc2ccccc2N1C1CCN(C2Cc3ccccc3C2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184328 | 66200 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 383 | 2 | 1 | 3 | 2.5 | O=S1(=O)NCc2ccccc2N1C1CCN(C2Cc3ccccc3C2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| 16131448 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.3 | 8.3 | -7 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1681 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.3 | 8.3 | -7 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1688 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.3 | 8.3 | -7 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 44361543 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.3 | 8.3 | -7 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 56947112 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.3 | 8.3 | -7 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| CHEMBL396460 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.3 | 8.3 | -7 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 16131448 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.3 | 8.3 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1681 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.3 | 8.3 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1688 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.3 | 8.3 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 44361543 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.3 | 8.3 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 56947112 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.3 | 8.3 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| CHEMBL396460 | 2849 | None | 24 | Mouse | Functional | pEC50 | = | 8.3 | 8.3 | -14 | 5 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 8.3 | 8.3 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 25207946 | 191407 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 275 | 3 | ChEMBL | 469 | 3 | 0 | 3 | 7.9 | CC1(N2CCC(n3c(-c4cccc(C(F)(F)F)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL519100 | 191407 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 275 | 3 | ChEMBL | 469 | 3 | 0 | 3 | 7.9 | CC1(N2CCC(n3c(-c4cccc(C(F)(F)F)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL503512 | 216657 | None | 0 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL504587 | 216669 | None | 0 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 129188452 | 195525 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 4 | 2 | ChEMBL | 353 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CN)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5405339 | 195525 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 4 | 2 | ChEMBL | 353 | 4 | 1 | 3 | 5.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CN)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL504587 | 216669 | None | 0 | Rat | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL510117 | 218071 | None | 0 | Rat | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 44574586 | 189432 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 33 | 2 | ChEMBL | 453 | 4 | 1 | 4 | 5.7 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(c2ccncn2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL512411 | 189432 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 33 | 2 | ChEMBL | 453 | 4 | 1 | 4 | 5.7 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(c2ccncn2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| 44574672 | 189493 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 10 | 2 | ChEMBL | 451 | 5 | 0 | 2 | 7.3 | COC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL512950 | 189493 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 10 | 2 | ChEMBL | 451 | 5 | 0 | 2 | 7.3 | COC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| 134563420 | 195891 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 395 | 5 | 1 | 3 | 5.1 | CC(=O)NCc1cc2ccccc2n1C1CCN([C@H]2CC[C@@H](C(C)C)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5412738 | 195891 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 395 | 5 | 1 | 3 | 5.1 | CC(=O)NCc1cc2ccccc2n1C1CCN([C@H]2CC[C@@H](C(C)C)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL510117 | 218071 | None | 0 | Rat | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 90655974 | 111069 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | 374 | 3 | 0 | 2 | 5.1 | CCC1C(=O)N(C2CCN(C3CCCc4ccccc43)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262546 | 111069 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | 374 | 3 | 0 | 2 | 5.1 | CCC1C(=O)N(C2CCN(C3CCCc4ccccc43)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| 10714523 | 99161 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | 7 | 2 | ChEMBL | 375 | 2 | 1 | 3 | 3.8 | Cc1cccc2c1CCCC2N1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1021/jm991129q | |||
| CHEMBL280827 | 99161 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | 7 | 2 | ChEMBL | 375 | 2 | 1 | 3 | 3.8 | Cc1cccc2c1CCCC2N1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1021/jm991129q | |||
| 172454217 | 196006 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | 471 | 5 | 0 | 5 | 4.7 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CN4CCS(=O)(=O)CC4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5415010 | 196006 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | 471 | 5 | 0 | 5 | 4.7 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CN4CCS(=O)(=O)CC4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 44455999 | 97564 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 965 | 32 | 15 | 11 | -0.7 | CCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL270394 | 97564 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 965 | 32 | 15 | 11 | -0.7 | CCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 90655972 | 111066 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 14 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN([C@@H]2CC[C@@H]3CCCc4cccc2c43)CC1 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262543 | 111066 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 14 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN([C@@H]2CC[C@@H]3CCCc4cccc2c43)CC1 | 10.1016/j.bmc.2014.02.047 | |||
| 53319617 | 57329 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 441 | 4 | 1 | 4 | 5.8 | OCC1(N2CCC(n3c(-c4ccc(F)c(Cl)c4)nc4ccccc43)CC2)CCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650849 | 57329 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 441 | 4 | 1 | 4 | 5.8 | OCC1(N2CCC(n3c(-c4ccc(F)c(Cl)c4)nc4ccccc43)CC2)CCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL5073730 | 216790 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 134563691 | 171165 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 381 | 5 | 0 | 3 | 5.6 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN(C)C)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4457077 | 171165 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 381 | 5 | 0 | 3 | 5.6 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN(C)C)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 44574743 | 178706 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 14 | 2 | ChEMBL | 494 | 5 | 1 | 3 | 7.0 | COC(=O)NC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL467313 | 178706 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 14 | 2 | ChEMBL | 494 | 5 | 1 | 3 | 7.0 | COC(=O)NC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| 172439310 | 194978 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 1 | 3 | ChEMBL | 515 | 6 | 1 | 4 | 7.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNC(=O)c4ccc(C(F)(F)F)o4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5394355 | 194978 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 1 | 3 | ChEMBL | 515 | 6 | 1 | 4 | 7.0 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNC(=O)c4ccc(C(F)(F)F)o4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 129188459 | 175272 | None | 4 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 326 | 3 | 0 | 2 | 4.7 | CC(C)[C@H]1CC[C@@H](N2CCC(N3CCc4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4570328 | 175272 | None | 4 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 326 | 3 | 0 | 2 | 4.7 | CC(C)[C@H]1CC[C@@H](N2CCC(N3CCc4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 71624270 | 90498 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 2 | 2 | ChEMBL | 354 | 3 | 0 | 2 | 4.8 | CC1C(=O)N(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387194 | 90498 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 2 | 2 | ChEMBL | 354 | 3 | 0 | 2 | 4.8 | CC1C(=O)N(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| 44430588 | 86867 | None | 0 | Mouse | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL232245 | 86867 | None | 0 | Mouse | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL541911 | 86867 | None | 0 | Mouse | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 1849 | 63 | 30 | 26 | -10.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL5086409 | 217517 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL413944 | 215563 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 44413442 | 79974 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 400 | 2 | 1 | 1 | 6.8 | Cc1[nH]c2ccc(Cl)cc2c1C1CCN(C2Cc3cccc4cccc2c34)CC1 | 10.1016/j.bmcl.2006.03.094 | |||
| CHEMBL212575 | 79974 | None | 0 | Human | Functional | pEC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 400 | 2 | 1 | 1 | 6.8 | Cc1[nH]c2ccc(Cl)cc2c1C1CCN(C2Cc3cccc4cccc2c34)CC1 | 10.1016/j.bmcl.2006.03.094 | |||
| 44394559 | 66329 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 407 | 3 | 1 | 3 | 3.7 | O=S1(=O)NCc2ccccc2N1C1CCN(Cc2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL184865 | 66329 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 407 | 3 | 1 | 3 | 3.7 | O=S1(=O)NCc2ccccc2N1C1CCN(Cc2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL5092388 | 217855 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -8 | 2 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 134578456 | 172240 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 423 | 5 | 1 | 4 | 5.1 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CC[C@@H](O)C4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4473045 | 172240 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 423 | 5 | 1 | 4 | 5.1 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CC[C@@H](O)C4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 1682 | 2852 | None | 17 | Rat | Functional | pEC50 | = | 6.2 | 6.2 | -147 | 3 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.04.086 | |||||
| 6324645 | 2852 | None | 17 | Rat | Functional | pEC50 | = | 6.2 | 6.2 | -147 | 3 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.04.086 | |||||
| CHEMBL384755 | 2852 | None | 17 | Rat | Functional | pEC50 | = | 6.2 | 6.2 | -147 | 3 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.04.086 | |||||
| 11848793 | 189433 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 63 | 2 | ChEMBL | 464 | 5 | 1 | 2 | 6.1 | NC(=O)C1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL512414 | 189433 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 63 | 2 | ChEMBL | 464 | 5 | 1 | 2 | 6.1 | NC(=O)C1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| 24800107 | 191970 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 2 | 3 | ChEMBL | 437 | 3 | 1 | 5 | 5.4 | CC1CN(c2nc3ccccc3n2C2CCN(C3(C)CCCCCCC3)CC2)CC(C)N1 | 10.1021/jm7012979 | |||
| CHEMBL519925 | 191970 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 2 | 3 | ChEMBL | 437 | 3 | 1 | 5 | 5.4 | CC1CN(c2nc3ccccc3n2C2CCN(C3(C)CCCCCCC3)CC2)CC(C)N1 | 10.1021/jm7012979 | |||
| 71624388 | 90501 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 5 | 2 | ChEMBL | 354 | 3 | 0 | 2 | 5.1 | CCC1C(=O)N(C2CCN(C3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387197 | 90501 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 5 | 2 | ChEMBL | 354 | 3 | 0 | 2 | 5.1 | CCC1C(=O)N(C2CCN(C3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| 24798598 | 112648 | None | 12 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -23 | 2 | ChEMBL | 364 | 2 | 2 | 2 | 4.8 | CN[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(F)ccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3301613 | 112648 | None | 12 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -23 | 2 | ChEMBL | 364 | 2 | 2 | 2 | 4.8 | CN[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(F)ccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3325959 | 112648 | None | 12 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -23 | 2 | ChEMBL | 364 | 2 | 2 | 2 | 4.8 | CN[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(F)ccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL5072270 | 216765 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -3 | 2 | ChEMBL | None | None | None | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL442305 | 216371 | None | 0 | Rat | Functional | pEC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| CHEMBL427954 | 215857 | None | 0 | Rat | Functional | pEC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| 44574631 | 178614 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 457 | 4 | 2 | 4 | 5.1 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(C2=NCCCN2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL466679 | 178614 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 457 | 4 | 2 | 4 | 5.1 | Cc1ccc(C(c2ccccc2Cl)N2C3CCC2CC(O)(C2=NCCCN2)C3)c(Cl)c1 | 10.1016/j.bmcl.2009.03.031 | |||
| 76324309 | 103377 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | 6 | 2 | ChEMBL | 543 | 5 | 1 | 3 | 6.3 | NC(=O)[C@@]1(c2ccc(Br)cn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084531 | 103377 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | 6 | 2 | ChEMBL | 543 | 5 | 1 | 3 | 6.3 | NC(=O)[C@@]1(c2ccc(Br)cn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL234724 | 211997 | None | 0 | Mouse | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCCC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL5075880 | 216890 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](CN)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL415583 | 215651 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | None | None | None | COc1ccc(C[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)O)cc1 | 10.1021/jm010221v | |||||
| 16131448 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 1681 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 1688 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 44361543 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 56947112 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Functional | pEC50 | = | 7.2 | 7.2 | -2 | 5 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 129188454 | 169936 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | 46 | 2 | ChEMBL | 367 | 4 | 1 | 4 | 5.3 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(/C=N/O)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4439811 | 169936 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | 46 | 2 | ChEMBL | 367 | 4 | 1 | 4 | 5.3 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(/C=N/O)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL5081432 | 217236 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | 12 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL5092204 | 217842 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 134578291 | 196080 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 5 | 3 | ChEMBL | 407 | 5 | 0 | 3 | 6.1 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CN4CCCC4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5416582 | 196080 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 5 | 3 | ChEMBL | 407 | 5 | 0 | 3 | 6.1 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CN4CCCC4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 146034955 | 174742 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 3.9 | CCn1c(=O)n([C@@H]2CCN(C3CCC(C(C)C)CC3)C[C@H]2CO)c2ccccc21 | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL4558048 | 174742 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 3.9 | CCn1c(=O)n([C@@H]2CCN(C3CCC(C(C)C)CC3)C[C@H]2CO)c2ccccc21 | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL410167 | 215263 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(I)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010221v | |||||
| 122179053 | 121461 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -33 | 2 | ChEMBL | 503 | 5 | 2 | 5 | 4.7 | CO[C@]12C=C[C@@]3(C[C@]1(C)[C@H](O)c1ccc(F)cc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| CHEMBL3581743 | 121461 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -33 | 2 | ChEMBL | 503 | 5 | 2 | 5 | 4.7 | CO[C@]12C=C[C@@]3(C[C@]1(C)[C@H](O)c1ccc(F)cc1)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 | 10.1021/acs.jmedchem.5b00130 | |||
| 44430605 | 166499 | None | 0 | Mouse | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 1835 | 63 | 30 | 26 | -10.9 | CCC(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL427699 | 166499 | None | 0 | Mouse | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 1835 | 63 | 30 | 26 | -10.9 | CCC(C)(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| 1682 | 2852 | None | 17 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm800394v | |||||
| 6324645 | 2852 | None | 17 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm800394v | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 7 | 3 | ChEMBL | None | None | None | None | 10.1021/jm800394v | |||||
| 90655978 | 111074 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 9 | 2 | ChEMBL | 362 | 6 | 0 | 2 | 4.6 | CCC1C(=O)N(C2CCN(CCCc3ccccc3)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262551 | 111074 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 9 | 2 | ChEMBL | 362 | 6 | 0 | 2 | 4.6 | CCC1C(=O)N(C2CCN(CCCc3ccccc3)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| 146034954 | 171112 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 425 | 5 | 1 | 5 | 4.3 | CCn1c(=O)n([C@@H]2CCN(CC3CCCC4CCCCC43)C[C@H]2CO)c2ccccc21 | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL4456531 | 171112 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 425 | 5 | 1 | 5 | 4.3 | CCn1c(=O)n([C@@H]2CCN(CC3CCCC4CCCCC43)C[C@H]2CO)c2ccccc21 | 10.1021/acs.jmedchem.8b00435 | |||
| 44332117 | 107957 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 352 | 2 | 0 | 2 | 4.4 | O=C1Cc2ccccc2N1C1CCN(C2CCC3CCCC[C@@H]3C2)CC1 | 10.1021/jm034249d | |||
| CHEMBL319307 | 107957 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 352 | 2 | 0 | 2 | 4.4 | O=C1Cc2ccccc2N1C1CCN(C2CCC3CCCC[C@@H]3C2)CC1 | 10.1021/jm034249d | |||
| 44430590 | 161418 | None | 0 | Mouse | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL412461 | 161418 | None | 0 | Mouse | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| CHEMBL557791 | 161418 | None | 0 | Mouse | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 1863 | 64 | 30 | 26 | -10.2 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||
| 44574744 | 189416 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 60 | 2 | ChEMBL | 436 | 4 | 1 | 2 | 6.6 | NC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL512258 | 189416 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 60 | 2 | ChEMBL | 436 | 4 | 1 | 2 | 6.6 | NC1(c2ccccc2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.031 | |||
| 10160920 | 66994 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 447 | 6 | 0 | 3 | 5.0 | CCCCN1Cc2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2004.08.001 | |||
| CHEMBL186773 | 66994 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 447 | 6 | 0 | 3 | 5.0 | CCCCN1Cc2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2004.08.001 | |||
| 56664973 | 65722 | None | 1 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -12 | 2 | ChEMBL | 481 | 6 | 2 | 5 | 4.8 | CCC(C)(C)[C@](C)(O)[C@H]1C[C@@]23CC[C@]1(OC)[C@@H]1Oc4c(O)ccc5c4[C@@]12CCN(CC1CC1)[C@@H]3C5 | 10.1021/jm2003238 | |||
| CHEMBL1834409 | 65722 | None | 1 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -12 | 2 | ChEMBL | 481 | 6 | 2 | 5 | 4.8 | CCC(C)(C)[C@](C)(O)[C@H]1C[C@@]23CC[C@]1(OC)[C@@H]1Oc4c(O)ccc5c4[C@@]12CCN(CC1CC1)[C@@H]3C5 | 10.1021/jm2003238 | |||
| 9997843 | 99719 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 347 | 2 | 1 | 3 | 3.1 | O=C1NCN(c2ccccc2)C12CCN(C1CCc3ccccc31)CC2 | 10.1021/jm991129q | |||
| CHEMBL284414 | 99719 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 347 | 2 | 1 | 3 | 3.1 | O=C1NCN(c2ccccc2)C12CCN(C1CCc3ccccc31)CC2 | 10.1021/jm991129q | |||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 2 | 5 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| CHEMBL436819 | 216149 | None | 0 | Mouse | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 9799433 | 90500 | None | 1 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 2 | ChEMBL | 368 | 4 | 0 | 2 | 5.2 | CCC1C(=O)N(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387196 | 90500 | None | 1 | Human | Functional | pEC50 | = | 8.1 | 8.1 | -1 | 2 | ChEMBL | 368 | 4 | 0 | 2 | 5.2 | CCC1C(=O)N(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| 53324890 | 57322 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 138 | 2 | ChEMBL | 469 | 4 | 1 | 4 | 6.6 | OCC1(N2CCC(n3c(-c4ccc(F)c(Cl)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650842 | 57322 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 138 | 2 | ChEMBL | 469 | 4 | 1 | 4 | 6.6 | OCC1(N2CCC(n3c(-c4ccc(F)c(Cl)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| 16131448 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.1 | 8.1 | -7 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1681 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.1 | 8.1 | -7 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1688 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.1 | 8.1 | -7 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44361543 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.1 | 8.1 | -7 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 56947112 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.1 | 8.1 | -7 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Guinea pig | Functional | pEC50 | = | 8.1 | 8.1 | -7 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL233069 | 211989 | None | 0 | Mouse | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 90655975 | 111071 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -3 | 2 | ChEMBL | 373 | 4 | 1 | 2 | 4.7 | CCC1C(=O)N(C2CCN(Cc3cccc4[nH]ccc34)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262548 | 111071 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -3 | 2 | ChEMBL | 373 | 4 | 1 | 2 | 4.7 | CCC1C(=O)N(C2CCN(Cc3cccc4[nH]ccc34)CC2)c2ccccc21 | 10.1016/j.bmc.2014.02.047 | |||
| 71624268 | 90495 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -2 | 3 | ChEMBL | 326 | 3 | 0 | 2 | 4.0 | CC(C1CCCCC1)N1CCC(N2C(=O)Cc3ccccc32)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387191 | 90495 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -2 | 3 | ChEMBL | 326 | 3 | 0 | 2 | 4.0 | CC(C1CCCCC1)N1CCC(N2C(=O)Cc3ccccc32)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| 71624266 | 90493 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | 368 | 4 | 0 | 2 | 5.0 | CCC(C)(C)[C@H]1CC[C@@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387189 | 90493 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | 368 | 4 | 0 | 2 | 5.0 | CCC(C)(C)[C@H]1CC[C@@H](N2CCC(N3C(=O)Cc4ccccc43)CC2)CC1 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL394775 | 214940 | None | 0 | Mouse | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 90655971 | 111065 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 4 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN([C@H]2CC[C@@H]3CCCc4cccc2c43)CC1 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL3262542 | 111065 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 4 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN([C@H]2CC[C@@H]3CCCc4cccc2c43)CC1 | 10.1016/j.bmc.2014.02.047 | |||
| CHEMBL5081900 | 217262 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| CHEMBL504461 | 216666 | None | 0 | Rat | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 76335144 | 103395 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 43 | 2 | ChEMBL | 495 | 5 | 1 | 4 | 6.4 | COC(=O)N[C@@]1(c2ccccn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| CHEMBL3084551 | 103395 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | 43 | 2 | ChEMBL | 495 | 5 | 1 | 4 | 6.4 | COC(=O)N[C@@]1(c2ccccn2)C[C@@H]2CC[C@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1016/j.bmcl.2009.03.057 | |||
| 9947044 | 98324 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 361 | 2 | 1 | 3 | 3.5 | O=C1NCN(c2ccccc2)C12CCN(C1CCCc3ccccc31)CC2 | 10.1021/jm991129q | |||
| CHEMBL27460 | 98324 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 361 | 2 | 1 | 3 | 3.5 | O=C1NCN(c2ccccc2)C12CCN(C1CCCc3ccccc31)CC2 | 10.1021/jm991129q | |||
| CHEMBL526142 | 218163 | None | 0 | Rat | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 24824635 | 158915 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -12 | 4 | ChEMBL | 480 | 4 | 3 | 5 | 3.4 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Cl)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL409458 | 158915 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -12 | 4 | ChEMBL | 480 | 4 | 3 | 5 | 3.4 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Cl)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL611933 | 158915 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -12 | 4 | ChEMBL | 480 | 4 | 3 | 5 | 3.4 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Cl)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL524339 | 218094 | None | 0 | Rat | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 53319615 | 57323 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 451 | 4 | 1 | 4 | 6.5 | OCC1(N2CCC(n3c(-c4ccc(Cl)cc4)nc4ccccc43)CC2)CCCCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650843 | 57323 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 451 | 4 | 1 | 4 | 6.5 | OCC1(N2CCC(n3c(-c4ccc(Cl)cc4)nc4ccccc43)CC2)CCCCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL5085161 | 217441 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | 89 | 2 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.0c02062 | |||||
| 172454342 | 196099 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | 3 | 4 | ChEMBL | 448 | 6 | 1 | 5 | 5.4 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNC(=O)c4cnco4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| CHEMBL5416899 | 196099 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | 3 | 4 | ChEMBL | 448 | 6 | 1 | 5 | 5.4 | CC(C)[C@H]1CC[C@@H](N2CCC(n3c(CNC(=O)c4cnco4)cc4ccccc43)CC2)CC1 | 10.1016/j.bmc.2023.117421 | |||
| 44574587 | 178540 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 496 | 6 | 1 | 4 | 6.4 | COc1ccc(CC2(O)CC3CCC(C2)N3C(c2ccccc2Cl)c2ccc(C)cc2Cl)nc1 | 10.1016/j.bmcl.2009.03.031 | |||
| CHEMBL466066 | 178540 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 496 | 6 | 1 | 4 | 6.4 | COc1ccc(CC2(O)CC3CCC(C2)N3C(c2ccccc2Cl)c2ccc(C)cc2Cl)nc1 | 10.1016/j.bmcl.2009.03.031 | |||
| 11393860 | 4451 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 346 | 2 | 0 | 2 | 3.6 | O=C1Cc2ccccc2N1C1CCN(C2CCc3ccccc3C2)CC1 | 10.1021/jm034249d | |||
| CHEMBL101676 | 4451 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 346 | 2 | 0 | 2 | 3.6 | O=C1Cc2ccccc2N1C1CCN(C2CCc3ccccc3C2)CC1 | 10.1021/jm034249d | |||
| CHEMBL442305 | 216371 | None | 0 | Rat | Functional | pEC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| 44596170 | 14182 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -933 | 4 | ChEMBL | 524 | 4 | 3 | 5 | 3.5 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Br)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL1198702 | 14182 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -933 | 4 | ChEMBL | 524 | 4 | 3 | 5 | 3.5 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Br)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL611930 | 14182 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -933 | 4 | ChEMBL | 524 | 4 | 3 | 5 | 3.5 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(Br)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| 71624389 | 90504 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -1 | 2 | ChEMBL | 354 | 2 | 0 | 2 | 5.1 | CC1CC(=O)N(C2CCN(C3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| CHEMBL2387200 | 90504 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -1 | 2 | ChEMBL | 354 | 2 | 0 | 2 | 5.1 | CC1CC(=O)N(C2CCN(C3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2013.03.101 | |||
| 134578457 | 174059 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 407 | 5 | 0 | 3 | 6.1 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CCCC4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| CHEMBL4541337 | 174059 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 407 | 5 | 0 | 3 | 6.1 | CC(C)[C@H]1CC[C@@H](N2CCC(n3cc(CN4CCCC4)c4ccccc43)CC2)CC1 | 10.1021/acs.jmedchem.9b02134 | |||
| 44456412 | 97537 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 965 | 30 | 15 | 11 | -0.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL270231 | 97537 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 965 | 30 | 15 | 11 | -0.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL219144 | 211867 | None | 0 | Rat | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN)C(N)=O | 10.1016/j.bmcl.2006.04.086 | |||||
| 16131448 | 2849 | None | 24 | Mouse | Functional | pED50 | = | 7.7 | 7.7 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 1681 | 2849 | None | 24 | Mouse | Functional | pED50 | = | 7.7 | 7.7 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 1688 | 2849 | None | 24 | Mouse | Functional | pED50 | = | 7.7 | 7.7 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 44361543 | 2849 | None | 24 | Mouse | Functional | pED50 | = | 7.7 | 7.7 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 56947112 | 2849 | None | 24 | Mouse | Functional | pED50 | = | 7.7 | 7.7 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| CHEMBL396460 | 2849 | None | 24 | Mouse | Functional | pED50 | = | 7.7 | 7.7 | -14 | 5 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 11511090 | 74079 | None | 0 | Human | Functional | pIC50 | = | 9.9 | 9.9 | 5888 | 3 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202225 | 74079 | None | 0 | Human | Functional | pIC50 | = | 9.9 | 9.9 | 5888 | 3 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| 10296561 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1021/jm0509851 | |||
| 7361 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1021/jm0509851 | |||
| CHEMBL201945 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1021/jm0509851 | |||
| 44143431 | 178611 | None | 0 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 1288 | 3 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL466648 | 178611 | None | 0 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 1288 | 3 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| 44143431 | 178611 | None | 0 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 1288 | 3 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL466648 | 178611 | None | 0 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 1288 | 3 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| 44143450 | 188925 | None | 0 | Human | Functional | pIC50 | = | 9.3 | 9.3 | - | 1 | ChEMBL | 475 | 5 | 1 | 5 | 4.8 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N5CCCC5=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL506207 | 188925 | None | 0 | Human | Functional | pIC50 | = | 9.3 | 9.3 | - | 1 | ChEMBL | 475 | 5 | 1 | 5 | 4.8 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N5CCCC5=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143456 | 178700 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | 460 | 5 | 1 | 7 | 5.0 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnco5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467279 | 178700 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | 460 | 5 | 1 | 7 | 5.0 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnco5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 45273531 | 196010 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | 348 | 5 | 1 | 4 | 4.3 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C(C)C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL541511 | 196010 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | 348 | 5 | 1 | 4 | 4.3 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C(C)C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| 45270907 | 198215 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | 334 | 5 | 1 | 4 | 3.7 | CCn1nc(CN[C@H]2CC[C@@H](F)C2)c(C)c1-c1cnc(C)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL557623 | 198215 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | - | 1 | ChEMBL | 334 | 5 | 1 | 4 | 3.7 | CCn1nc(CN[C@H]2CC[C@@H](F)C2)c(C)c1-c1cnc(C)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 24857819 | 187623 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 114 | 4 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL494350 | 187623 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 114 | 4 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| 24857819 | 187623 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 114 | 4 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL494350 | 187623 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 114 | 4 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| 24857820 | 96738 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 190 | 3 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL263918 | 96738 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 190 | 3 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 24857820 | 96738 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 190 | 3 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263918 | 96738 | None | 0 | Human | Functional | pIC50 | = | 9.2 | 9.2 | 190 | 3 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44143432 | 178815 | None | 0 | Human | Functional | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL468302 | 178815 | None | 0 | Human | Functional | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 44143432 | 178815 | None | 0 | Human | Functional | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468302 | 178815 | None | 0 | Human | Functional | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143453 | 178586 | None | 0 | Human | Functional | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnn(C)n5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466448 | 178586 | None | 0 | Human | Functional | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnn(C)n5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143455 | 178565 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nc(C)no5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466252 | 178565 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nc(C)no5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 45273546 | 198231 | None | 0 | Human | Functional | pIC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 353 | 6 | 1 | 4 | 3.5 | COCc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL557721 | 198231 | None | 0 | Human | Functional | pIC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 353 | 6 | 1 | 4 | 3.5 | COCc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 44143428 | 178818 | None | 0 | Human | Functional | pIC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL468308 | 178818 | None | 0 | Human | Functional | pIC50 | = | 9 | 9.0 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44143446 | 178561 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 465 | 5 | 1 | 6 | 4.5 | CCOC(=O)N1CCC(C)(Sc2nc3cc(Cl)c(N4CCN(CC)CC4)cc3[nH]2)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466222 | 178561 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 465 | 5 | 1 | 6 | 4.5 | CCOC(=O)N1CCC(C)(Sc2nc3cc(Cl)c(N4CCN(CC)CC4)cc3[nH]2)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143448 | 178762 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 449 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467677 | 178762 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 449 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143451 | 178820 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 449 | 5 | 2 | 5 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](C(=O)NC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468315 | 178820 | None | 0 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 449 | 5 | 2 | 5 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](C(=O)NC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143430 | 189496 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.8 | Cc1ncc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL512975 | 189496 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.8 | Cc1ncc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| 9823363 | 178572 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | 1047 | 2 | ChEMBL | 418 | 4 | 2 | 5 | 3.9 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466308 | 178572 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | 1047 | 2 | ChEMBL | 418 | 4 | 2 | 5 | 3.9 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 44143433 | 178671 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | 154 | 3 | ChEMBL | 463 | 5 | 1 | 5 | 4.6 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N(C)C(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467057 | 178671 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | 154 | 3 | ChEMBL | 463 | 5 | 1 | 5 | 4.6 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N(C)C(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 1691 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.8 | 8.8 | 512 | 3 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm0509851 | |||
| 5311194 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.8 | 8.8 | 512 | 3 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm0509851 | |||
| CHEMBL357076 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.8 | 8.8 | 512 | 3 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm0509851 | |||
| 24894426 | 185873 | None | 0 | Human | Functional | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 404 | 3 | 1 | 3 | 5.3 | O[C@H]1C[C@H](CN2CCC(c3c(Cl)cccc3Cl)CC2)CCc2cccnc21 | 10.1021/jm701590h | |||
| CHEMBL486644 | 185873 | None | 0 | Human | Functional | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 404 | 3 | 1 | 3 | 5.3 | O[C@H]1C[C@H](CN2CCC(c3c(Cl)cccc3Cl)CC2)CCc2cccnc21 | 10.1021/jm701590h | |||
| 44143449 | 178696 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 485 | 6 | 2 | 6 | 3.7 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NS(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467266 | 178696 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 485 | 6 | 2 | 6 | 3.7 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NS(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44450085 | 96737 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 47 | 3 | ChEMBL | 408 | 5 | 2 | 5 | 4.1 | CC1(Sc2nc3cc(Cl)c(N4CCN(CCO)CC4)cc3[nH]2)CCCCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263917 | 96737 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 47 | 3 | ChEMBL | 408 | 5 | 2 | 5 | 4.1 | CC1(Sc2nc3cc(Cl)c(N4CCN(CCO)CC4)cc3[nH]2)CCCCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44437610 | 145607 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 508 | 10 | 1 | 7 | 4.0 | CNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391487 | 145607 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 508 | 10 | 1 | 7 | 4.0 | CNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44561518 | 189563 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 363 | 3 | 1 | 2 | 5.2 | Cc1ccccc1C1CCN(C[C@@H]2CCc3c(C)cccc3[C@@H](O)C2)CC1 | 10.1021/jm701590h | |||
| CHEMBL513585 | 189563 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 363 | 3 | 1 | 2 | 5.2 | Cc1ccccc1C1CCN(C[C@@H]2CCc3c(C)cccc3[C@@H](O)C2)CC1 | 10.1021/jm701590h | |||
| 44437642 | 91787 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 536 | 11 | 1 | 7 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NC(C)C)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL240941 | 91787 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 536 | 11 | 1 | 7 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NC(C)C)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 46879578 | 6039 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 427 | 3 | 1 | 4 | 4.6 | CNC(=O)CN1C(=O)OC2(CCN(C3CCCCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1080463 | 6039 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 427 | 3 | 1 | 4 | 4.6 | CNC(=O)CN1C(=O)OC2(CCN(C3CCCCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| 44437644 | 91831 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 538 | 12 | 2 | 8 | 3.4 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NCCO)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL241155 | 91831 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 538 | 12 | 2 | 8 | 3.4 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NCCO)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44437617 | 155068 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 523 | 11 | 0 | 8 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCOC(C)=O)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL401248 | 155068 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 523 | 11 | 0 | 8 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCOC(C)=O)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44391133 | 65146 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 457 | 8 | 2 | 6 | 4.9 | CCCC(Oc1cc(C)ccc1Cl)C(O)CN1CCC(n2c(O)nc3ccccc32)CC1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL182410 | 65146 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 457 | 8 | 2 | 6 | 4.9 | CCCC(Oc1cc(C)ccc1Cl)C(O)CN1CCC(n2c(O)nc3ccccc32)CC1 | 10.1016/j.bmcl.2004.11.049 | |||
| 70682351 | 76691 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 423 | 5 | 0 | 3 | 3.4 | CN(C)C(=O)[C@@H]1Cc2ccccc2N1C(=O)CCN1CCC(c2ccc(F)cc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064158 | 76691 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 423 | 5 | 0 | 3 | 3.4 | CN(C)C(=O)[C@@H]1Cc2ccccc2N1C(=O)CCN1CCC(c2ccc(F)cc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 44391081 | 62626 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 471 | 8 | 2 | 6 | 5.2 | Cc1ccc(Cl)c(OC(CC(C)C)C(O)CN2CCC(n3c(O)nc4ccccc43)CC2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL178318 | 62626 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 471 | 8 | 2 | 6 | 5.2 | Cc1ccc(Cl)c(OC(CC(C)C)C(O)CN2CCC(n3c(O)nc4ccccc43)CC2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44143427 | 189595 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3F)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL513855 | 189595 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3F)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 11597677 | 73687 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 23 | 2 | ChEMBL | 454 | 8 | 1 | 3 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1OCc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL201805 | 73687 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 23 | 2 | ChEMBL | 454 | 8 | 1 | 3 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1OCc1ccccc1 | 10.1021/jm0509851 | |||
| 70690755 | 76679 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 419 | 5 | 0 | 3 | 3.6 | Cc1ccccc1C1CCN(CCC(=O)N2c3ccccc3CC2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064130 | 76679 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 419 | 5 | 0 | 3 | 3.6 | Cc1ccccc1C1CCN(CCC(=O)N2c3ccccc3CC2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 46879716 | 6043 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 460 | 4 | 1 | 4 | 3.1 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCC4CCCCC4C3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1080483 | 6043 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 460 | 4 | 1 | 4 | 3.1 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCC4CCCCC4C3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| 53318067 | 56448 | None | 0 | Mouse | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 2073 | 50 | 34 | 30 | -13.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 91933707 | 56448 | None | 0 | Mouse | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 2073 | 50 | 34 | 30 | -13.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| CHEMBL1631930 | 56448 | None | 0 | Mouse | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 2073 | 50 | 34 | 30 | -13.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 44143418 | 187345 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 401 | 5 | 1 | 5 | 5.0 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1ccc(Cl)nc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL492585 | 187345 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 401 | 5 | 1 | 5 | 5.0 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1ccc(Cl)nc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 11326750 | 186415 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 390 | 3 | 2 | 4 | 3.3 | O[C@H]1C[C@H](CN2CC[C@H](c3ccc(F)cc3Cl)[C@@H](O)C2)Cc2cccnc21 | 10.1021/jm701590h | |||
| CHEMBL487458 | 186415 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 390 | 3 | 2 | 4 | 3.3 | O[C@H]1C[C@H](CN2CC[C@H](c3ccc(F)cc3Cl)[C@@H](O)C2)Cc2cccnc21 | 10.1021/jm701590h | |||
| 70690760 | 76693 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 433 | 5 | 0 | 3 | 3.9 | Cc1cccc(C)c1C1CCN(CCC(=O)N2c3ccccc3C[C@H]2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064160 | 76693 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 433 | 5 | 0 | 3 | 3.9 | Cc1cccc(C)c1C1CCN(CCC(=O)N2c3ccccc3C[C@H]2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 53318067 | 56448 | None | 0 | Mouse | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 2073 | 50 | 34 | 30 | -13.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 91933707 | 56448 | None | 0 | Mouse | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 2073 | 50 | 34 | 30 | -13.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| CHEMBL1631930 | 56448 | None | 0 | Mouse | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 2073 | 50 | 34 | 30 | -13.9 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 44437640 | 91266 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 536 | 12 | 1 | 7 | 4.8 | CCCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL240086 | 91266 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 536 | 12 | 1 | 7 | 4.8 | CCCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 127034022 | 139090 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 333 | 2 | 0 | 2 | 4.2 | c1ccc2c(c1)CC(CN1CCC3(CCc4ccccc43)CC1)CO2 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3785605 | 139090 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 333 | 2 | 0 | 2 | 4.2 | c1ccc2c(c1)CC(CN1CCC3(CCc4ccccc43)CC1)CO2 | 10.1016/j.ejmech.2016.02.014 | |||
| 44437615 | 90411 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 509 | 10 | 0 | 8 | 4.4 | COC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238637 | 90411 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 509 | 10 | 0 | 8 | 4.4 | COC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44437623 | 145268 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 523 | 11 | 0 | 8 | 4.8 | COC(=O)CCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391234 | 145268 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 523 | 11 | 0 | 8 | 4.8 | COC(=O)CCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44391094 | 64496 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 422 | 7 | 2 | 6 | 4.8 | Cc1ccc(N)cc1OC(CCN1CCC(n2c(O)nc3ccccc32)CC1)C(C)C | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL181389 | 64496 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 422 | 7 | 2 | 6 | 4.8 | Cc1ccc(N)cc1OC(CCN1CCC(n2c(O)nc3ccccc32)CC1)C(C)C | 10.1016/j.bmcl.2004.11.049 | |||
| 44437637 | 91931 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 529 | 10 | 0 | 8 | 4.3 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CS(C)(=O)=O)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL241357 | 91931 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 529 | 10 | 0 | 8 | 4.3 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CS(C)(=O)=O)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 45270917 | 197290 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 341 | 4 | 1 | 3 | 3.8 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)c(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL549439 | 197290 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 341 | 4 | 1 | 3 | 3.8 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)c(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 10159203 | 65631 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 421 | 7 | 1 | 5 | 5.5 | Cc1ccc(C)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL183355 | 65631 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 421 | 7 | 1 | 5 | 5.5 | Cc1ccc(C)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 70684436 | 76690 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 405 | 5 | 0 | 3 | 3.3 | CN(C)C(=O)[C@@H]1Cc2ccccc2N1C(=O)CCN1CCC(c2ccccc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064157 | 76690 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 405 | 5 | 0 | 3 | 3.3 | CN(C)C(=O)[C@@H]1Cc2ccccc2N1C(=O)CCN1CCC(c2ccccc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 44450208 | 96269 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3cccc(Cl)c3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL260820 | 96269 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3cccc(Cl)c3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44391062 | 122690 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 441 | 7 | 1 | 5 | 5.8 | Cc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL360326 | 122690 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 441 | 7 | 1 | 5 | 5.8 | Cc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44391062 | 122690 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 441 | 7 | 1 | 5 | 5.8 | Cc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL360326 | 122690 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 441 | 7 | 1 | 5 | 5.8 | Cc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44189834 | 14027 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 1047 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.8 | O=c1n(C(CO)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL1197240 | 14027 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 1047 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.8 | O=c1n(C(CO)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL563657 | 14027 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 1047 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.8 | O=c1n(C(CO)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| 44391067 | 63479 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 425 | 7 | 1 | 5 | 5.3 | Cc1cc(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)ccc1F | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL179797 | 63479 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 425 | 7 | 1 | 5 | 5.3 | Cc1cc(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)ccc1F | 10.1016/j.bmcl.2004.11.049 | |||
| 44437628 | 170768 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 522 | 11 | 1 | 7 | 4.4 | CNC(=O)CCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL445154 | 170768 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 522 | 11 | 1 | 7 | 4.4 | CNC(=O)CCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 46879538 | 6187 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 462 | 5 | 1 | 4 | 3.0 | CNC(=O)CN1Cc2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1081192 | 6187 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 462 | 5 | 1 | 4 | 3.0 | CNC(=O)CN1Cc2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| 44189733 | 14035 | None | 2 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 741 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL1197275 | 14035 | None | 2 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 741 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL564840 | 14035 | None | 2 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 741 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| 44391157 | 64907 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 452 | 8 | 1 | 7 | 5.1 | Cc1ccc([N+](=O)[O-])c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL182202 | 64907 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 452 | 8 | 1 | 7 | 5.1 | Cc1ccc([N+](=O)[O-])c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44437646 | 90378 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 534 | 12 | 1 | 7 | 4.6 | C=CCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238602 | 90378 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 534 | 12 | 1 | 7 | 4.6 | C=CCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44437656 | 145803 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 522 | 10 | 1 | 6 | 3.7 | CNC(=O)CN1CN(c2ccccc2)C2(CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)C1=O | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391631 | 145803 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 522 | 10 | 1 | 6 | 3.7 | CNC(=O)CN1CN(c2ccccc2)C2(CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)C1=O | 10.1016/j.bmc.2006.11.030 | |||
| 44449766 | 155786 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1ccccc1CSc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL405078 | 155786 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1ccccc1CSc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44391103 | 65592 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 461 | 7 | 1 | 5 | 5.9 | CC(C)C(CCN1CCC(n2c(O)nc3ccccc32)CC1)Oc1ccccc1C(F)(F)F | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL183135 | 65592 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 461 | 7 | 1 | 5 | 5.9 | CC(C)C(CCN1CCC(n2c(O)nc3ccccc32)CC1)Oc1ccccc1C(F)(F)F | 10.1016/j.bmcl.2004.11.049 | |||
| 46879669 | 5971 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 436 | 4 | 1 | 4 | 3.4 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCC4CCCCC4C3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1079942 | 5971 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 436 | 4 | 1 | 4 | 3.4 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCC4CCCCC4C3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| 11462727 | 189489 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 366 | 3 | 2 | 4 | 3.2 | Cc1ccccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1O | 10.1021/jm701590h | |||
| CHEMBL512896 | 189489 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 366 | 3 | 2 | 4 | 3.2 | Cc1ccccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1O | 10.1021/jm701590h | |||
| 135458466 | 79553 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 422 | 5 | 1 | 6 | 3.8 | CN1CCN(c2[nH]ccc3nc(-c4nc(CCc5ccc(Cl)cc5)no4)cc2-3)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211390 | 79553 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 422 | 5 | 1 | 6 | 3.8 | CN1CCN(c2[nH]ccc3nc(-c4nc(CCc5ccc(Cl)cc5)no4)cc2-3)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| 44143432 | 178814 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468301 | 178814 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 45268355 | 198696 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 320 | 4 | 1 | 4 | 3.2 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL561732 | 198696 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 320 | 4 | 1 | 4 | 3.2 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| 44576628 | 187833 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 6 | 4 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL495402 | 187833 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | 6 | 4 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| 45269358 | 198647 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 427 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL561397 | 198647 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 427 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| 45268498 | 199157 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 413 | 6 | 1 | 5 | 4.8 | CCc1c(CN[C@H]2CC[C@@H](F)C2)nc(-c2ncccc2Cl)n1-c1ccc(C)nc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL564812 | 199157 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 413 | 6 | 1 | 5 | 4.8 | CCc1c(CN[C@H]2CC[C@@H](F)C2)nc(-c2ncccc2Cl)n1-c1ccc(C)nc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44143437 | 178740 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 432 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(CC)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL467533 | 178740 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 432 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(CC)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 45267505 | 198517 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 343 | 4 | 1 | 3 | 4.0 | Cn1nc(CN[C@H]2CC[C@@H](F)C2)c(Cl)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL560468 | 198517 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 343 | 4 | 1 | 3 | 4.0 | Cn1nc(CN[C@H]2CC[C@@H](F)C2)c(Cl)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 45273537 | 198884 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL562932 | 198884 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 10199945 | 96739 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | 42 | 3 | ChEMBL | 382 | 6 | 2 | 5 | 3.6 | CCC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263919 | 96739 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | 42 | 3 | ChEMBL | 382 | 6 | 2 | 5 | 3.6 | CCC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 45102745 | 6045 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 412 | 5 | 1 | 5 | 3.4 | CNC(=O)Cn1c(=O)n(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1080485 | 6045 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 412 | 5 | 1 | 5 | 3.4 | CNC(=O)Cn1c(=O)n(C2CCN([C@H]3CC[C@@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| 44143438 | 178838 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 366 | 3 | 1 | 4 | 4.6 | CCN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)[C@H](C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468504 | 178838 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 366 | 3 | 1 | 4 | 4.6 | CCN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)[C@H](C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44450086 | 158387 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 394 | 5 | 2 | 5 | 3.8 | OCCN1CCN(c2cc3[nH]c(SC4CCCCC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL408901 | 158387 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 394 | 5 | 2 | 5 | 3.8 | OCCN1CCN(c2cc3[nH]c(SC4CCCCC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 10451761 | 38012 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 38 | 3 | ChEMBL | 369 | 4 | 0 | 4 | 4.8 | CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1021/jm990517p | |||
| CHEMBL146013 | 38012 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 38 | 3 | ChEMBL | 369 | 4 | 0 | 4 | 4.8 | CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1021/jm990517p | |||
| 10783436 | 38212 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 341 | 3 | 1 | 4 | 4.7 | Oc1nc2ccccc2n1C1CCN(CC2CCCCCCC2)CC1 | 10.1021/jm990517p | |||
| CHEMBL146191 | 38212 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 341 | 3 | 1 | 4 | 4.7 | Oc1nc2ccccc2n1C1CCN(CC2CCCCCCC2)CC1 | 10.1021/jm990517p | |||
| 44437648 | 147721 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 548 | 12 | 1 | 7 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NCC4CC4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL393138 | 147721 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 548 | 12 | 1 | 7 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NCC4CC4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 46879539 | 5496 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 448 | 5 | 1 | 4 | 3.0 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1076242 | 5496 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 448 | 5 | 1 | 4 | 3.0 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCC(C(C)C)CC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| 22272877 | 95949 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL259185 | 95949 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 22272877 | 95949 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL259185 | 95949 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 11516508 | 139086 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 382 | 2 | 2 | 3 | 4.0 | Oc1ccc(Cl)c2c1CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3785560 | 139086 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 382 | 2 | 2 | 3 | 4.0 | Oc1ccc(Cl)c2c1CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| 44576625 | 187604 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL494219 | 187604 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 136043779 | 78142 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 408 | 8 | 1 | 4 | 5.2 | CCN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL210292 | 78142 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 408 | 8 | 1 | 4 | 5.2 | CCN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 11552010 | 139104 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 348 | 2 | 2 | 3 | 3.4 | Oc1ccc2c(c1)CC(CN1CCC3(CCc4ccccc43)CC1)NC2 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3785728 | 139104 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 348 | 2 | 2 | 3 | 3.4 | Oc1ccc2c(c1)CC(CN1CCC3(CCc4ccccc43)CC1)NC2 | 10.1016/j.ejmech.2016.02.014 | |||
| 70690757 | 76684 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 405 | 5 | 0 | 3 | 3.3 | CN(C)C(=O)C1Cc2ccccc2N1C(=O)CCN1CCC(c2ccccc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064139 | 76684 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 405 | 5 | 0 | 3 | 3.3 | CN(C)C(=O)C1Cc2ccccc2N1C(=O)CCN1CCC(c2ccccc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 136043782 | 138751 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 380 | 6 | 1 | 4 | 4.7 | CN(C)Cc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL377736 | 138751 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 380 | 6 | 1 | 4 | 4.7 | CN(C)Cc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 44437602 | 90688 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 4.9 | COCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL239043 | 90688 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 4.9 | COCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44391155 | 65289 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 475 | 7 | 1 | 5 | 6.6 | Cc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)c2ccccc2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL182819 | 65289 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 475 | 7 | 1 | 5 | 6.6 | Cc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)c2ccccc2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44391134 | 123380 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 425 | 7 | 1 | 5 | 5.3 | Cc1ccc(F)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL361576 | 123380 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 425 | 7 | 1 | 5 | 5.3 | Cc1ccc(F)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 11602409 | 139212 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 332 | 2 | 1 | 2 | 3.7 | c1ccc2c(c1)CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3786899 | 139212 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 332 | 2 | 1 | 2 | 3.7 | c1ccc2c(c1)CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| 44437601 | 90662 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 481 | 10 | 0 | 7 | 4.9 | COCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238833 | 90662 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 481 | 10 | 0 | 7 | 4.9 | COCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 24894428 | 186433 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 370 | 3 | 1 | 3 | 4.6 | O[C@H]1C[C@H](CN2CCC(c3ccccc3Cl)CC2)CCc2cccnc21 | 10.1021/jm701590h | |||
| CHEMBL487485 | 186433 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 370 | 3 | 1 | 3 | 4.6 | O[C@H]1C[C@H](CN2CCC(c3ccccc3Cl)CC2)CCc2cccnc21 | 10.1021/jm701590h | |||
| 44576627 | 193351 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 394 | 7 | 2 | 5 | 3.8 | CCC(CC)Sc1nc2cc(Cl)c(N3C[C@@H]4C[C@H]3CN4CCO)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL523724 | 193351 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 394 | 7 | 2 | 5 | 3.8 | CCC(CC)Sc1nc2cc(Cl)c(N3C[C@@H]4C[C@H]3CN4CCO)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 44450210 | 96271 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3c(Cl)cccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL260822 | 96271 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3c(Cl)cccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 46879670 | 5972 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 474 | 4 | 1 | 4 | 3.1 | CNC(=O)CN1Cc2ccccc2N(C2CCN(C3CCC4CCCCC4C3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1079943 | 5972 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 474 | 4 | 1 | 4 | 3.1 | CNC(=O)CN1Cc2ccccc2N(C2CCN(C3CCC4CCCCC4C3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| 127033703 | 139121 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 388 | 3 | 2 | 3 | 4.4 | Cc1cc(F)ccc1C1CCN(CC2Cc3c(Cl)ccc(O)c3CN2)CC1 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3785952 | 139121 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 388 | 3 | 2 | 3 | 4.4 | Cc1cc(F)ccc1C1CCN(CC2Cc3c(Cl)ccc(O)c3CN2)CC1 | 10.1016/j.ejmech.2016.02.014 | |||
| 44189735 | 14028 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 363 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL1197249 | 14028 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 363 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL563980 | 14028 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 363 | 3 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| 136043759 | 78740 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 380 | 8 | 1 | 4 | 5.2 | CN(C)CCc1cccc2[nH]c(-c3nc(CCCC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211254 | 78740 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 380 | 8 | 1 | 4 | 5.2 | CN(C)CCc1cccc2[nH]c(-c3nc(CCCC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 10221539 | 157090 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | 10 | 3 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL407325 | 157090 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | 10 | 3 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 10221539 | 157090 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | 10 | 3 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL407325 | 157090 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | 10 | 3 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44143454 | 189284 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnnn5C)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL511205 | 189284 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnnn5C)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 45270184 | 197726 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL551208 | 197726 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| 22272974 | 96731 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 366 | 6 | 1 | 4 | 4.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CC)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263903 | 96731 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 366 | 6 | 1 | 4 | 4.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CC)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44437606 | 145606 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 494 | 10 | 1 | 7 | 3.7 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(N)=O)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391486 | 145606 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 494 | 10 | 1 | 7 | 3.7 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(N)=O)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 53316771 | 56446 | None | 0 | Mouse | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1896 | 66 | 31 | 27 | -11.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 91933706 | 56446 | None | 0 | Mouse | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1896 | 66 | 31 | 27 | -11.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| CHEMBL1631928 | 56446 | None | 0 | Mouse | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1896 | 66 | 31 | 27 | -11.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 53316771 | 56446 | None | 0 | Mouse | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1896 | 66 | 31 | 27 | -11.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 91933706 | 56446 | None | 0 | Mouse | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1896 | 66 | 31 | 27 | -11.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| CHEMBL1631928 | 56446 | None | 0 | Mouse | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 1896 | 66 | 31 | 27 | -11.6 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 44437652 | 90661 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 548 | 11 | 1 | 7 | 4.9 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NC4CCC4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238819 | 90661 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 548 | 11 | 1 | 7 | 4.9 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NC4CCC4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44437619 | 91262 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 497 | 10 | 0 | 7 | 5.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CSC)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL240074 | 91262 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 497 | 10 | 0 | 7 | 5.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CSC)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 46879629 | 5875 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 420 | 4 | 1 | 4 | 2.5 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCCCCC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1079417 | 5875 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 420 | 4 | 1 | 4 | 2.5 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCCCCC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| 11626062 | 139036 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 426 | 2 | 2 | 3 | 4.1 | Oc1ccc(Br)c2c1CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3785095 | 139036 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 426 | 2 | 2 | 3 | 4.1 | Oc1ccc(Br)c2c1CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| 44437613 | 146979 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 522 | 10 | 0 | 7 | 4.3 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)N(C)C)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL392548 | 146979 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 522 | 10 | 0 | 7 | 4.3 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)N(C)C)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 10225083 | 166491 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL427683 | 166491 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44143436 | 178571 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 402 | 4 | 1 | 5 | 3.7 | CCN1CCN(c2cc3[nH]c(C(=O)C4(C)CCC(=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466307 | 178571 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 402 | 4 | 1 | 5 | 3.7 | CCN1CCN(c2cc3[nH]c(C(=O)C4(C)CCC(=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 10225083 | 166491 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL427683 | 166491 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44450209 | 96270 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 376 | 4 | 2 | 4 | 4.1 | Fc1cc2nc(SCc3ccccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL260821 | 96270 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 376 | 4 | 2 | 4 | 4.1 | Fc1cc2nc(SCc3ccccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 53319408 | 56445 | None | 0 | Mouse | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 1878 | 66 | 31 | 27 | -11.7 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 91933705 | 56445 | None | 0 | Mouse | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 1878 | 66 | 31 | 27 | -11.7 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| CHEMBL1631927 | 56445 | None | 0 | Mouse | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 1878 | 66 | 31 | 27 | -11.7 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 53319408 | 56445 | None | 0 | Mouse | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 1878 | 66 | 31 | 27 | -11.7 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 91933705 | 56445 | None | 0 | Mouse | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 1878 | 66 | 31 | 27 | -11.7 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| CHEMBL1631927 | 56445 | None | 0 | Mouse | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 1878 | 66 | 31 | 27 | -11.7 | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm101139f | |||
| 44437610 | 145607 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 508 | 10 | 1 | 7 | 4.0 | CNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391487 | 145607 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 508 | 10 | 1 | 7 | 4.0 | CNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44143452 | 178842 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 470 | 5 | 1 | 6 | 4.2 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](S(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468524 | 178842 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 470 | 5 | 1 | 6 | 4.2 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](S(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 11583016 | 74379 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 1698 | 2 | ChEMBL | 440 | 7 | 1 | 3 | 5.6 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Oc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202443 | 74379 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | 1698 | 2 | ChEMBL | 440 | 7 | 1 | 3 | 5.6 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Oc1ccccc1 | 10.1021/jm0509851 | |||
| 44143429 | 178841 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 417 | 5 | 1 | 5 | 4.9 | Cc1ccc(-c2c(C)c(CNC3CCC(F)(F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL468518 | 178841 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 417 | 5 | 1 | 5 | 4.9 | Cc1ccc(-c2c(C)c(CNC3CCC(F)(F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44561020 | 179291 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 384 | 3 | 2 | 4 | 3.4 | Cc1cc(F)ccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1O | 10.1021/jm701590h | |||
| CHEMBL472304 | 179291 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 384 | 3 | 2 | 4 | 3.4 | Cc1cc(F)ccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1O | 10.1021/jm701590h | |||
| 45273679 | 198091 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 351 | 5 | 1 | 3 | 4.6 | Cc1nc(CN[C@H]2CC[C@@H](F)C2)c(C(C)C)n1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL556300 | 198091 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 351 | 5 | 1 | 3 | 4.6 | Cc1nc(CN[C@H]2CC[C@@H](F)C2)c(C(C)C)n1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44178080 | 198536 | None | 2 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 1584 | 2 | ChEMBL | 362 | 6 | 1 | 4 | 4.0 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCC#N)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL560667 | 198536 | None | 2 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 1584 | 2 | ChEMBL | 362 | 6 | 1 | 4 | 4.0 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCC#N)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 44143419 | 187711 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494767 | 187711 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44437649 | 90660 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 534 | 11 | 1 | 7 | 4.5 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NC4CC4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238818 | 90660 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 534 | 11 | 1 | 7 | 4.5 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NC4CC4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44574003 | 178608 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 394 | 4 | 1 | 5 | 4.2 | CC(=O)CN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)C(C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466631 | 178608 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 394 | 4 | 1 | 5 | 4.2 | CC(=O)CN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)C(C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| 10301207 | 148743 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 511 | 11 | 0 | 7 | 5.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCSC)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL393960 | 148743 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 511 | 11 | 0 | 7 | 5.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCSC)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 70688697 | 76692 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 5 | 0 | 3 | 3.8 | Cc1cc(F)ccc1C1CCN(CCC(=O)N2c3ccccc3C[C@H]2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064159 | 76692 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 5 | 0 | 3 | 3.8 | Cc1cc(F)ccc1C1CCN(CCC(=O)N2c3ccccc3C[C@H]2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 11525624 | 133608 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 181 | 2 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL370870 | 133608 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 181 | 2 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| 136043800 | 77819 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 428 | 7 | 1 | 4 | 5.1 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(C(F)(F)F)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL209213 | 77819 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 428 | 7 | 1 | 4 | 5.1 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(C(F)(F)F)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 10225083 | 166491 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL427683 | 166491 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44437645 | 91832 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 552 | 13 | 1 | 8 | 4.0 | COCCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL241157 | 91832 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 552 | 13 | 1 | 8 | 4.0 | COCCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44437605 | 90922 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 507 | 11 | 0 | 7 | 5.2 | CCC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL239260 | 90922 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 507 | 11 | 0 | 7 | 5.2 | CCC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 70696991 | 76689 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 419 | 5 | 0 | 3 | 3.6 | Cc1ccccc1C1CCN(CCC(=O)N2c3ccccc3C[C@H]2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064156 | 76689 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 419 | 5 | 0 | 3 | 3.6 | Cc1ccccc1C1CCN(CCC(=O)N2c3ccccc3C[C@H]2C(=O)N(C)C)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 46879478 | 5489 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 413 | 4 | 1 | 4 | 3.9 | CNC(=O)CN1C(=O)OC2(CCN(C3CCC(C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1076208 | 5489 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 413 | 4 | 1 | 4 | 3.9 | CNC(=O)CN1C(=O)OC2(CCN(C3CCC(C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| 136043780 | 139355 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 438 | 10 | 1 | 5 | 4.8 | CN(C)CCOCCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL379048 | 139355 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 438 | 10 | 1 | 5 | 4.8 | CN(C)CCOCCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 44574053 | 178727 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 451 | 5 | 2 | 6 | 4.1 | CCN1CCN(c2cc3[nH]c(SC4(C)CCC(NC(=O)OC)C4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467473 | 178727 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 451 | 5 | 2 | 6 | 4.1 | CCN1CCN(c2cc3[nH]c(SC4(C)CCC(NC(=O)OC)C4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143406 | 187605 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 407 | 5 | 1 | 3 | 6.3 | Cc1c(CNC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494230 | 187605 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 407 | 5 | 1 | 3 | 6.3 | Cc1c(CNC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 70686573 | 76681 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 406 | 5 | 0 | 4 | 2.2 | CN(C)C(=O)C1Cc2ccccc2N1C(=O)CCN1CCN(c2ccccc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| CHEMBL2064133 | 76681 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 406 | 5 | 0 | 4 | 2.2 | CN(C)C(=O)C1Cc2ccccc2N1C(=O)CCN1CCN(c2ccccc2)CC1 | 10.1016/j.ejmech.2012.07.021 | |||
| 11188910 | 189552 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 404 | 3 | 2 | 4 | 3.7 | O[C@H]1C[C@H](CN2CC[C@H](c3ccc(F)cc3Cl)[C@@H](O)C2)CCc2cccnc21 | 10.1021/jm701590h | |||
| CHEMBL513423 | 189552 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 404 | 3 | 2 | 4 | 3.7 | O[C@H]1C[C@H](CN2CC[C@H](c3ccc(F)cc3Cl)[C@@H](O)C2)CCc2cccnc21 | 10.1021/jm701590h | |||
| 46879580 | 5870 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 476 | 4 | 1 | 4 | 3.7 | CNC(=O)CN1Cc2ccccc2N(C2CCN(C3CCCCCCCCC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1079400 | 5870 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 476 | 4 | 1 | 4 | 3.7 | CNC(=O)CN1Cc2ccccc2N(C2CCN(C3CCCCCCCCC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| 44143435 | 178547 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 441 | 5 | 2 | 6 | 3.5 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2C)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466112 | 178547 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 441 | 5 | 2 | 6 | 3.5 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2C)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 44517710 | 198979 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 393 | 8 | 1 | 4 | 5.0 | COCCc1nc(CN[C@H]2CC[C@@H](F)C2)n(C(C)C)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL563593 | 198979 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 393 | 8 | 1 | 4 | 5.0 | COCCc1nc(CN[C@H]2CC[C@@H](F)C2)n(C(C)C)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 1691 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 512 | 3 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm990517p | |||
| 5311194 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 512 | 3 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm990517p | |||
| CHEMBL357076 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 512 | 3 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm990517p | |||
| 11152739 | 189354 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 364 | 3 | 1 | 3 | 4.5 | Cc1ccccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1C | 10.1021/jm701590h | |||
| CHEMBL511658 | 189354 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 364 | 3 | 1 | 3 | 4.5 | Cc1ccccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1C | 10.1021/jm701590h | |||
| 44391138 | 65484 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 445 | 7 | 1 | 5 | 5.7 | CC(C)C(CCN1CCC(n2c(O)nc3ccccc32)CC1)Oc1cc(F)ccc1Cl | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL182995 | 65484 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 445 | 7 | 1 | 5 | 5.7 | CC(C)C(CCN1CCC(n2c(O)nc3ccccc32)CC1)Oc1cc(F)ccc1Cl | 10.1016/j.bmcl.2004.11.049 | |||
| 46879537 | 6186 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 424 | 5 | 1 | 4 | 3.3 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCC(C(C)C)CC3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1081191 | 6186 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 424 | 5 | 1 | 4 | 3.3 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCC(C(C)C)CC3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| 11544795 | 139103 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 348 | 2 | 2 | 3 | 3.4 | Oc1cccc2c1CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3785718 | 139103 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 348 | 2 | 2 | 3 | 3.4 | Oc1cccc2c1CNC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| 44437654 | 145823 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 451 | 8 | 1 | 5 | 4.2 | COc1ccc(C)c(OC(CCN2CCC3(CC2)C(=O)NCN3c2ccccc2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391650 | 145823 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 451 | 8 | 1 | 5 | 4.2 | COc1ccc(C)c(OC(CCN2CCC3(CC2)C(=O)NCN3c2ccccc2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44437647 | 90377 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 584 | 12 | 1 | 7 | 5.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NCc4ccccc4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238600 | 90377 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 584 | 12 | 1 | 7 | 5.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CC(=O)NCc4ccccc4)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 127034292 | 139166 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 338 | 3 | 1 | 2 | 4.0 | Cc1cc(F)ccc1C1CCN(CC2Cc3ccccc3CN2)CC1 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3786469 | 139166 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 338 | 3 | 1 | 2 | 4.0 | Cc1cc(F)ccc1C1CCN(CC2Cc3ccccc3CN2)CC1 | 10.1016/j.ejmech.2016.02.014 | |||
| 45102745 | 6044 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 412 | 5 | 1 | 5 | 3.4 | CNC(=O)Cn1c(=O)n(C2CCN([C@H]3CC[C@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1080484 | 6044 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 412 | 5 | 1 | 5 | 3.4 | CNC(=O)Cn1c(=O)n(C2CCN([C@H]3CC[C@H](C(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2009.09.028 | |||
| 44576626 | 193475 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 410 | 7 | 2 | 5 | 4.4 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL525054 | 193475 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 410 | 7 | 2 | 5 | 4.4 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 44143442 | 178607 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 391 | 4 | 1 | 5 | 4.5 | C[C@@H]1CN(CCC#N)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466630 | 178607 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 391 | 4 | 1 | 5 | 4.5 | C[C@@H]1CN(CCC#N)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| 45270082 | 197701 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1ccc(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL551002 | 197701 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1ccc(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 44437602 | 90688 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 4.9 | COCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL239043 | 90688 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 4.9 | COCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 53323365 | 56447 | None | 0 | Mouse | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 1395 | 47 | 24 | 20 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm101139f | |||
| CHEMBL1631929 | 56447 | None | 0 | Mouse | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 1395 | 47 | 24 | 20 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm101139f | |||
| 136043819 | 77966 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 394 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL209537 | 77966 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 394 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 10225083 | 166491 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL427683 | 166491 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 437 | 8 | 1 | 5 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)[nH]c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 127034023 | 139241 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 331 | 2 | 0 | 1 | 4.8 | c1ccc2c(c1)CCC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| CHEMBL3787174 | 139241 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 331 | 2 | 0 | 1 | 4.8 | c1ccc2c(c1)CCC(CN1CCC3(CCc4ccccc43)CC1)C2 | 10.1016/j.ejmech.2016.02.014 | |||
| 46879667 | 5969 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 438 | 4 | 1 | 4 | 3.7 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCC(C(C)(C)C)CC3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1079940 | 5969 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 438 | 4 | 1 | 4 | 3.7 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCC(C(C)(C)C)CC3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| 17858448 | 96011 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 322 | 5 | 2 | 4 | 3.4 | CCC(CC)Sc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL259452 | 96011 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 322 | 5 | 2 | 4 | 3.4 | CCC(CC)Sc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44143457 | 178701 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnc(C)o5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467280 | 178701 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnc(C)o5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 11372427 | 179261 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 380 | 4 | 2 | 4 | 3.5 | Cc1ccccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1CO | 10.1021/jm701590h | |||
| CHEMBL472125 | 179261 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 380 | 4 | 2 | 4 | 3.5 | Cc1ccccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1CO | 10.1021/jm701590h | |||
| 46879581 | 5902 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 462 | 4 | 1 | 4 | 3.7 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCCCCCCCC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1079571 | 5902 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 462 | 4 | 1 | 4 | 3.7 | CNC(=O)CN1c2ccccc2N(C2CCN(C3CCCCCCCCC3)CC2)S1(=O)=O | 10.1016/j.bmcl.2009.09.028 | |||
| 44143434 | 178621 | None | 3 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 461 | 5 | 2 | 6 | 3.8 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466702 | 178621 | None | 3 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 461 | 5 | 2 | 6 | 3.8 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 53320710 | 56449 | None | 0 | Mouse | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 91933708 | 56449 | None | 0 | Mouse | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| CHEMBL1631931 | 56449 | None | 0 | Mouse | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 11633324 | 72703 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 724 | 2 | ChEMBL | 392 | 7 | 2 | 3 | 3.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H](O)Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL199639 | 72703 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 724 | 2 | ChEMBL | 392 | 7 | 2 | 3 | 3.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H](O)Cc1ccccc1 | 10.1021/jm0509851 | |||
| 53320710 | 56449 | None | 0 | Mouse | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 91933708 | 56449 | None | 0 | Mouse | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| CHEMBL1631931 | 56449 | None | 0 | Mouse | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 45272626 | 198220 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 306 | 4 | 2 | 3 | 3.2 | Cc1ncc(-c2[nH]nc(CN[C@H]3CC[C@@H](F)C3)c2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL557653 | 198220 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 306 | 4 | 2 | 3 | 3.2 | Cc1ncc(-c2[nH]nc(CN[C@H]3CC[C@@H](F)C3)c2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| 44437610 | 145607 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 508 | 10 | 1 | 7 | 4.0 | CNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391487 | 145607 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 508 | 10 | 1 | 7 | 4.0 | CNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 53323365 | 56447 | None | 0 | Mouse | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 1395 | 47 | 24 | 20 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm101139f | |||
| CHEMBL1631929 | 56447 | None | 0 | Mouse | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 1395 | 47 | 24 | 20 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm101139f | |||
| 44437630 | 145650 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 481 | 10 | 1 | 7 | 4.2 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCO)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391518 | 145650 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 481 | 10 | 1 | 7 | 4.2 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCO)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 44437602 | 90688 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 4.9 | COCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL239043 | 90688 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 4.9 | COCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44450151 | 95845 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 329 | 5 | 2 | 5 | 3.1 | CCC(CC)Sc1nc2cc(C#N)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL258711 | 95845 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 329 | 5 | 2 | 5 | 3.1 | CCC(CC)Sc1nc2cc(C#N)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44391104 | 65035 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 491 | 7 | 2 | 6 | 5.5 | Cc1ccc(Cl)c(OC(c2ccccc2)C(O)CN2CCC(n3c(O)nc4ccccc43)CC2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL182328 | 65035 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 491 | 7 | 2 | 6 | 5.5 | Cc1ccc(Cl)c(OC(c2ccccc2)C(O)CN2CCC(n3c(O)nc4ccccc43)CC2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44437636 | 145527 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 513 | 10 | 0 | 7 | 4.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(C[S+](C)[O-])c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL391422 | 145527 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 513 | 10 | 0 | 7 | 4.6 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(C[S+](C)[O-])c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 11619553 | 161814 | None | 1 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 407 | 2 | ChEMBL | 424 | 6 | 1 | 2 | 5.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL413571 | 161814 | None | 1 | Human | Functional | pIC50 | = | 8.1 | 8.1 | 407 | 2 | ChEMBL | 424 | 6 | 1 | 2 | 5.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm0509851 | |||
| 44143445 | 178560 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 439 | 7 | 2 | 6 | 4.0 | CCN1CCN(c2cc3[nH]c(SC(C)(C)CCNC(=O)OC)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466221 | 178560 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 439 | 7 | 2 | 6 | 4.0 | CCN1CCN(c2cc3[nH]c(SC(C)(C)CCNC(=O)OC)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44391124 | 96491 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 457 | 8 | 1 | 6 | 5.5 | COc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL262104 | 96491 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 457 | 8 | 1 | 6 | 5.5 | COc1ccc(Cl)c(OC(CCN2CCC(n3c(O)nc4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44437601 | 90662 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 481 | 10 | 0 | 7 | 4.9 | COCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238833 | 90662 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 481 | 10 | 0 | 7 | 4.9 | COCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44437626 | 90657 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 508 | 11 | 0 | 7 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCN(C)C)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL238795 | 90657 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 508 | 11 | 0 | 7 | 4.8 | COc1ccc(C)c(OC(CCN2CCC(n3c(=O)n(CCN(C)C)c4ccccc43)CC2)C(C)C)c1 | 10.1016/j.bmc.2006.11.030 | |||
| 136043788 | 139430 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 420 | 5 | 1 | 4 | 5.5 | CN1CCC(c2cccc3[nH]c(-c4nc(CCc5ccc(Cl)cc5)no4)cc23)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL379284 | 139430 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 420 | 5 | 1 | 4 | 5.5 | CN1CCC(c2cccc3[nH]c(-c4nc(CCc5ccc(Cl)cc5)no4)cc23)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| 11187225 | 179271 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 350 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)CC1 | 10.1021/jm701590h | |||
| CHEMBL472168 | 179271 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 350 | 3 | 1 | 3 | 4.3 | Cc1ccccc1C1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)CC1 | 10.1021/jm701590h | |||
| 22273044 | 95844 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 338 | 5 | 2 | 4 | 3.9 | CCC(CC)Sc1nc2cc(Cl)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL258710 | 95844 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 338 | 5 | 2 | 4 | 3.9 | CCC(CC)Sc1nc2cc(Cl)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 46879579 | 6040 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 438 | 4 | 1 | 4 | 4.0 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCCCCCCCC3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| CHEMBL1080464 | 6040 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 438 | 4 | 1 | 4 | 4.0 | CNC(=O)CN1N=C(c2ccccc2)C2(CCN(C3CCCCCCCCC3)CC2)C1=O | 10.1016/j.bmcl.2009.09.028 | |||
| 45269357 | 198646 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 409 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CNC3CCCC3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL561396 | 198646 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 409 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CNC3CCCC3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44437639 | 91265 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 522 | 11 | 1 | 7 | 4.4 | CCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL240085 | 91265 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 522 | 11 | 1 | 7 | 4.4 | CCNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 44437604 | 90689 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 5.2 | CCOCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL239045 | 90689 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 495 | 11 | 0 | 7 | 5.2 | CCOCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 22272900 | 96727 | None | 1 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 348 | 4 | 2 | 4 | 3.8 | Fc1cc2nc(SCC3CCCCC3)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263889 | 96727 | None | 1 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 348 | 4 | 2 | 4 | 3.8 | Fc1cc2nc(SCC3CCCCC3)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44390989 | 165986 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 483 | 6 | 2 | 6 | 5.5 | Cc1ccc(Cl)c(OC2(C(O)CN3CCC(n4c(O)nc5ccccc54)CC3)CCCCC2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL424971 | 165986 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 483 | 6 | 2 | 6 | 5.5 | Cc1ccc(Cl)c(OC2(C(O)CN3CCC(n4c(O)nc5ccccc54)CC3)CCCCC2)c1 | 10.1016/j.bmcl.2004.11.049 | |||
| 44391052 | 129737 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 425 | 7 | 1 | 5 | 5.3 | Cc1cc(F)ccc1OC(CCN1CCC(n2c(O)nc3ccccc32)CC1)C(C)C | 10.1016/j.bmcl.2004.11.049 | |||
| CHEMBL367367 | 129737 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 425 | 7 | 1 | 5 | 5.3 | Cc1cc(F)ccc1OC(CCN1CCC(n2c(O)nc3ccccc32)CC1)C(C)C | 10.1016/j.bmcl.2004.11.049 | |||
| 44437638 | 91264 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 494 | 11 | 1 | 7 | 4.5 | CNCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| CHEMBL240084 | 91264 | None | 0 | Human | Functional | pIC50 | = | 7 | 7.0 | - | 1 | ChEMBL | 494 | 11 | 1 | 7 | 4.5 | CNCCn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 | 10.1016/j.bmc.2006.11.030 | |||
| 25001412 | 62671 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 473 | 8 | 1 | 3 | 5.3 | O=C(NCCCN1CCC(c2c(Cl)cccc2Cl)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1016/j.bmc.2009.05.068 | |||
| CHEMBL1783826 | 62671 | None | 0 | Human | Functional | pKd | = | 9.9 | 9.9 | - | 0 | ChEMBL | 473 | 8 | 1 | 3 | 5.3 | O=C(NCCCN1CCC(c2c(Cl)cccc2Cl)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1016/j.bmc.2009.05.068 | |||
| CHEMBL2372052 | 212633 | None | 0 | Guinea pig | Functional | pKd | = | 9.5 | 9.5 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](CN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL2372052 | 212633 | None | 0 | Rat | Functional | pKd | = | 9.2 | 9.2 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](CN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL2372052 | 212633 | None | 0 | Mouse | Functional | pKd | = | 9.1 | 9.1 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](CN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 53320710 | 56449 | None | 0 | Mouse | Functional | pKd | = | 8.7 | 8.7 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 91933708 | 56449 | None | 0 | Mouse | Functional | pKd | = | 8.7 | 8.7 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| CHEMBL1631931 | 56449 | None | 0 | Mouse | Functional | pKd | = | 8.7 | 8.7 | - | 1 | ChEMBL | 2091 | 50 | 34 | 30 | -13.8 | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccccc1)C(=O)NCC(=O)N[C@H]1CCCCNC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC2=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC1=O | 10.1021/jm101139f | |||
| 25001412 | 62671 | None | 0 | Mouse | Functional | pKd | = | 8 | 8.0 | - | 0 | ChEMBL | 473 | 8 | 1 | 3 | 5.3 | O=C(NCCCN1CCC(c2c(Cl)cccc2Cl)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1016/j.bmc.2009.05.068 | |||
| CHEMBL1783826 | 62671 | None | 0 | Mouse | Functional | pKd | = | 8 | 8.0 | - | 0 | ChEMBL | 473 | 8 | 1 | 3 | 5.3 | O=C(NCCCN1CCC(c2c(Cl)cccc2Cl)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1016/j.bmc.2009.05.068 | |||
| 127043001 | 140453 | None | 0 | Human | Functional | pKd | = | 6 | 6.0 | - | 1 | ChEMBL | 1577 | 43 | 25 | 17 | -1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C1=O | 10.1021/acs.jmedchem.5b01976 | |||
| CHEMBL3808398 | 140453 | None | 0 | Human | Functional | pKd | = | 6 | 6.0 | - | 1 | ChEMBL | 1577 | 43 | 25 | 17 | -1.7 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C1=O | 10.1021/acs.jmedchem.5b01976 | |||
| CHEMBL269068 | 213236 | None | 0 | Human | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL269068 | 213236 | None | 0 | Mouse | Functional | pKd | = | 7.5 | 7.5 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 127044528 | 140455 | None | 0 | Human | Functional | pKd | = | 5.4 | 5.4 | - | 1 | ChEMBL | 1474 | 43 | 23 | 18 | -1.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCN1Cc2ccccc2C[C@H](NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc2c(C)cc(O)cc2C)C1=O)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.5b01976 | |||
| CHEMBL3808415 | 140455 | None | 0 | Human | Functional | pKd | = | 5.4 | 5.4 | - | 1 | ChEMBL | 1474 | 43 | 23 | 18 | -1.9 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCN1Cc2ccccc2C[C@H](NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc2c(C)cc(O)cc2C)C1=O)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.5b01976 | |||
| CHEMBL269068 | 213236 | None | 0 | Guinea pig | Functional | pKd | = | 7.3 | 7.3 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 10296561 | 1043 | None | 22 | Mouse | Functional | pKd | = | 8.2 | 8.2 | - | 3 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1016/j.bmc.2009.05.068 | |||
| 7361 | 1043 | None | 22 | Mouse | Functional | pKd | = | 8.2 | 8.2 | - | 3 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1016/j.bmc.2009.05.068 | |||
| CHEMBL201945 | 1043 | None | 22 | Mouse | Functional | pKd | = | 8.2 | 8.2 | - | 3 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1016/j.bmc.2009.05.068 | |||
| 127043559 | 140597 | None | 0 | Human | Functional | pKd | = | 6.3 | 6.3 | - | 1 | ChEMBL | 1603 | 43 | 26 | 18 | -1.5 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c(C)cc(O)cc2C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C1=O | 10.1021/acs.jmedchem.5b01976 | |||
| CHEMBL3810104 | 140597 | None | 0 | Human | Functional | pKd | = | 6.3 | 6.3 | - | 1 | ChEMBL | 1603 | 43 | 26 | 18 | -1.5 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c(C)cc(O)cc2C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C1=O | 10.1021/acs.jmedchem.5b01976 | |||
| CHEMBL269068 | 213236 | None | 0 | Rat | Functional | pKd | = | 7.1 | 7.1 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| 127043364 | 140465 | None | 0 | Human | Functional | pKd | = | 6.0 | 6.0 | - | 1 | ChEMBL | 1575 | 43 | 26 | 18 | -2.1 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C1=O | 10.1021/acs.jmedchem.5b01976 | |||
| CHEMBL3808523 | 140465 | None | 0 | Human | Functional | pKd | = | 6.0 | 6.0 | - | 1 | ChEMBL | 1575 | 43 | 26 | 18 | -2.1 | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C1=O | 10.1021/acs.jmedchem.5b01976 | |||
| 44339596 | 9798 | None | 3 | Human | Functional | pKi | = | 7.0 | 7.0 | - | 0 | ChEMBL | 369 | 3 | 1 | 2 | 5.3 | OC1(c2cccc(C(F)(F)F)c2)CCN(CC2CCCCCCC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL113684 | 9798 | None | 3 | Human | Functional | pKi | = | 7.0 | 7.0 | - | 0 | ChEMBL | 369 | 3 | 1 | 2 | 5.3 | OC1(c2cccc(C(F)(F)F)c2)CCN(CC2CCCCCCC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 11743914 | 109721 | None | 0 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 439 | 6 | 1 | 2 | 6.2 | OC1(c2cccc(C(F)(F)F)c2)CCN(CCC(c2ccccc2)c2ccccc2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL322515 | 109721 | None | 0 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 439 | 6 | 1 | 2 | 6.2 | OC1(c2cccc(C(F)(F)F)c2)CCN(CCC(c2ccccc2)c2ccccc2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 44339424 | 9340 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 369 | 3 | 1 | 2 | 5.2 | CC(C)C1CCC(N2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL111192 | 9340 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 369 | 3 | 1 | 2 | 5.2 | CC(C)C1CCC(N2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 44339695 | 9368 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 381 | 2 | 1 | 2 | 5.3 | OC1(c2cccc(C(F)(F)F)c2)CCN(C2CCC3CCCCC3C2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL111347 | 9368 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 381 | 2 | 1 | 2 | 5.3 | OC1(c2cccc(C(F)(F)F)c2)CCN(C2CCC3CCCCC3C2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 44339425 | 8685 | None | 0 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 369 | 4 | 1 | 2 | 5.3 | CCCC1CCC(N2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL109563 | 8685 | None | 0 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 369 | 4 | 1 | 2 | 5.3 | CCCC1CCC(N2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 44339374 | 110660 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 473 | 6 | 1 | 2 | 6.9 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCC(c2ccccc2)c2ccccc2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL325536 | 110660 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 473 | 6 | 1 | 2 | 6.9 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CCC(c2ccccc2)c2ccccc2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 44339423 | 9346 | None | 0 | Human | Functional | pKi | = | 7.5 | 7.5 | - | 0 | ChEMBL | 403 | 3 | 1 | 2 | 5.9 | CC(C)C1CCC(N2CCC(O)(c3ccc(Cl)c(C(F)(F)F)c3)CC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL111230 | 9346 | None | 0 | Human | Functional | pKi | = | 7.5 | 7.5 | - | 0 | ChEMBL | 403 | 3 | 1 | 2 | 5.9 | CC(C)C1CCC(N2CCC(O)(c3ccc(Cl)c(C(F)(F)F)c3)CC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 46227963 | 14181 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | -3 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 3.8 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL1198701 | 14181 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | -3 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 3.8 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| CHEMBL611929 | 14181 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | -3 | 4 | ChEMBL | 514 | 4 | 3 | 5 | 3.8 | O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1ccc(C(F)(F)F)cc1 | 10.1016/j.bmc.2009.07.069 | |||
| 44339576 | 8730 | None | 0 | Human | Functional | pKi | = | 7.3 | 7.3 | - | 0 | ChEMBL | 403 | 3 | 1 | 2 | 6.0 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CC2CCCCCCC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL109598 | 8730 | None | 0 | Human | Functional | pKi | = | 7.3 | 7.3 | - | 0 | ChEMBL | 403 | 3 | 1 | 2 | 6.0 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(CC2CCCCCCC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 44339504 | 108900 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 335 | 3 | 1 | 2 | 5.0 | OC1(c2ccc(Cl)cc2)CCN(CC2CCCCCCC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL320991 | 108900 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 335 | 3 | 1 | 2 | 5.0 | OC1(c2ccc(Cl)cc2)CCN(CC2CCCCCCC2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 44339684 | 9681 | None | 0 | Human | Functional | pKi | = | 7.1 | 7.1 | - | 0 | ChEMBL | 395 | 2 | 1 | 2 | 4.8 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(C2Cc3ccccc3C2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| CHEMBL112974 | 9681 | None | 0 | Human | Functional | pKi | = | 7.1 | 7.1 | - | 0 | ChEMBL | 395 | 2 | 1 | 2 | 4.8 | OC1(c2ccc(Cl)c(C(F)(F)F)c2)CCN(C2Cc3ccccc3C2)CC1 | 10.1016/s0960-894x(03)00665-6 | |||
| 10499 | 3852 | None | 0 | Mouse | Functional | pA2 | = | 7.8 | 7.8 | - | 1 | Guide to Pharmacology | 397 | 5 | 1 | 5 | 4.1 | OCC1=C(CCN(C1)CC1CCCCCCC1)n1c(=O)n(c2c1cccc2)CC | 16202610 | |||
| 11494970 | 3852 | None | 0 | Mouse | Functional | pA2 | = | 7.8 | 7.8 | - | 1 | Guide to Pharmacology | 397 | 5 | 1 | 5 | 4.1 | OCC1=C(CCN(C1)CC1CCCCCCC1)n1c(=O)n(c2c1cccc2)CC | 16202610 | |||
| CHEMBL3182208 | 3852 | None | 0 | Mouse | Functional | pA2 | = | 7.8 | 7.8 | - | 1 | Guide to Pharmacology | 397 | 5 | 1 | 5 | 4.1 | OCC1=C(CCN(C1)CC1CCCCCCC1)n1c(=O)n(c2c1cccc2)CC | 16202610 | |||
| 66553195 | 93198 | None | 26 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 1 | 5 | Drug Central | 386 | 7 | 1 | 5 | 4.7 | COc1ccsc1CNCC[C@@]1(c2ccccn2)CCOC2(CCCC2)C1 | None | |||
| 66553195.0 | 93198 | None | 26 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 1 | 5 | Drug Central | 386 | 7 | 1 | 5 | 4.7 | COc1ccsc1CNCC[C@@]1(c2ccccn2)CCOC2(CCCC2)C1 | None | |||
| CHEMBL2443262 | 93198 | None | 26 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 1 | 5 | Drug Central | 386 | 7 | 1 | 5 | 4.7 | COc1ccsc1CNCC[C@@]1(c2ccccn2)CCOC2(CCCC2)C1 | None | |||
| DB14881 | 93198 | None | 26 | Human | Functional | pEC50 | = | 8.1 | 8.1 | 1 | 5 | Drug Central | 386 | 7 | 1 | 5 | 4.7 | COc1ccsc1CNCC[C@@]1(c2ccccn2)CCOC2(CCCC2)C1 | None | |||
| 12419 | 2474 | None | 22 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 87 | 4 | Guide to Pharmacology | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 19125610 | |||
| 24800108 | 2474 | None | 22 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 87 | 4 | Guide to Pharmacology | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 19125610 | |||
| CHEMBL481512 | 2474 | None | 22 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 87 | 4 | Guide to Pharmacology | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 19125610 | |||
| 1684 | 3362 | None | 21 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(C21CCN(CC2)[C@H]1CC[C@H]2c3c1cccc3CCC2)c1ccccc1 | 11006485 | |||
| 9844019 | 3362 | None | 21 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(C21CCN(CC2)[C@H]1CC[C@H]2c3c1cccc3CCC2)c1ccccc1 | 11006485 | |||
| CHEMBL2088034 | 3362 | None | 21 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(C21CCN(CC2)[C@H]1CC[C@H]2c3c1cccc3CCC2)c1ccccc1 | 11006485 | |||
| 1686 | 3073 | None | 0 | Human | Functional | pEC50 | = | 10.1 | 10.1 | - | 1 | Guide to Pharmacology | None | None | None | None | 15743186 | |||||
| 1679 | 268 | None | 20 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 9963005 | 268 | None | 20 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| CHEMBL437723 | 268 | None | 20 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 11597355 | 3554 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | Guide to Pharmacology | 439 | 4 | 1 | 4 | 5.4 | Clc1ccccc1C(c1ccccc1Cl)N1[C@@H]2CC[C@H]1CC(C2)(O)c1ncccn1 | 20006596 | |||
| 8869 | 3554 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | Guide to Pharmacology | 439 | 4 | 1 | 4 | 5.4 | Clc1ccccc1C(c1ccccc1Cl)N1[C@@H]2CC[C@H]1CC(C2)(O)c1ncccn1 | 20006596 | |||
| 49843739 | 3668 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | Guide to Pharmacology | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2c(N1C1CCN(CC1)C1CCC3c4c1cccc4CCC3)cccc2 | 19773529 | |||
| 8867 | 3668 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | Guide to Pharmacology | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2c(N1C1CCN(CC1)C1CCC3c4c1cccc4CCC3)cccc2 | 19773529 | |||
| CHEMBL3262554 | 3668 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | Guide to Pharmacology | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2c(N1C1CCN(CC1)C1CCC3c4c1cccc4CCC3)cccc2 | 19773529 | |||
| 15512229 | 3385 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(C21CCN(CC2)[C@@H]1Cc2c3c1cccc3ccc2)c1ccccc1 | 10476866 | |||
| 8864 | 3385 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(C21CCN(CC2)[C@@H]1Cc2c3c1cccc3ccc2)c1ccccc1 | 10476866 | |||
| CHEMBL355202 | 3385 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(C21CCN(CC2)[C@@H]1Cc2c3c1cccc3ccc2)c1ccccc1 | 10476866 | |||
| 11848225 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | Guide to Pharmacology | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 24713140 | |||
| 11848225.0 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | Guide to Pharmacology | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 24713140 | |||
| 8866 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | Guide to Pharmacology | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 24713140 | |||
| CHEMBL2364605 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | Guide to Pharmacology | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 24713140 | |||
| CHEMBL3545616 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | Guide to Pharmacology | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 24713140 | |||
| CHEMBL3962932 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | Guide to Pharmacology | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 24713140 | |||
| DB12830 | 877 | None | 42 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -10 | 2 | Guide to Pharmacology | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 24713140 | |||
| 8868 | 3547 | None | 23 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 57 | 3 | Guide to Pharmacology | 397 | 4 | 1 | 2 | 5.9 | Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1 | 18492950 | |||
| 9887077 | 3547 | None | 23 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 57 | 3 | Guide to Pharmacology | 397 | 4 | 1 | 2 | 5.9 | Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1 | 18492950 | |||
| CHEMBL513136 | 3547 | None | 23 | Human | Functional | pEC50 | = | 7.9 | 7.9 | 57 | 3 | Guide to Pharmacology | 397 | 4 | 1 | 2 | 5.9 | Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1 | 18492950 | |||
| 8865 | 3238 | None | 0 | Human | Functional | pEC50 | = | 8.8 | 8.8 | - | 1 | Guide to Pharmacology | None | None | None | None | 24903280 | |||||
| 1680 | 269 | None | 0 | Human | Functional | pEC50 | = | 8.7 | 8.7 | - | 1 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 3917 | 3930 | None | 1 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | Guide to Pharmacology | None | None | None | None | 17532097 | |||||
| 3917 | 3930 | None | 1 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | Guide to Pharmacology | None | None | None | None | 19183962 | |||||
| 44430609 | 3930 | None | 1 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | Guide to Pharmacology | None | None | None | None | 17532097 | |||||
| 44430609 | 3930 | None | 1 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | Guide to Pharmacology | None | None | None | None | 19183962 | |||||
| CHEMBL409969 | 3930 | None | 1 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | Guide to Pharmacology | None | None | None | None | 17532097 | |||||
| CHEMBL409969 | 3930 | None | 1 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 3 | 4 | Guide to Pharmacology | None | None | None | None | 19183962 | |||||
| 16131448 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 2 | 5 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 1681 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 2 | 5 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 1688 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 2 | 5 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 44361543 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 2 | 5 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 56947112 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 2 | 5 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Functional | pEC50 | = | 9.1 | 9.1 | 2 | 5 | Guide to Pharmacology | None | None | None | None | 9353393 | |||||
| 1691 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 512 | 3 | Guide to Pharmacology | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10602690 | |||
| 5311194 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 512 | 3 | Guide to Pharmacology | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10602690 | |||
| CHEMBL357076 | 2107 | None | 23 | Human | Functional | pIC50 | = | 8.3 | 8.3 | 512 | 3 | Guide to Pharmacology | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10602690 | |||
| 10047612 | 3529 | None | 11 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | Guide to Pharmacology | 417 | 3 | 1 | 2 | 6.2 | O[C@H]1C[C@H](CCc2c1cccc2C)CN1CCC(CC1)c1c(Cl)cccc1Cl | 14593080 | |||
| 10047612 | 3529 | None | 11 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | Guide to Pharmacology | 417 | 3 | 1 | 2 | 6.2 | O[C@H]1C[C@H](CCc2c1cccc2C)CN1CCC(CC1)c1c(Cl)cccc1Cl | 17329552 | |||
| 1693 | 3529 | None | 11 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | Guide to Pharmacology | 417 | 3 | 1 | 2 | 6.2 | O[C@H]1C[C@H](CCc2c1cccc2C)CN1CCC(CC1)c1c(Cl)cccc1Cl | 14593080 | |||
| 1693 | 3529 | None | 11 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | Guide to Pharmacology | 417 | 3 | 1 | 2 | 6.2 | O[C@H]1C[C@H](CCc2c1cccc2C)CN1CCC(CC1)c1c(Cl)cccc1Cl | 17329552 | |||
| CHEMBL559569 | 3529 | None | 11 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | Guide to Pharmacology | 417 | 3 | 1 | 2 | 6.2 | O[C@H]1C[C@H](CCc2c1cccc2C)CN1CCC(CC1)c1c(Cl)cccc1Cl | 14593080 | |||
| CHEMBL559569 | 3529 | None | 11 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | Guide to Pharmacology | 417 | 3 | 1 | 2 | 6.2 | O[C@H]1C[C@H](CCc2c1cccc2C)CN1CCC(CC1)c1c(Cl)cccc1Cl | 17329552 | |||
| 10296561 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | Guide to Pharmacology | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 16451050 | |||
| 10296561 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | Guide to Pharmacology | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 19445927 | |||
| 7361 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | Guide to Pharmacology | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 16451050 | |||
| 7361 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | Guide to Pharmacology | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 19445927 | |||
| CHEMBL201945 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | Guide to Pharmacology | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 16451050 | |||
| CHEMBL201945 | 1043 | None | 22 | Human | Functional | pIC50 | = | 9.8 | 9.8 | 13182 | 3 | Guide to Pharmacology | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 19445927 | |||
| 10500 | 2825 | None | 0 | Human | Functional | pKB | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 512 | 6 | 1 | 5 | 3.8 | NC(=O)Cn1c(C(=O)N2CCOCC2)c(c2c1cccc2)CN1CCC(CC1)c1c(F)cccc1Cl | 22994368 | |||
| 24889797 | 2825 | None | 0 | Human | Functional | pKB | = | 7.4 | 7.4 | - | 1 | Guide to Pharmacology | 512 | 6 | 1 | 5 | 3.8 | NC(=O)Cn1c(C(=O)N2CCOCC2)c(c2c1cccc2)CN1CCC(CC1)c1c(F)cccc1Cl | 22994368 | |||
| 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 |
|
| CHEMBL414542 | 215598 | None | 0 | Human | Binding | pEC50 | = | 10.2 | 10.2 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 44388462 | 161947 | None | 0 | Human | Binding | pEC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL414782 | 161947 | None | 0 | Human | Binding | pEC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 1970 | 68 | 33 | 31 | -15.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL266191 | 213138 | None | 0 | Human | Binding | pEC50 | = | 10.1 | 10.1 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 162662480 | 182161 | None | 0 | Human | Binding | pEC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 2434 | 92 | 38 | 37 | -12.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4781235 | 182161 | None | 0 | Human | Binding | pEC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 2434 | 92 | 38 | 37 | -12.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL408356 | 215168 | None | 0 | Human | Binding | pEC50 | = | 9.9 | 9.9 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 44388461 | 159934 | None | 0 | Human | Binding | pEC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL410653 | 159934 | None | 0 | Human | Binding | pEC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | 1952 | 68 | 33 | 31 | -15.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL415845 | 215664 | None | 0 | Human | Binding | pEC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 44388467 | 169508 | None | 0 | Human | Binding | pEC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL442297 | 169508 | None | 0 | Human | Binding | pEC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL264084 | 213064 | None | 0 | Human | Binding | pEC50 | = | 9.6 | 9.6 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 162662934 | 182133 | None | 0 | Human | Binding | pEC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 1789 | 67 | 24 | 23 | -3.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4780822 | 182133 | None | 0 | Human | Binding | pEC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 1789 | 67 | 24 | 23 | -3.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162676761 | 183622 | None | 0 | Human | Binding | pEC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 1848 | 68 | 26 | 25 | -5.3 | CCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4799815 | 183622 | None | 0 | Human | Binding | pEC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | 1848 | 68 | 26 | 25 | -5.3 | CCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 124565311 | 174174 | None | 0 | Human | Binding | pEC50 | = | 9.5 | 9.5 | 165 | 2 | ChEMBL | 440 | 4 | 1 | 5 | 3.6 | CNC(=O)Cn1c(=O)n(C2CCN([C@H]3Cc4cccc5cccc3c45)CC2)c2ccccc21 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL4544227 | 174174 | None | 0 | Human | Binding | pEC50 | = | 9.5 | 9.5 | 165 | 2 | ChEMBL | 440 | 4 | 1 | 5 | 3.6 | CNC(=O)Cn1c(=O)n(C2CCN([C@H]3Cc4cccc5cccc3c45)CC2)c2ccccc21 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL264846 | 213091 | None | 0 | Human | Binding | pEC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 44388474 | 161136 | None | 0 | Human | Binding | pEC50 | = | 9.4 | 9.4 | - | 1 | ChEMBL | 1970 | 69 | 33 | 31 | -15.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL411649 | 161136 | None | 0 | Human | Binding | pEC50 | = | 9.4 | 9.4 | - | 1 | ChEMBL | 1970 | 69 | 33 | 31 | -15.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 162676231 | 183432 | None | 0 | Human | Binding | pEC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 1805 | 68 | 25 | 24 | -4.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4797388 | 183432 | None | 0 | Human | Binding | pEC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | 1805 | 68 | 25 | 24 | -4.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm0202021 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm0202021 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm0202021 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm0202021 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm0202021 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.4 | 9.4 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm0202021 | |||||
| 162656512 | 181013 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1399 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(F)cc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4757730 | 181013 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1399 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(F)cc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL410979 | 215315 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 162651080 | 180326 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1720 | 64 | 22 | 23 | -3.2 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4749802 | 180326 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1720 | 64 | 22 | 23 | -3.2 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162650489 | 180140 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1876 | 70 | 26 | 25 | -4.5 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4747497 | 180140 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1876 | 70 | 26 | 25 | -4.5 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162669053 | 182833 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1365 | 46 | 23 | 19 | -7.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4789749 | 182833 | None | 0 | Human | Binding | pEC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 1365 | 46 | 23 | 19 | -7.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL438537 | 216235 | None | 0 | Human | Binding | pEC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 162676138 | 183504 | None | 0 | Human | Binding | pEC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 2861 | 104 | 44 | 43 | -15.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4798159 | 183504 | None | 0 | Human | Binding | pEC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 2861 | 104 | 44 | 43 | -15.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL263588 | 213038 | None | 0 | Human | Binding | pEC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 44388466 | 96554 | None | 0 | Human | Binding | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 1938 | 69 | 33 | 31 | -14.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL262544 | 96554 | None | 0 | Human | Binding | pEC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 1938 | 69 | 33 | 31 | -14.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL415584 | 215652 | None | 0 | Human | Binding | pEC50 | = | 9 | 9.0 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.0 | 9.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.0 | 9.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.0 | 9.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.0 | 9.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.0 | 9.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pEC50 | = | 9.0 | 9.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 162661740 | 181950 | None | 0 | Human | Binding | pEC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 2777 | 104 | 44 | 43 | -17.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4778484 | 181950 | None | 0 | Human | Binding | pEC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 2777 | 104 | 44 | 43 | -17.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL406905 | 215089 | None | 0 | Human | Binding | pEC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1CCCCC1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| 162670125 | 182705 | None | 0 | Human | Binding | pEC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4788218 | 182705 | None | 0 | Human | Binding | pEC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162670701 | 182990 | None | 0 | Human | Binding | pEC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 1748 | 64 | 24 | 23 | -4.1 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4792010 | 182990 | None | 0 | Human | Binding | pEC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 1748 | 64 | 24 | 23 | -4.1 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 10276738 | 172364 | None | 0 | Human | Binding | pEC50 | = | 8.8 | 8.8 | 54 | 2 | ChEMBL | 466 | 5 | 2 | 3 | 6.1 | NCc1ccccc1C1(O)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL4474536 | 172364 | None | 0 | Human | Binding | pEC50 | = | 8.8 | 8.8 | 54 | 2 | ChEMBL | 466 | 5 | 2 | 3 | 6.1 | NCc1ccccc1C1(O)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/acs.jmedchem.5b01499 | |||
| 162645148 | 179523 | None | 0 | Human | Binding | pEC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 1904 | 72 | 26 | 25 | -3.7 | CCCCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4740203 | 179523 | None | 0 | Human | Binding | pEC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 1904 | 72 | 26 | 25 | -3.7 | CCCCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL265801 | 213122 | None | 0 | Human | Binding | pEC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(N)=O | 10.1021/jm010092i | |||||
| 1682 | 2852 | None | 17 | Human | Binding | pEC50 | = | 8 | 8.0 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b02057 | |||||
| 6324645 | 2852 | None | 17 | Human | Binding | pEC50 | = | 8 | 8.0 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Binding | pEC50 | = | 8 | 8.0 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL405212 | 215010 | None | 0 | Human | Binding | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)N(C)C(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| CHEMBL439528 | 216305 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| 162653778 | 180587 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1379 | 47 | 23 | 19 | -7.5 | CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4753041 | 180587 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1379 | 47 | 23 | 19 | -7.5 | CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162652312 | 180426 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4751132 | 180426 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162649797 | 180137 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 2830 | 92 | 44 | 43 | -18.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4747450 | 180137 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 2830 | 92 | 44 | 43 | -18.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162650108 | 180247 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 2101 | 80 | 29 | 34 | -12.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4748849 | 180247 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 2101 | 80 | 29 | 34 | -12.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 11848225 | 877 | None | 42 | Human | Binding | pEC50 | = | 7.9 | 7.9 | -4 | 7 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/acs.jmedchem.5b01499 | |||
| 11848225.0 | 877 | None | 42 | Human | Binding | pEC50 | = | 7.9 | 7.9 | -4 | 7 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/acs.jmedchem.5b01499 | |||
| 8866 | 877 | None | 42 | Human | Binding | pEC50 | = | 7.9 | 7.9 | -4 | 7 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL2364605 | 877 | None | 42 | Human | Binding | pEC50 | = | 7.9 | 7.9 | -4 | 7 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL3545616 | 877 | None | 42 | Human | Binding | pEC50 | = | 7.9 | 7.9 | -4 | 7 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL3962932 | 877 | None | 42 | Human | Binding | pEC50 | = | 7.9 | 7.9 | -4 | 7 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/acs.jmedchem.5b01499 | |||
| DB12830 | 877 | None | 42 | Human | Binding | pEC50 | = | 7.9 | 7.9 | -4 | 7 | ChEMBL | 378 | 2 | 1 | 2 | 5.1 | Fc1ccc2c(c1)c1CCOC3(c1[nH]2)CCC(CC3)(N(C)C)c1ccccc1 | 10.1021/acs.jmedchem.5b01499 | |||
| 162659015 | 181496 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4763461 | 181496 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162652312 | 180426 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4751132 | 180426 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL412479 | 215455 | None | 0 | Human | Binding | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)O | 10.1021/acs.jmedchem.9b02057 | |||||
| 162661740 | 181950 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2777 | 104 | 44 | 43 | -17.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4778484 | 181950 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2777 | 104 | 44 | 43 | -17.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 11804490 | 181921 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 1296 | 43 | 21 | 19 | -8.1 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4778171 | 181921 | None | 0 | Human | Binding | pEC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 1296 | 43 | 21 | 19 | -8.1 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL2403216 | 212876 | None | 0 | Rat | Binding | pEC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | None | None | None | COc1ccc2[nH]cc([C@H](CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CCCNC(=N)N)NC(C)=O)C(=O)N[C@@H](CCCCN)C(N)=O)c2c1 | 10.1016/j.bmcl.2013.05.064 | |||||
| 162650108 | 180247 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2101 | 80 | 29 | 34 | -12.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4748849 | 180247 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2101 | 80 | 29 | 34 | -12.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL2403218 | 212878 | None | 18 | Rat | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | None | None | None | CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmcl.2013.05.064 | |||||
| 11137032 | 181544 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4764102 | 181544 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 25208097 | 184028 | None | 1 | Human | Binding | pEC50 | = | 5.8 | 5.8 | 5 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL481366 | 184028 | None | 1 | Human | Binding | pEC50 | = | 5.8 | 5.8 | 5 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/acs.jmedchem.8b00435 | |||
| 162661631 | 181984 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4778926 | 181984 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL2403216 | 212876 | None | 0 | Rat | Binding | pEC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | None | None | None | COc1ccc2[nH]cc([C@H](CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CCCNC(=N)N)NC(C)=O)C(=O)N[C@@H](CCCCN)C(N)=O)c2c1 | 10.1016/j.bmcl.2013.05.064 | |||||
| 162676138 | 183504 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2861 | 104 | 44 | 43 | -15.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4798159 | 183504 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2861 | 104 | 44 | 43 | -15.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162650867 | 180309 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2698 | 92 | 44 | 43 | -21.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4749620 | 180309 | None | 0 | Human | Binding | pEC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 2698 | 92 | 44 | 43 | -21.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 5311327 | 180543 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4752457 | 180543 | None | 0 | Human | Binding | pEC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162662934 | 182133 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1789 | 67 | 24 | 23 | -3.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4780822 | 182133 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1789 | 67 | 24 | 23 | -3.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162665903 | 182435 | None | 0 | Human | Binding | pEC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC1(C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)CCCC1 | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4784371 | 182435 | None | 0 | Human | Binding | pEC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC1(C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)CCCC1 | 10.1021/acs.jmedchem.9b02057 | |||
| 9905428 | 4410 | None | 15 | Human | Binding | pEC50 | = | 7.7 | 7.7 | 21 | 3 | ChEMBL | 326 | 2 | 0 | 2 | 4.2 | O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL101454 | 4410 | None | 15 | Human | Binding | pEC50 | = | 7.7 | 7.7 | 21 | 3 | ChEMBL | 326 | 2 | 0 | 2 | 4.2 | O=C1Cc2ccccc2N1C1CCN(C2CCCCCCC2)CC1 | 10.1021/acs.jmedchem.5b01499 | |||
| 162659601 | 181305 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1393 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4761103 | 181305 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1393 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162646448 | 179805 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4743726 | 179805 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162651080 | 180326 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1720 | 64 | 22 | 23 | -3.2 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4749802 | 180326 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1720 | 64 | 22 | 23 | -3.2 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 11137032 | 181544 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4764102 | 181544 | None | 0 | Human | Binding | pEC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162655432 | 180787 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1420 | 47 | 25 | 20 | -8.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4755353 | 180787 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1420 | 47 | 25 | 20 | -8.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162655941 | 180848 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4755981 | 180848 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162648427 | 180067 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 2782 | 92 | 44 | 43 | -19.4 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4746696 | 180067 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 2782 | 92 | 44 | 43 | -19.4 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162676761 | 183622 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1848 | 68 | 26 | 25 | -5.3 | CCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4799815 | 183622 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1848 | 68 | 26 | 25 | -5.3 | CCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 25208097 | 184028 | None | 1 | Human | Binding | pEC50 | = | 5.6 | 5.6 | 5 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL481366 | 184028 | None | 1 | Human | Binding | pEC50 | = | 5.6 | 5.6 | 5 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/acs.jmedchem.8b00435 | |||
| 10832076 | 38062 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 355 | 3 | 1 | 4 | 4.8 | CC(c1ccccc1Cl)N1CCC(n2c(O)nc3ccccc32)CC1 | 10.1021/jm990517p | |||
| CHEMBL146054 | 38062 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 355 | 3 | 1 | 4 | 4.8 | CC(c1ccccc1Cl)N1CCC(n2c(O)nc3ccccc32)CC1 | 10.1021/jm990517p | |||
| 10534521 | 183157 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4794113 | 183157 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162650635 | 180202 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1394 | 48 | 24 | 20 | -9.3 | C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4748275 | 180202 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1394 | 48 | 24 | 20 | -9.3 | C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162659601 | 181305 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1393 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4761103 | 181305 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1393 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162671943 | 183040 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1776 | 57 | 26 | 25 | -7.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NC2CCCCCCC2)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4792616 | 183040 | None | 0 | Human | Binding | pEC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 1776 | 57 | 26 | 25 | -7.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NC2CCCCCCC2)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162659015 | 181496 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4763461 | 181496 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162673971 | 183256 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4795259 | 183256 | None | 0 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162669053 | 182833 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1365 | 46 | 23 | 19 | -7.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4789749 | 182833 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1365 | 46 | 23 | 19 | -7.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162671943 | 183040 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1776 | 57 | 26 | 25 | -7.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NC2CCCCCCC2)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4792616 | 183040 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1776 | 57 | 26 | 25 | -7.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NC2CCCCCCC2)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162656512 | 181013 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1399 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(F)cc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4757730 | 181013 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1399 | 47 | 24 | 20 | -8.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(F)cc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162670125 | 182705 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4788218 | 182705 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162676231 | 183432 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1805 | 68 | 25 | 24 | -4.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4797388 | 183432 | None | 0 | Human | Binding | pEC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 1805 | 68 | 25 | 24 | -4.0 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 10763594 | 161371 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | 120 | 4 | ChEMBL | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CC[C@H]3CCCc4cccc1c43)CC2 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL412098 | 161371 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | 120 | 4 | ChEMBL | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CC[C@H]3CCCc4cccc1c43)CC2 | 10.1021/acs.jmedchem.5b01499 | |||
| 15512228 | 67777 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | 8 | 3 | ChEMBL | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(c2ccccc2)C12CCN([C@H]1Cc3cccc4cccc1c34)CC2 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL1907858 | 67777 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | 8 | 3 | ChEMBL | 383 | 2 | 1 | 3 | 3.9 | O=C1NCN(c2ccccc2)C12CCN([C@H]1Cc3cccc4cccc1c34)CC2 | 10.1021/acs.jmedchem.5b01499 | |||
| 162661152 | 181631 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4765138 | 181631 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162649797 | 180137 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 2830 | 92 | 44 | 43 | -18.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4747450 | 180137 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 2830 | 92 | 44 | 43 | -18.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@@H](Cc2cnc[nH]2)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162648962 | 179896 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC(C)(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4744757 | 179896 | None | 0 | Human | Binding | pEC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC(C)(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162657281 | 181080 | None | 0 | Human | Binding | pEC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4758592 | 181080 | None | 0 | Human | Binding | pEC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162655941 | 180848 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4755981 | 180848 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL414541 | 215597 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)N(C)C(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 162653778 | 180587 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1379 | 47 | 23 | 19 | -7.5 | CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4753041 | 180587 | None | 0 | Human | Binding | pEC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 1379 | 47 | 23 | 19 | -7.5 | CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL413429 | 215527 | None | 0 | Human | Binding | pEC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| 155544763 | 173460 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | 7 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN([C@@H]2CC[C@H]3CCCc4cccc2c43)CC1 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL4527189 | 173460 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | 7 | 2 | ChEMBL | 386 | 2 | 0 | 2 | 5.0 | O=C1Cc2ccccc2N1C1CCN([C@@H]2CC[C@H]3CCCc4cccc2c43)CC1 | 10.1021/acs.jmedchem.5b01499 | |||
| 162645845 | 179781 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 2032 | 78 | 28 | 27 | -4.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4743479 | 179781 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 2032 | 78 | 28 | 27 | -4.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 11804490 | 181921 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1296 | 43 | 21 | 19 | -8.1 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4778171 | 181921 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1296 | 43 | 21 | 19 | -8.1 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162650867 | 180309 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 2698 | 92 | 44 | 43 | -21.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4749620 | 180309 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 2698 | 92 | 44 | 43 | -21.7 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162658205 | 181235 | None | 0 | Human | Binding | pEC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4760586 | 181235 | None | 0 | Human | Binding | pEC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162645845 | 179781 | None | 0 | Human | Binding | pEC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 2032 | 78 | 28 | 27 | -4.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4743479 | 179781 | None | 0 | Human | Binding | pEC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 2032 | 78 | 28 | 27 | -4.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL406905 | 215089 | None | 0 | Human | Binding | pEC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1CCCCC1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL414767 | 215614 | None | 0 | Human | Binding | pEC50 | = | 8.3 | 8.3 | 154 | 2 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| CHEMBL436732 | 216148 | None | 0 | Human | Binding | pEC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 162657281 | 181080 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4758592 | 181080 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL413944 | 215563 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 10593778 | 99296 | None | 0 | Human | Binding | pEC50 | = | 6.3 | 6.3 | 10 | 4 | ChEMBL | 347 | 2 | 1 | 3 | 2.6 | O=C1NCN(c2ccccc2)C12CCN(C1Cc3ccccc3C1)CC2 | 10.1021/jm991129q | |||
| CHEMBL28172 | 99296 | None | 0 | Human | Binding | pEC50 | = | 6.3 | 6.3 | 10 | 4 | ChEMBL | 347 | 2 | 1 | 3 | 2.6 | O=C1NCN(c2ccccc2)C12CCN(C1Cc3ccccc3C1)CC2 | 10.1021/jm991129q | |||
| 1682 | 2852 | None | 17 | Rat | Binding | pEC50 | = | 7.3 | 7.3 | - | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2013.05.064 | |||||
| 6324645 | 2852 | None | 17 | Rat | Binding | pEC50 | = | 7.3 | 7.3 | - | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2013.05.064 | |||||
| CHEMBL384755 | 2852 | None | 17 | Rat | Binding | pEC50 | = | 7.3 | 7.3 | - | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2013.05.064 | |||||
| CHEMBL414543 | 215599 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)N(C)C(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 5311327 | 180543 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4752457 | 180543 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162650489 | 180140 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1876 | 70 | 26 | 25 | -4.5 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4747497 | 180140 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1876 | 70 | 26 | 25 | -4.5 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162670701 | 182990 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1748 | 64 | 24 | 23 | -4.1 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4792010 | 182990 | None | 0 | Human | Binding | pEC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 1748 | 64 | 24 | 23 | -4.1 | CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162672438 | 183333 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 2215 | 89 | 29 | 28 | -2.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4796153 | 183333 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 2215 | 89 | 29 | 28 | -2.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162662480 | 182161 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 2434 | 92 | 38 | 37 | -12.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4781235 | 182161 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 2434 | 92 | 38 | 37 | -12.5 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162665903 | 182435 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC1(C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)CCCC1 | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4784371 | 182435 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC1(C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O)CCCC1 | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL2403218 | 212878 | None | 18 | Rat | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | None | None | None | CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmcl.2013.05.064 | |||||
| 162648962 | 179896 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC(C)(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4744757 | 179896 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NC(C)(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162672438 | 183333 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 2215 | 89 | 29 | 28 | -2.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4796153 | 183333 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 2215 | 89 | 29 | 28 | -2.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CSC1CC(=O)N(CCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)NCCCCCCCCCCC(N)=O)C1=O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL412479 | 215455 | None | 0 | Human | Binding | pEC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)O | 10.1021/acs.jmedchem.9b02057 | |||||
| 162645148 | 179523 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1904 | 72 | 26 | 25 | -3.7 | CCCCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4740203 | 179523 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1904 | 72 | 26 | 25 | -3.7 | CCCCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O | 10.1021/acs.jmedchem.9b02057 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pEC50 | = | 7.2 | 7.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm991129q | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pEC50 | = | 7.2 | 7.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm991129q | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pEC50 | = | 7.2 | 7.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm991129q | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pEC50 | = | 7.2 | 7.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm991129q | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pEC50 | = | 7.2 | 7.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm991129q | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pEC50 | = | 7.2 | 7.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm991129q | |||||
| 162655432 | 180787 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1420 | 47 | 25 | 20 | -8.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4755353 | 180787 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1420 | 47 | 25 | 20 | -8.3 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 10534521 | 183157 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4794113 | 183157 | None | 0 | Human | Binding | pEC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 416359 | 101915 | None | 16 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 307 | 3 | 1 | 4 | 3.6 | Oc1nc2ccccc2n1C1CCN(Cc2ccccc2)CC1 | 10.1021/jm990517p | |||
| CHEMBL300616 | 101915 | None | 16 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 307 | 3 | 1 | 4 | 3.6 | Oc1nc2ccccc2n1C1CCN(Cc2ccccc2)CC1 | 10.1021/jm990517p | |||
| 162661631 | 181984 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4778926 | 181984 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1324 | 43 | 23 | 19 | -8.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162671290 | 182934 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 2914 | 92 | 44 | 43 | -16.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4791156 | 182934 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 2914 | 92 | 44 | 43 | -16.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162673058 | 183232 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4795008 | 183232 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162673058 | 183232 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4795008 | 183232 | None | 0 | Human | Binding | pEC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 1421 | 47 | 24 | 20 | -7.9 | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CCCC1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162661152 | 181631 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4765138 | 181631 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162645528 | 179740 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 1351 | 46 | 23 | 19 | -8.2 | C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4742892 | 179740 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 1351 | 46 | 23 | 19 | -8.2 | C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162645528 | 179740 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1351 | 46 | 23 | 19 | -8.2 | C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4742892 | 179740 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1351 | 46 | 23 | 19 | -8.2 | C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 11583008 | 175967 | None | 8 | Human | Binding | pEC50 | = | 7.1 | 7.1 | 213 | 2 | ChEMBL | 439 | 4 | 1 | 4 | 5.4 | OC1(c2ncccn2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL4585935 | 175967 | None | 8 | Human | Binding | pEC50 | = | 7.1 | 7.1 | 213 | 2 | ChEMBL | 439 | 4 | 1 | 4 | 5.4 | OC1(c2ncccn2)CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl | 10.1021/acs.jmedchem.5b01499 | |||
| 162646448 | 179805 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4743726 | 179805 | None | 0 | Human | Binding | pEC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 1395 | 47 | 24 | 20 | -8.4 | C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 1682 | 2852 | None | 17 | Human | Binding | pEC50 | = | 8.1 | 8.1 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b02057 | |||||
| 6324645 | 2852 | None | 17 | Human | Binding | pEC50 | = | 8.1 | 8.1 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Binding | pEC50 | = | 8.1 | 8.1 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL410396 | 215278 | None | 13 | Human | Binding | pEC50 | = | 8.1 | 8.1 | 1 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| 162650635 | 180202 | None | 0 | Human | Binding | pEC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1394 | 48 | 24 | 20 | -9.3 | C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4748275 | 180202 | None | 0 | Human | Binding | pEC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 1394 | 48 | 24 | 20 | -9.3 | C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162671290 | 182934 | None | 0 | Human | Binding | pEC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 2914 | 92 | 44 | 43 | -16.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4791156 | 182934 | None | 0 | Human | Binding | pEC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 2914 | 92 | 44 | 43 | -16.5 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162673971 | 183256 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4795259 | 183256 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162648427 | 180067 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 2782 | 92 | 44 | 43 | -19.4 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4746696 | 180067 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 2782 | 92 | 44 | 43 | -19.4 | C[C@H](NC(=O)CCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(N)=O)C1=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL429239 | 215979 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL427617 | 215817 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)N(C)C(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 162658205 | 181235 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4760586 | 181235 | None | 0 | Human | Binding | pEC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 1381 | 47 | 24 | 20 | -8.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 24882570 | 115195 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343946 | 115195 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343947 | 115195 | None | 0 | Human | Binding | pIC50 | = | 10.5 | 10.5 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL414736 | 215612 | None | 0 | Human | Binding | pIC50 | = | 10.3 | 10.3 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1016/j.bmcl.2006.06.060 | |||||
| 101354795 | 115197 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 967 | 31 | 16 | 12 | -1.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343949 | 115197 | None | 0 | Human | Binding | pIC50 | = | 10.2 | 10.2 | - | 0 | ChEMBL | 967 | 31 | 16 | 12 | -1.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| 44416445 | 169455 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 1847 | 62 | 28 | 25 | -8.2 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)CNC(=O)CNC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1016/j.bmcl.2006.06.060 | |||
| CHEMBL441930 | 169455 | None | 0 | Human | Binding | pIC50 | = | 10.1 | 10.1 | - | 0 | ChEMBL | 1847 | 62 | 28 | 25 | -8.2 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)CNC(=O)CNC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1016/j.bmcl.2006.06.060 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| CHEMBL443591 | 216387 | None | 0 | Human | Binding | pIC50 | = | 9.9 | 9.9 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]1CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC1=O | 10.1021/jm010092i | |||||
| CHEMBL511107 | 218083 | None | 0 | Rat | Binding | pIC50 | = | 9.8 | 9.8 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 16143911 | 467 | None | 15 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1689 | 467 | None | 15 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL505874 | 467 | None | 15 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL506825 | 216701 | None | 0 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 16143911 | 467 | None | 15 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 1689 | 467 | None | 15 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL505874 | 467 | None | 15 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | - | 1 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 11511090 | 74079 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202225 | 74079 | None | 0 | Human | Binding | pIC50 | = | 9.7 | 9.7 | - | 0 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.7 | 9.7 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL556388 | 218225 | None | 0 | Rat | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL559130 | 218233 | None | 0 | Rat | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 10296561 | 1043 | None | 22 | Human | Binding | pIC50 | = | 9.6 | 9.6 | 23 | 2 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1021/jm0509851 | |||
| 7361 | 1043 | None | 22 | Human | Binding | pIC50 | = | 9.6 | 9.6 | 23 | 2 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1021/jm0509851 | |||
| CHEMBL201945 | 1043 | None | 22 | Human | Binding | pIC50 | = | 9.6 | 9.6 | 23 | 2 | ChEMBL | 433 | 7 | 1 | 4 | 3.7 | O=C([C@H]1CCCN1Cc1ccccc1)NCCCN1CCC2(CC1)OCc1c2cccc1 | 10.1021/jm0509851 | |||
| CHEMBL507847 | 217045 | None | 0 | Rat | Binding | pIC50 | = | 9.6 | 9.6 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL265801 | 213122 | None | 0 | Human | Binding | pIC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(N)=O | 10.1021/jm010092i | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2013.03.016 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2013.03.016 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2013.03.016 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2013.03.016 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2013.03.016 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2013.03.016 | |||||
| CHEMBL555757 | 218222 | None | 0 | Rat | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL526333 | 218170 | None | 0 | Rat | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL558807 | 218232 | None | 0 | Rat | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL500773 | 216615 | None | 0 | Rat | Binding | pIC50 | = | 9.5 | 9.5 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1682 | 2852 | None | 17 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/jm010092i | |||||
| 6324645 | 2852 | None | 17 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/jm010092i | |||||
| CHEMBL384755 | 2852 | None | 17 | Human | Binding | pIC50 | = | 9.5 | 9.5 | 3 | 2 | ChEMBL | None | None | None | None | 10.1021/jm010092i | |||||
| CHEMBL503512 | 216657 | None | 0 | Rat | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL504587 | 216669 | None | 0 | Rat | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL505632 | 216683 | None | 0 | Rat | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL504587 | 216669 | None | 0 | Rat | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| CHEMBL505824 | 216685 | None | 0 | Rat | Binding | pIC50 | = | 9.4 | 9.4 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL406718 | 215077 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(N)=O | 10.1021/jm010092i | |||||
| CHEMBL504872 | 216673 | None | 0 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 44143431 | 178611 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL466648 | 178611 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| 44143431 | 178611 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL466648 | 178611 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | 417 | 5 | 1 | 5 | 4.7 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL437915 | 216200 | None | 0 | Human | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O | 10.1021/jm010092i | |||||
| CHEMBL499157 | 216579 | None | 0 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 155569742 | 176757 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 415 | 6 | 1 | 5 | 3.6 | O=c1n(CCF)c2ccccc2n1[C@H]1CCN(C[C@H]2CCCCC23CC3)C[C@@H]1CO | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL4454908 | 176757 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 415 | 6 | 1 | 5 | 3.6 | O=c1n(CCF)c2ccccc2n1[C@H]1CCN(C[C@H]2CCCCC23CC3)C[C@@H]1CO | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL4598052 | 176757 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 415 | 6 | 1 | 5 | 3.6 | O=c1n(CCF)c2ccccc2n1[C@H]1CCN(C[C@H]2CCCCC23CC3)C[C@@H]1CO | 10.1021/acs.jmedchem.5b01499 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.2 | 9.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44456296 | 97773 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 909 | 31 | 15 | 11 | -2.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC=O)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL271478 | 97773 | None | 0 | Human | Binding | pIC50 | = | 9.2 | 9.2 | - | 0 | ChEMBL | 909 | 31 | 15 | 11 | -2.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC=O)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1679 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.06.060 | |||||
| 9963005 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.06.060 | |||||
| CHEMBL437723 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.06.060 | |||||
| 44416444 | 161686 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 1604 | 53 | 23 | 20 | -3.6 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCNC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1016/j.bmcl.2006.06.060 | |||
| CHEMBL412939 | 161686 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 1604 | 53 | 23 | 20 | -3.6 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCNC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1016/j.bmcl.2006.06.060 | |||
| 1679 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 9963005 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| CHEMBL437723 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.1 | 9.1 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.11.043 | |||||
| 44143437 | 178740 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 432 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(CC)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL467533 | 178740 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 432 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(CC)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44143433 | 178671 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 463 | 5 | 1 | 5 | 4.6 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N(C)C(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL467057 | 178671 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 463 | 5 | 1 | 5 | 4.6 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N(C)C(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 44143433 | 178671 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 463 | 5 | 1 | 5 | 4.6 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N(C)C(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467057 | 178671 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 0 | ChEMBL | 463 | 5 | 1 | 5 | 4.6 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N(C)C(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL269029 | 213234 | None | 0 | Human | Binding | pIC50 | = | 9.1 | 9.1 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 45273531 | 196010 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 348 | 5 | 1 | 4 | 4.3 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C(C)C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL541511 | 196010 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 348 | 5 | 1 | 4 | 4.3 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C(C)C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL504461 | 216666 | None | 0 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 72548703 | 161661 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | |||
| CHEMBL4128926 | 161661 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 583 | 8 | 3 | 6 | 5.8 | CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2018.03.093 | |||
| 44143451 | 178820 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 449 | 5 | 2 | 5 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](C(=O)NC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468315 | 178820 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 449 | 5 | 2 | 5 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](C(=O)NC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL505873 | 216687 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL525604 | 218147 | None | 0 | Rat | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1679 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.0 | 9.0 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 9963005 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.0 | 9.0 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| CHEMBL437723 | 268 | None | 20 | Human | Binding | pIC50 | = | 9.0 | 9.0 | 1 | 2 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 44143456 | 178700 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 460 | 5 | 1 | 7 | 5.0 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnco5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467279 | 178700 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 460 | 5 | 1 | 7 | 5.0 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnco5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44576628 | 187833 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL495402 | 187833 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| 44143430 | 189496 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.8 | Cc1ncc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL512975 | 189496 | None | 0 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.8 | Cc1ncc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cc1F | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL504540 | 216668 | None | 0 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL524339 | 218094 | None | 0 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL524873 | 218116 | None | 0 | Rat | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 24857820 | 96738 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263918 | 96738 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 24857820 | 96738 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL263918 | 96738 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL389521 | 214887 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2016.11.014 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.9 | 8.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2016.03.006 | |||||
| 118717442 | 115196 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 953 | 31 | 16 | 12 | -1.6 | CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343948 | 115196 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 953 | 31 | 16 | 12 | -1.6 | CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2014.09.018 | |||
| 9823363 | 178572 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 418 | 4 | 2 | 5 | 3.9 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466308 | 178572 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 418 | 4 | 2 | 5 | 3.9 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 45273546 | 198231 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 353 | 6 | 1 | 4 | 3.5 | COCc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL557721 | 198231 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 353 | 6 | 1 | 4 | 3.5 | COCc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 44143450 | 188925 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 475 | 5 | 1 | 5 | 4.8 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N5CCCC5=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL506207 | 188925 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 475 | 5 | 1 | 5 | 4.8 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](N5CCCC5=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 45269358 | 198647 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 427 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL561397 | 198647 | None | 0 | Human | Binding | pIC50 | = | 8.9 | 8.9 | - | 0 | ChEMBL | 427 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2013.01.044 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2013.01.044 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2013.01.044 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2013.01.044 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2013.01.044 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.ejmech.2013.01.044 | |||||
| CHEMBL526352 | 218172 | None | 0 | Rat | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 101354795 | 115197 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 967 | 31 | 16 | 12 | -1.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343949 | 115197 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 967 | 31 | 16 | 12 | -1.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| 44143455 | 178565 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nc(C)no5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466252 | 178565 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nc(C)no5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44456220 | 155529 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 937 | 31 | 15 | 11 | -1.3 | CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL403807 | 155529 | None | 0 | Human | Binding | pIC50 | = | 8.8 | 8.8 | - | 0 | ChEMBL | 937 | 31 | 15 | 11 | -1.3 | CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm8007618 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm8007618 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm8007618 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm8007618 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm8007618 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.8 | 8.8 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm8007618 | |||||
| 44450085 | 96737 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 408 | 5 | 2 | 5 | 4.1 | CC1(Sc2nc3cc(Cl)c(N4CCN(CCO)CC4)cc3[nH]2)CCCCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263917 | 96737 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 408 | 5 | 2 | 5 | 4.1 | CC1(Sc2nc3cc(Cl)c(N4CCN(CCO)CC4)cc3[nH]2)CCCCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44143457 | 178701 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnc(C)o5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467280 | 178701 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 474 | 5 | 1 | 7 | 5.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnc(C)o5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 44456185 | 166716 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 951 | 32 | 15 | 11 | -0.9 | CCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL428076 | 166716 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 951 | 32 | 15 | 11 | -0.9 | CCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 44143448 | 178762 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 449 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467677 | 178762 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 449 | 5 | 2 | 5 | 4.3 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(C)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44189735 | 14028 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL1197249 | 14028 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL563980 | 14028 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| 11619553 | 161814 | None | 1 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 424 | 6 | 1 | 2 | 5.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL413571 | 161814 | None | 1 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 424 | 6 | 1 | 2 | 5.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1-c1ccccc1 | 10.1021/jm0509851 | |||
| 22272974 | 96731 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 366 | 6 | 1 | 4 | 4.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CC)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263903 | 96731 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 366 | 6 | 1 | 4 | 4.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CC)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 15982795 | 72175 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 426 | 4 | 0 | 4 | 4.4 | COC(=O)CN1C(=O)C2(CCN(CC3CCC(C(C)(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL197942 | 72175 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 426 | 4 | 0 | 4 | 4.4 | COC(=O)CN1C(=O)C2(CCN(CC3CCC(C(C)(C)C)CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44404679 | 168537 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 398 | 4 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL434944 | 168537 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 398 | 4 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44406497 | 136090 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 439 | 3 | 2 | 4 | 3.9 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(Cl)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL373170 | 136090 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 439 | 3 | 2 | 4 | 3.9 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(Cl)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 44406604 | 140708 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 419 | 3 | 2 | 4 | 3.6 | Cc1ccccc1[C@]1(O)CCCC[C@H]1N1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL381419 | 140708 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 419 | 3 | 2 | 4 | 3.6 | Cc1ccccc1[C@]1(O)CCCC[C@H]1N1CCC2(CC1)C(=O)NCN2c1ccccc1 | 10.1016/j.bmcl.2005.09.067 | |||
| 44406603 | 166158 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 423 | 3 | 2 | 4 | 3.4 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL425753 | 166158 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 0 | ChEMBL | 423 | 3 | 2 | 4 | 3.4 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 15982659 | 72323 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 440 | 5 | 0 | 4 | 4.4 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc(-c4ccccc4)cc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198322 | 72323 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 440 | 5 | 0 | 4 | 4.4 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc(-c4ccccc4)cc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44404706 | 135272 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 378 | 4 | 0 | 4 | 3.3 | COC(=O)CN1C(=O)C2(CCN(C(C)c3ccccc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL372135 | 135272 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 378 | 4 | 0 | 4 | 3.3 | COC(=O)CN1C(=O)C2(CCN(C(C)c3ccccc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 15983065 | 135432 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 446 | 5 | 0 | 5 | 4.5 | COC(=O)CN1C(=O)C2(CCN(Cc3ccccc3-c3ccsc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL372779 | 135432 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 446 | 5 | 0 | 5 | 4.5 | COC(=O)CN1C(=O)C2(CCN(Cc3ccccc3-c3ccsc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 15982796 | 140980 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 442 | 12 | 0 | 4 | 5.3 | CCCCCCC(CCCC)CN1CCC2(CC1)C(=O)N(CC(=O)OC)c1ccccc12 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL382086 | 140980 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 442 | 12 | 0 | 4 | 5.3 | CCCCCCC(CCCC)CN1CCC2(CC1)C(=O)N(CC(=O)OC)c1ccccc12 | 10.1016/j.bmcl.2005.08.009 | |||
| 44406587 | 72872 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 473 | 3 | 2 | 4 | 4.6 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(Cl)c(Cl)c1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL200227 | 72872 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 473 | 3 | 2 | 4 | 4.6 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(Cl)c(Cl)c1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 44406503 | 168753 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 441 | 3 | 2 | 4 | 3.5 | O=C1NCN(c2ccc(F)cc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL436295 | 168753 | None | 0 | Human | Binding | pIC50 | = | 5 | 5.0 | - | 0 | ChEMBL | 441 | 3 | 2 | 4 | 3.5 | O=C1NCN(c2ccc(F)cc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(F)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 44406543 | 135328 | None | 0 | Human | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 457 | 3 | 2 | 4 | 4.0 | O=C1NCN(c2ccc(F)cc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(Cl)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL372567 | 135328 | None | 0 | Human | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 457 | 3 | 2 | 4 | 4.0 | O=C1NCN(c2ccc(F)cc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccc(Cl)cc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 44404711 | 133081 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 404 | 3 | 0 | 4 | 3.1 | COC(=O)CN1C(=O)C2(CCN(C3CCc4ccccc4C3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL370226 | 133081 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 404 | 3 | 0 | 4 | 3.1 | COC(=O)CN1C(=O)C2(CCN(C3CCc4ccccc4C3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44143418 | 187345 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 401 | 5 | 1 | 5 | 5.0 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1ccc(Cl)nc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL492585 | 187345 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 401 | 5 | 1 | 5 | 5.0 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1ccc(Cl)nc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 45271041 | 198840 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 331 | 5 | 1 | 3 | 5.1 | Cc1nc(CNC2CCCC2)n(C(C)C)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL562663 | 198840 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 331 | 5 | 1 | 3 | 5.1 | Cc1nc(CNC2CCCC2)n(C(C)C)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL404792 | 214993 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCN=C(N)N)NC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O | 10.1016/j.bmcl.2006.06.060 | |||||
| 52915518 | 60597 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 511 | 13 | 4 | 6 | 5.6 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1760025 | 60597 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 511 | 13 | 4 | 6 | 5.6 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915270 | 60955 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 468 | 10 | 3 | 5 | 5.8 | CCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762398 | 60955 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 468 | 10 | 3 | 5 | 5.8 | CCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 15982938 | 133587 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 454 | 4 | 0 | 4 | 5.5 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL370782 | 133587 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 454 | 4 | 0 | 4 | 5.5 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 52916471 | 60935 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 930 | 21 | 4 | 10 | 12.1 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762378 | 60935 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 930 | 21 | 4 | 10 | 12.1 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52916266 | 60969 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 412 | 6 | 3 | 5 | 4.4 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762412 | 60969 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 412 | 6 | 3 | 5 | 4.4 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 11633324 | 72703 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 392 | 7 | 2 | 3 | 3.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H](O)Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL199639 | 72703 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 392 | 7 | 2 | 3 | 3.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H](O)Cc1ccccc1 | 10.1021/jm0509851 | |||
| 11619363 | 74464 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 452 | 7 | 1 | 3 | 5.0 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1C(=O)c1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202715 | 74464 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 452 | 7 | 1 | 3 | 5.0 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1C(=O)c1ccccc1 | 10.1021/jm0509851 | |||
| 45273547 | 198252 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 365 | 6 | 1 | 4 | 3.7 | CC(=O)Cn1nc(CN[C@H]2CC[C@@H](F)C2)c(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL557925 | 198252 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 365 | 6 | 1 | 4 | 3.7 | CC(=O)Cn1nc(CN[C@H]2CC[C@@H](F)C2)c(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 15982661 | 133510 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 512 | 9 | 2 | 6 | 3.0 | O=C1N(CC(O)CNCCN2CCOCC2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL370613 | 133510 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 512 | 9 | 2 | 6 | 3.0 | O=C1N(CC(O)CNCCN2CCOCC2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| 44404670 | 135276 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 416 | 4 | 0 | 2 | 5.9 | O=C1N(Cc2ccccc2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL372184 | 135276 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 416 | 4 | 0 | 2 | 5.9 | O=C1N(Cc2ccccc2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| 22273116 | 96732 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 354 | 5 | 2 | 5 | 2.8 | CC(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263904 | 96732 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 354 | 5 | 2 | 5 | 2.8 | CC(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 136043786 | 77401 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 421 | 5 | 1 | 5 | 4.4 | CN1CCN(c2cccc3[nH]c(-c4nc(CCc5ccc(Cl)cc5)no4)cc23)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL208602 | 77401 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 421 | 5 | 1 | 5 | 4.4 | CN1CCN(c2cccc3[nH]c(-c4nc(CCc5ccc(Cl)cc5)no4)cc23)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| 52915390 | 60957 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 496 | 12 | 3 | 5 | 6.6 | CCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762400 | 60957 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 496 | 12 | 3 | 5 | 6.6 | CCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL405948 | 215047 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 44143422 | 187631 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1cncc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)c1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494406 | 187631 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1cncc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)c1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL526142 | 218163 | None | 0 | Rat | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 45273662 | 198306 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 419 | 5 | 1 | 3 | 6.5 | Clc1ccc(-c2cc(CNC3CCCC3)nn2-c2ccc(Cl)cc2Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL558524 | 198306 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 419 | 5 | 1 | 3 | 6.5 | Clc1ccc(-c2cc(CNC3CCCC3)nn2-c2ccc(Cl)cc2Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44406621 | 72917 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 405 | 3 | 2 | 4 | 3.2 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@@]1(O)c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL200371 | 72917 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 405 | 3 | 2 | 4 | 3.2 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@@]1(O)c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 44407084 | 140447 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 477 | 7 | 1 | 5 | 3.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1COCN1C(=O)OCc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL380786 | 140447 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 477 | 7 | 1 | 5 | 3.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1COCN1C(=O)OCc1ccccc1 | 10.1021/jm0509851 | |||
| 44404653 | 141395 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 446 | 5 | 0 | 3 | 5.9 | COc1ccc(CN2C(=O)C3(CCN(CC4CCCCCCC4)CC3)c3ccccc32)cc1 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL383371 | 141395 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 446 | 5 | 0 | 3 | 5.9 | COc1ccc(CN2C(=O)C3(CCN(CC4CCCCCCC4)CC3)c3ccccc32)cc1 | 10.1016/j.bmcl.2005.08.009 | |||
| 44406557 | 73000 | None | 0 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 406 | 3 | 2 | 5 | 2.6 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1cccnc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL200695 | 73000 | None | 0 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 0 | ChEMBL | 406 | 3 | 2 | 5 | 2.6 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1cccnc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 118726267 | 117299 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 594 | 11 | 2 | 6 | 5.6 | Cc1ccccc1CNC[C@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394749 | 117299 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 594 | 11 | 2 | 6 | 5.6 | Cc1ccccc1CNC[C@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| 44456187 | 95694 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 985 | 31 | 15 | 11 | -0.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL257921 | 95694 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 985 | 31 | 15 | 11 | -0.4 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 44456412 | 97537 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 965 | 30 | 15 | 11 | -0.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL270231 | 97537 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 965 | 30 | 15 | 11 | -0.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 15982658 | 96752 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 432 | 4 | 0 | 4 | 3.8 | COC(=O)CN1C(=O)C2(CCN(Cc3cccc(C(F)(F)F)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL264066 | 96752 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 432 | 4 | 0 | 4 | 3.8 | COC(=O)CN1C(=O)C2(CCN(Cc3cccc(C(F)(F)F)c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44449771 | 155740 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 342 | 4 | 2 | 4 | 3.4 | Fc1cc2nc(SCc3ccccc3)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL404771 | 155740 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 342 | 4 | 2 | 4 | 3.4 | Fc1cc2nc(SCc3ccccc3)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 136043771 | 78220 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 366 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3nc(CCC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL210504 | 78220 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 366 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3nc(CCC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 52915147 | 60950 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 508 | 12 | 2 | 5 | 7.3 | CCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762393 | 60950 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 508 | 12 | 2 | 5 | 7.3 | CCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915635 | 60966 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 539 | 15 | 4 | 6 | 6.3 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762409 | 60966 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 539 | 15 | 4 | 6 | 6.3 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915266 | 60951 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 522 | 13 | 2 | 5 | 7.7 | CCCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762394 | 60951 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 522 | 13 | 2 | 5 | 7.7 | CCCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44450151 | 95845 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 329 | 5 | 2 | 5 | 3.1 | CCC(CC)Sc1nc2cc(C#N)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL258711 | 95845 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 329 | 5 | 2 | 5 | 3.1 | CCC(CC)Sc1nc2cc(C#N)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 45270917 | 197290 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 341 | 4 | 1 | 3 | 3.8 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)c(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL549439 | 197290 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 341 | 4 | 1 | 3 | 3.8 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)c(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 45270928 | 198044 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 353 | 6 | 2 | 4 | 3.1 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCO)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL555354 | 198044 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 353 | 6 | 2 | 4 | 3.1 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCO)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 24847114 | 155476 | None | 1 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1(c3ccccc3)CCCCC1)CC2 | 10.1016/j.bmcl.2006.05.063 | |||
| CHEMBL403515 | 155476 | None | 1 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1(c3ccccc3)CCCCC1)CC2 | 10.1016/j.bmcl.2006.05.063 | |||
| 44404695 | 72523 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.7 | Cc1ccc2c(c1)N(C)C(=O)C21CCN(CC2CCCCCCC2)CC1 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL199011 | 72523 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.7 | Cc1ccc2c(c1)N(C)C(=O)C21CCN(CC2CCCCCCC2)CC1 | 10.1016/j.bmcl.2005.08.009 | |||
| 44143408 | 178643 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 435 | 7 | 1 | 3 | 6.9 | Cc1c(CNCCC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL466843 | 178643 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 435 | 7 | 1 | 3 | 6.9 | Cc1c(CNCCC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44143407 | 193327 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 421 | 6 | 1 | 3 | 6.6 | Cc1c(CNCC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL523530 | 193327 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 421 | 6 | 1 | 3 | 6.6 | Cc1c(CNCC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44406538 | 72865 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 405 | 3 | 2 | 4 | 3.2 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL200204 | 72865 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 405 | 3 | 2 | 4 | 3.2 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 44406551 | 133898 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 406 | 3 | 2 | 5 | 2.6 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccccn1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL371550 | 133898 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 406 | 3 | 2 | 5 | 2.6 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1ccccn1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 18441735 | 79542 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 405 | 3 | 2 | 4 | 3.2 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCC1(O)c1ccccc1)CC2 | 10.1016/j.bmcl.2006.05.058 | |||
| CHEMBL211373 | 79542 | None | 0 | Human | Binding | pIC50 | = | 4.8 | 4.8 | - | 0 | ChEMBL | 405 | 3 | 2 | 4 | 3.2 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCC1(O)c1ccccc1)CC2 | 10.1016/j.bmcl.2006.05.058 | |||
| 52915637 | 60968 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 567 | 17 | 4 | 6 | 7.1 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762411 | 60968 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 567 | 17 | 4 | 6 | 7.1 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915267 | 60952 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 536 | 14 | 2 | 5 | 8.1 | CCCCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762395 | 60952 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 536 | 14 | 2 | 5 | 8.1 | CCCCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915515 | 60962 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 469 | 10 | 4 | 6 | 4.4 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762405 | 60962 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 469 | 10 | 4 | 6 | 4.4 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44574053 | 178727 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 451 | 5 | 2 | 6 | 4.1 | CCN1CCN(c2cc3[nH]c(SC4(C)CCC(NC(=O)OC)C4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467473 | 178727 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 451 | 5 | 2 | 6 | 4.1 | CCN1CCN(c2cc3[nH]c(SC4(C)CCC(NC(=O)OC)C4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44456299 | 97532 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 979 | 31 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL270216 | 97532 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 979 | 31 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 118726265 | 117297 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 586 | 11 | 2 | 7 | 5.3 | O=C1N(C[C@@H](O)CNCc2cccs2)CN(c2ccccc2)C12CCN(CCc1ccccc1-c1cccs1)CC2 | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394747 | 117297 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 586 | 11 | 2 | 7 | 5.3 | O=C1N(C[C@@H](O)CNCc2cccs2)CN(c2ccccc2)C12CCN(CCc1ccccc1-c1cccs1)CC2 | 10.1016/j.bmcl.2014.12.015 | |||
| 45271902 | 197982 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 465 | 7 | 1 | 3 | 7.2 | FCCn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL554058 | 197982 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 465 | 7 | 1 | 3 | 7.2 | FCCn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 45269372 | 199117 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 489 | 8 | 1 | 3 | 8.6 | CCC(CC)n1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL564484 | 199117 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 489 | 8 | 1 | 3 | 8.6 | CCC(CC)n1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 45268503 | 199158 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 447 | 6 | 1 | 3 | 7.2 | CCn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL564837 | 199158 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 447 | 6 | 1 | 3 | 7.2 | CCn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 118726264 | 117296 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 636 | 14 | 1 | 6 | 6.8 | CCCCN(Cc1ccccc1)C[C@@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394746 | 117296 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 636 | 14 | 1 | 6 | 6.8 | CCCCN(Cc1ccccc1)C[C@@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| 22272877 | 95949 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL259185 | 95949 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 22272900 | 96727 | None | 1 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 348 | 4 | 2 | 4 | 3.8 | Fc1cc2nc(SCC3CCCCC3)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263889 | 96727 | None | 1 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 348 | 4 | 2 | 4 | 3.8 | Fc1cc2nc(SCC3CCCCC3)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 45268356 | 198994 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 339 | 4 | 1 | 3 | 4.2 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(Cl)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL563686 | 198994 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 339 | 4 | 1 | 3 | 4.2 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(Cl)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 22272877 | 95949 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL259185 | 95949 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 368 | 4 | 2 | 5 | 3.2 | CC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 44407070 | 73955 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 394 | 7 | 1 | 3 | 4.3 | O=C(CSc1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL202059 | 73955 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 394 | 7 | 1 | 3 | 4.3 | O=C(CSc1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 118726273 | 117306 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 649 | 11 | 2 | 6 | 5.3 | Cc1ccc(CN(C[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)C(=O)[C@H](N)C(C)C)cc1 | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394756 | 117306 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 649 | 11 | 2 | 6 | 5.3 | Cc1ccc(CN(C[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)C(=O)[C@H](N)C(C)C)cc1 | 10.1016/j.bmcl.2014.12.015 | |||
| 44576627 | 193351 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 394 | 7 | 2 | 5 | 3.8 | CCC(CC)Sc1nc2cc(Cl)c(N3C[C@@H]4C[C@H]3CN4CCO)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL523724 | 193351 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 394 | 7 | 2 | 5 | 3.8 | CCC(CC)Sc1nc2cc(Cl)c(N3C[C@@H]4C[C@H]3CN4CCO)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 44404731 | 136124 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 412 | 5 | 0 | 4 | 4.3 | CC(=O)OCCN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL373190 | 136124 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 412 | 5 | 0 | 4 | 4.3 | CC(=O)OCCN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44449767 | 96075 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1cccc(CSc2nc3cc(F)c(N4CCNCC4)cc3[nH]2)c1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL259764 | 96075 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1cccc(CSc2nc3cc(F)c(N4CCNCC4)cc3[nH]2)c1 | 10.1016/j.bmcl.2008.04.054 | |||
| 52915268 | 60953 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 550 | 15 | 2 | 5 | 8.5 | CCCCCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762396 | 60953 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 550 | 15 | 2 | 5 | 8.5 | CCCCCCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915145 | 60948 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 480 | 10 | 2 | 5 | 6.6 | CCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762391 | 60948 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 480 | 10 | 2 | 5 | 6.6 | CCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 10004950 | 10051 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 470 | 5 | 1 | 6 | 2.5 | CNC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3cc4c(cc3Cl)OCO4)CC2)C1=O | 10.1021/jm010878g | |||
| CHEMBL115222 | 10051 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 470 | 5 | 1 | 6 | 2.5 | CNC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3cc4c(cc3Cl)OCO4)CC2)C1=O | 10.1021/jm010878g | |||
| 45271885 | 199080 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 459 | 6 | 1 | 3 | 7.5 | Clc1ccc(-c2c(-c3ccc(Cl)cc3Cl)nc(CNC3CCCC3)n2C2CC2)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL564225 | 199080 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 459 | 6 | 1 | 3 | 7.5 | Clc1ccc(-c2c(-c3ccc(Cl)cc3Cl)nc(CNC3CCCC3)n2C2CC2)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44342270 | 9932 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 355 | 3 | 1 | 4 | 4.5 | Cc1ccc(CN2CCC(n3c(O)nc4ccccc43)CC2)c(Cl)c1 | 10.1021/jm010878g | |||
| CHEMBL114484 | 9932 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 355 | 3 | 1 | 4 | 4.5 | Cc1ccc(CN2CCC(n3c(O)nc4ccccc43)CC2)c(Cl)c1 | 10.1021/jm010878g | |||
| 44143435 | 178547 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 441 | 5 | 2 | 6 | 3.5 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2C)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466112 | 178547 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 441 | 5 | 2 | 6 | 3.5 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2C)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 45270907 | 198215 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 334 | 5 | 1 | 4 | 3.7 | CCn1nc(CN[C@H]2CC[C@@H](F)C2)c(C)c1-c1cnc(C)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL557623 | 198215 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 334 | 5 | 1 | 4 | 3.7 | CCn1nc(CN[C@H]2CC[C@@H](F)C2)c(C)c1-c1cnc(C)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 22273044 | 95844 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 338 | 5 | 2 | 4 | 3.9 | CCC(CC)Sc1nc2cc(Cl)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL258710 | 95844 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 338 | 5 | 2 | 4 | 3.9 | CCC(CC)Sc1nc2cc(Cl)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44143449 | 178696 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 485 | 6 | 2 | 6 | 3.7 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NS(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467266 | 178696 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 485 | 6 | 2 | 6 | 3.7 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NS(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL510117 | 218071 | None | 0 | Rat | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| CHEMBL510117 | 218071 | None | 0 | Rat | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.06.015 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm701575k | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm701575k | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm701575k | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm701575k | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm701575k | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pIC50 | = | 8.7 | 8.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm701575k | |||||
| 24882570 | 115195 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343946 | 115195 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343947 | 115195 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| 44143453 | 178586 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnn(C)n5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466448 | 178586 | None | 0 | Human | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnn(C)n5)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL455289 | 216472 | None | 0 | Rat | Binding | pIC50 | = | 8.7 | 8.7 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2008.09.014 | |||||
| 1691 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm990517p | |||
| 5311194 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm990517p | |||
| CHEMBL357076 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm990517p | |||
| 1691 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm900581g | |||
| 5311194 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm900581g | |||
| CHEMBL357076 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm900581g | |||
| 44189834 | 14027 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.8 | O=c1n(C(CO)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL1197240 | 14027 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.8 | O=c1n(C(CO)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL563657 | 14027 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.8 | O=c1n(C(CO)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| 44189733 | 14035 | None | 2 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL1197275 | 14035 | None | 2 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| CHEMBL564840 | 14035 | None | 2 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 425 | 6 | 2 | 6 | 2.6 | O=c1n(C[C@@H](O)CO)c2ccccc2n1C1CCN(C[C@H]2[C@H]3CC[C@H](C3)C23CC3)CC1 | 10.1021/jm900581g | |||
| 1691 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm0509851 | |||
| 5311194 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm0509851 | |||
| CHEMBL357076 | 2107 | None | 23 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | OC[C@@H]1CN(CC[C@H]1n1c(=O)n(c2c1cccc2)CC)CC1CCCCCCC1 | 10.1021/jm0509851 | |||
| 44143432 | 178815 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL468302 | 178815 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 44143432 | 178815 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468302 | 178815 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44143428 | 178818 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL468308 | 178818 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 24857819 | 187623 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| 24857819 | 187623 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL494350 | 187623 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL494350 | 187623 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 382 | 4 | 2 | 5 | 3.6 | C[C@@H]1CN(CCO)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| 44456140 | 168817 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 951 | 31 | 15 | 11 | -1.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL436852 | 168817 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 951 | 31 | 15 | 11 | -1.1 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 44450086 | 158387 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 394 | 5 | 2 | 5 | 3.8 | OCCN1CCN(c2cc3[nH]c(SC4CCCCC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL408901 | 158387 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 394 | 5 | 2 | 5 | 3.8 | OCCN1CCN(c2cc3[nH]c(SC4CCCCC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 416359 | 101915 | None | 16 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 307 | 3 | 1 | 4 | 3.6 | Oc1nc2ccccc2n1C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2003.09.068 | |||
| CHEMBL300616 | 101915 | None | 16 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 307 | 3 | 1 | 4 | 3.6 | Oc1nc2ccccc2n1C1CCN(Cc2ccccc2)CC1 | 10.1016/j.bmcl.2003.09.068 | |||
| 416359 | 101915 | None | 16 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 307 | 3 | 1 | 4 | 3.6 | Oc1nc2ccccc2n1C1CCN(Cc2ccccc2)CC1 | 10.1021/jm990517p | |||
| CHEMBL300616 | 101915 | None | 16 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 307 | 3 | 1 | 4 | 3.6 | Oc1nc2ccccc2n1C1CCN(Cc2ccccc2)CC1 | 10.1021/jm990517p | |||
| 45267616 | 198743 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 432 | 5 | 1 | 2 | 7.4 | Cc1c(CNC2CCCC2)cc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL562077 | 198743 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 432 | 5 | 1 | 2 | 7.4 | Cc1c(CNC2CCCC2)cc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 52915517 | 60964 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 497 | 12 | 4 | 6 | 5.2 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762407 | 60964 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 497 | 12 | 4 | 6 | 5.2 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52916174 | 60970 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 411 | 6 | 2 | 5 | 4.8 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(C=O)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762413 | 60970 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 411 | 6 | 2 | 5 | 4.8 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(C=O)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915146 | 60949 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 494 | 11 | 2 | 5 | 7.0 | CCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762392 | 60949 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 494 | 11 | 2 | 5 | 7.0 | CCCCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44407116 | 74228 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 438 | 7 | 1 | 2 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202322 | 74228 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 438 | 7 | 1 | 2 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Cc1ccccc1 | 10.1021/jm0509851 | |||
| 44143445 | 178560 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 439 | 7 | 2 | 6 | 4.0 | CCN1CCN(c2cc3[nH]c(SC(C)(C)CCNC(=O)OC)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466221 | 178560 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 439 | 7 | 2 | 6 | 4.0 | CCN1CCN(c2cc3[nH]c(SC(C)(C)CCNC(=O)OC)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44455999 | 97564 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 965 | 32 | 15 | 11 | -0.7 | CCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL270394 | 97564 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 965 | 32 | 15 | 11 | -0.7 | CCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 44456339 | 168996 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 979 | 34 | 15 | 11 | -0.1 | CCCCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL438383 | 168996 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 979 | 34 | 15 | 11 | -0.1 | CCCCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 45269228 | 198387 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 373 | 4 | 1 | 3 | 4.5 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL559402 | 198387 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 373 | 4 | 1 | 3 | 4.5 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(C(F)(F)F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 136043790 | 78090 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 408 | 8 | 1 | 4 | 5.2 | CN(C)CCCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL210000 | 78090 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 408 | 8 | 1 | 4 | 5.2 | CN(C)CCCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 52915636 | 60967 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 553 | 16 | 4 | 6 | 6.7 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762410 | 60967 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 553 | 16 | 4 | 6 | 6.7 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL444110 | 216389 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||||
| 44143444 | 178532 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 352 | 3 | 1 | 4 | 4.2 | CCN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466020 | 178532 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 352 | 3 | 1 | 4 | 4.2 | CCN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 579 | 3144 | None | 18 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.07.036 | |||||
| 6918468 | 3144 | None | 18 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.07.036 | |||||
| CHEMBL41547 | 3144 | None | 18 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2006.07.036 | |||||
| 11710187 | 72104 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 358 | 2 | 0 | 2 | 4.5 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2cc(F)ccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL197727 | 72104 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 358 | 2 | 0 | 2 | 4.5 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2cc(F)ccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44450209 | 96270 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 376 | 4 | 2 | 4 | 4.1 | Fc1cc2nc(SCc3ccccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL260821 | 96270 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 376 | 4 | 2 | 4 | 4.1 | Fc1cc2nc(SCc3ccccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44143439 | 172853 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 402 | 4 | 1 | 4 | 4.9 | C[C@@H]1CN(CC(F)F)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL450887 | 172853 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 402 | 4 | 1 | 4 | 4.9 | C[C@@H]1CN(CC(F)F)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| 44407085 | 74071 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 439 | 7 | 2 | 3 | 5.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Nc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202220 | 74071 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 439 | 7 | 2 | 3 | 5.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Nc1ccccc1 | 10.1021/jm0509851 | |||
| 136043796 | 79051 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 374 | 7 | 1 | 4 | 4.4 | Cc1ccc(CCc2noc(-c3cc4c(CCN(C)C)cccc4[nH]3)n2)cc1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211310 | 79051 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 374 | 7 | 1 | 4 | 4.4 | Cc1ccc(CCc2noc(-c3cc4c(CCN(C)C)cccc4[nH]3)n2)cc1 | 10.1016/j.bmcl.2006.03.086 | |||
| 44407133 | 74427 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 447 | 7 | 1 | 4 | 3.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1COC(=O)N1Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202492 | 74427 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 447 | 7 | 1 | 4 | 3.5 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1COC(=O)N1Cc1ccccc1 | 10.1021/jm0509851 | |||
| 44450180 | 156855 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 442 | 4 | 2 | 5 | 3.4 | O=S(=O)(Cc1cccc(Cl)c1Cl)c1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL407068 | 156855 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 442 | 4 | 2 | 5 | 3.4 | O=S(=O)(Cc1cccc(Cl)c1Cl)c1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44404684 | 140716 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 370 | 3 | 0 | 3 | 4.4 | COc1ccc2c(c1)N(C)C(=O)C21CCN(CC2CCCCCCC2)CC1 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL381429 | 140716 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 370 | 3 | 0 | 3 | 4.4 | COc1ccc2c(c1)N(C)C(=O)C21CCN(CC2CCCCCCC2)CC1 | 10.1016/j.bmcl.2005.08.009 | |||
| 11811722 | 10067 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 413 | 5 | 1 | 4 | 4.4 | O=C1NCN(c2ccccc2)C12CCN(Cc1cccc(Oc3ccccc3)c1)CC2 | 10.1021/jm010878g | |||
| CHEMBL115280 | 10067 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 413 | 5 | 1 | 4 | 4.4 | O=C1NCN(c2ccccc2)C12CCN(Cc1cccc(Oc3ccccc3)c1)CC2 | 10.1021/jm010878g | |||
| 52915634 | 60965 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 525 | 14 | 4 | 6 | 6.0 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762408 | 60965 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 525 | 14 | 4 | 6 | 6.0 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 11411841 | 60928 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 835 | 16 | 0 | 6 | 10.4 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)N(CCCCCCCCCN2CN(c4ccccc4)C4(CCN([C@H]5CC[C@@H](C(C)C)CC5)CC4)C2=O)CN3c2ccccc2)CC1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762371 | 60928 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 835 | 16 | 0 | 6 | 10.4 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)N(CCCCCCCCCN2CN(c4ccccc4)C4(CCN([C@H]5CC[C@@H](C(C)C)CC5)CC4)C2=O)CN3c2ccccc2)CC1 | 10.1016/j.ejmech.2011.01.040 | |||
| 15982935 | 170377 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 414 | 4 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc4ccccc4c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL444620 | 170377 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 414 | 4 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc4ccccc4c3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 118726268 | 117300 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 594 | 11 | 2 | 6 | 5.6 | Cc1ccccc1CNC[C@@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394750 | 117300 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 594 | 11 | 2 | 6 | 5.6 | Cc1ccccc1CNC[C@@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| 45271015 | 197994 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CNC3CCCC3)c2C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL554299 | 197994 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CNC3CCCC3)c2C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44404689 | 168421 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 356 | 2 | 1 | 3 | 4.1 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccc(O)cc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL434179 | 168421 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 356 | 2 | 1 | 3 | 4.1 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccc(O)cc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 9823363 | 189362 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 418 | 4 | 2 | 5 | 3.9 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL511742 | 189362 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 418 | 4 | 2 | 5 | 3.9 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@](C)(O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 44143442 | 178607 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 391 | 4 | 1 | 5 | 4.5 | C[C@@H]1CN(CCC#N)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466630 | 178607 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 391 | 4 | 1 | 5 | 4.5 | C[C@@H]1CN(CCC#N)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| 44143421 | 187606 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 435 | 5 | 1 | 5 | 5.3 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1ccc(C(F)(F)F)nc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494231 | 187606 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 435 | 5 | 1 | 5 | 5.3 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1ccc(C(F)(F)F)nc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL268145 | 213199 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 15983067 | 72555 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 384 | 4 | 0 | 3 | 4.8 | CCN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccc(OC)cc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL199095 | 72555 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 384 | 4 | 0 | 3 | 4.8 | CCN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccc(OC)cc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44143413 | 189480 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.8 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL512827 | 189480 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.8 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44143413 | 189480 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.8 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL512827 | 189480 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.8 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 45267601 | 198554 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.8 | Cc1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL560875 | 198554 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.8 | Cc1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 52915031 | 60944 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 949 | 24 | 6 | 10 | 11.8 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762387 | 60944 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 949 | 24 | 6 | 10 | 11.8 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 10949380 | 164118 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 399 | 3 | 1 | 6 | 4.3 | Cc1ccc2nc(O)n(C3CCN(Cc4cc5c(cc4Cl)OCO5)CC3)c2c1 | 10.1021/jm010878g | |||
| CHEMBL420863 | 164118 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 399 | 3 | 1 | 6 | 4.3 | Cc1ccc2nc(O)n(C3CCN(Cc4cc5c(cc4Cl)OCO5)CC3)c2c1 | 10.1021/jm010878g | |||
| 44404646 | 140383 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 370 | 4 | 1 | 3 | 3.7 | O=C1N(CCO)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL380603 | 140383 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 370 | 4 | 1 | 3 | 3.7 | O=C1N(CCO)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| 44407086 | 73697 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 451 | 7 | 1 | 5 | 4.9 | O=C(CSc1nc2ccccc2s1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL201826 | 73697 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 451 | 7 | 1 | 5 | 4.9 | O=C(CSc1nc2ccccc2s1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 44449793 | 157751 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | CSc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL408148 | 157751 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | CSc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44450207 | 159547 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 426 | 4 | 2 | 4 | 3.7 | [O-][S+](Cc1cccc(Cl)c1Cl)c1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL410124 | 159547 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 426 | 4 | 2 | 4 | 3.7 | [O-][S+](Cc1cccc(Cl)c1Cl)c1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL442113 | 216368 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| CHEMBL435511 | 216128 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CSSC[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm010092i | |||||
| 45273537 | 198884 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL562932 | 198884 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 45268498 | 199157 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 413 | 6 | 1 | 5 | 4.8 | CCc1c(CN[C@H]2CC[C@@H](F)C2)nc(-c2ncccc2Cl)n1-c1ccc(C)nc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL564812 | 199157 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 413 | 6 | 1 | 5 | 4.8 | CCc1c(CN[C@H]2CC[C@@H](F)C2)nc(-c2ncccc2Cl)n1-c1ccc(C)nc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44456141 | 95407 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 1043 | 31 | 15 | 11 | 0.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL256687 | 95407 | None | 0 | Human | Binding | pIC50 | = | 8.5 | 8.5 | - | 0 | ChEMBL | 1043 | 31 | 15 | 11 | 0.5 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 118726269 | 117301 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 654 | 14 | 2 | 8 | 5.3 | COc1ccc(CCNC[C@@H](O)CN2CN(c3ccccc3)C3(CCN(CCc4ccccc4-c4cccs4)CC3)C2=O)cc1OC | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394751 | 117301 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 654 | 14 | 2 | 8 | 5.3 | COc1ccc(CCNC[C@@H](O)CN2CN(c3ccccc3)C3(CCN(CCc4ccccc4-c4cccs4)CC3)C2=O)cc1OC | 10.1016/j.bmcl.2014.12.015 | |||
| 44407044 | 140664 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 447 | 7 | 2 | 4 | 3.2 | O=C1N[C@@H](Cc2ccccc2)[C@@H](C(=O)NCCCN2CCC3(CCc4ccccc43)CC2)O1 | 10.1021/jm0509851 | |||
| CHEMBL381287 | 140664 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 447 | 7 | 2 | 4 | 3.2 | O=C1N[C@@H](Cc2ccccc2)[C@@H](C(=O)NCCCN2CCC3(CCc4ccccc43)CC2)O1 | 10.1021/jm0509851 | |||
| 1692 | 2154 | None | 25 | Human | Binding | pIC50 | = | 7.5 | 7.5 | 28 | 15 | ChEMBL | 411 | 6 | 2 | 4 | 5.5 | CCc1ccc(cc1)OCc1ccccc1C(=O)Nc1ccc2c(c1)c(N)cc(n2)C | 10.1016/j.ejmech.2011.01.040 | |||
| 5311340 | 2154 | None | 25 | Human | Binding | pIC50 | = | 7.5 | 7.5 | 28 | 15 | ChEMBL | 411 | 6 | 2 | 4 | 5.5 | CCc1ccc(cc1)OCc1ccccc1C(=O)Nc1ccc2c(c1)c(N)cc(n2)C | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL140979 | 2154 | None | 25 | Human | Binding | pIC50 | = | 7.5 | 7.5 | 28 | 15 | ChEMBL | 411 | 6 | 2 | 4 | 5.5 | CCc1ccc(cc1)OCc1ccccc1C(=O)Nc1ccc2c(c1)c(N)cc(n2)C | 10.1016/j.ejmech.2011.01.040 | |||
| 52916714 | 60942 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 920 | 22 | 6 | 10 | 11.1 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762385 | 60942 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 920 | 22 | 6 | 10 | 11.1 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44406618 | 133668 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| CHEMBL371267 | 133668 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| 52915393 | 60960 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 538 | 15 | 3 | 5 | 7.8 | CCCCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762403 | 60960 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 538 | 15 | 3 | 5 | 7.8 | CCCCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915144 | 60947 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 466 | 9 | 2 | 5 | 6.2 | CCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762390 | 60947 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 466 | 9 | 2 | 5 | 6.2 | CCCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44449764 | 157344 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1ccc(CSc2nc3cc(F)c(N4CCNCC4)cc3[nH]2)cc1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL407653 | 157344 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1ccc(CSc2nc3cc(F)c(N4CCNCC4)cc3[nH]2)cc1 | 10.1016/j.bmcl.2008.04.054 | |||
| 52915030 | 60943 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 934 | 23 | 6 | 10 | 11.4 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762386 | 60943 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 934 | 23 | 6 | 10 | 11.4 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44406618 | 133668 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL371267 | 133668 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 22273255 | 157615 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 346 | 6 | 2 | 5 | 3.5 | CCC(CC)Sc1nc2cc(C(C)=O)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL407991 | 157615 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 346 | 6 | 2 | 5 | 3.5 | CCC(CC)Sc1nc2cc(C(C)=O)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 11544654 | 70293 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 340 | 2 | 0 | 2 | 4.4 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL194200 | 70293 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 340 | 2 | 0 | 2 | 4.4 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 52915032 | 60945 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 963 | 25 | 6 | 10 | 12.2 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762388 | 60945 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 963 | 25 | 6 | 10 | 12.2 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 15982791 | 72398 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 531 | 9 | 1 | 4 | 5.9 | CCN(Cc1ccc(C)cc1)CC(O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198604 | 72398 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 531 | 9 | 1 | 4 | 5.9 | CCN(Cc1ccc(C)cc1)CC(O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 17858339 | 96726 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 304 | 5 | 2 | 4 | 3.3 | CCC(CC)Sc1nc2ccc(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263888 | 96726 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 304 | 5 | 2 | 4 | 3.3 | CCC(CC)Sc1nc2ccc(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 45267506 | 198518 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 415 | 7 | 1 | 5 | 3.2 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCS(C)(=O)=O)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL560469 | 198518 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 415 | 7 | 1 | 5 | 3.2 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCS(C)(=O)=O)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 44143423 | 187635 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 361 | 5 | 1 | 5 | 4.3 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2C)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494413 | 187635 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 361 | 5 | 1 | 5 | 4.3 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2C)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 45268504 | 198567 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 461 | 6 | 1 | 3 | 7.8 | CC(C)n1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL560937 | 198567 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 461 | 6 | 1 | 3 | 7.8 | CC(C)n1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44407140 | 74441 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 415 | 6 | 2 | 3 | 3.8 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)C(=O)c1c[nH]c2ccccc12 | 10.1021/jm0509851 | |||
| CHEMBL202604 | 74441 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 415 | 6 | 2 | 3 | 3.8 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)C(=O)c1c[nH]c2ccccc12 | 10.1021/jm0509851 | |||
| 23542099 | 117292 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 592 | 12 | 1 | 5 | 6.3 | CCCCN(Cc1ccccc1)C[C@H](O)CN1CN(c2ccc(F)cc2)C2(CCN(CC3CCCCCCC3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394742 | 117292 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 592 | 12 | 1 | 5 | 6.3 | CCCCN(Cc1ccccc1)C[C@H](O)CN1CN(c2ccc(F)cc2)C2(CCN(CC3CCCCCCC3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| 44407112 | 73964 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 454 | 8 | 1 | 3 | 5.5 | O=C(Cc1cccc(Oc2ccccc2)c1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL202091 | 73964 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 454 | 8 | 1 | 3 | 5.5 | O=C(Cc1cccc(Oc2ccccc2)c1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 10948527 | 111418 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 365 | 3 | 1 | 5 | 2.3 | O=C1NCN(c2ccccc2)C12CCN(Cc1ccc3c(c1)OCO3)CC2 | 10.1021/jm010878g | |||
| CHEMBL326962 | 111418 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 365 | 3 | 1 | 5 | 2.3 | O=C1NCN(c2ccccc2)C12CCN(Cc1ccc3c(c1)OCO3)CC2 | 10.1021/jm010878g | |||
| 52916358 | 60931 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 874 | 17 | 4 | 10 | 10.5 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762374 | 60931 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 874 | 17 | 4 | 10 | 10.5 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44404721 | 72217 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 426 | 3 | 0 | 4 | 4.0 | COC(=O)CN1C(=O)C2(CCN(c3ccc4c5c(cccc35)CC4)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198046 | 72217 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 426 | 3 | 0 | 4 | 4.0 | COC(=O)CN1C(=O)C2(CCN(c3ccc4c5c(cccc35)CC4)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 11523972 | 166259 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 390 | 8 | 1 | 2 | 4.5 | O=C(CCCc1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL426303 | 166259 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 390 | 8 | 1 | 2 | 4.5 | O=C(CCCc1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 44143406 | 187605 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 407 | 5 | 1 | 3 | 6.3 | Cc1c(CNC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494230 | 187605 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 407 | 5 | 1 | 3 | 6.3 | Cc1c(CNC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44143424 | 192835 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 415 | 5 | 1 | 5 | 5.0 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2C(F)(F)F)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL522021 | 192835 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 415 | 5 | 1 | 5 | 5.0 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2C(F)(F)F)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44407048 | 73965 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 415 | 7 | 2 | 2 | 4.6 | O=C(CCc1c[nH]c2ccccc12)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL202094 | 73965 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 415 | 7 | 2 | 2 | 4.6 | O=C(CCc1c[nH]c2ccccc12)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 15983063 | 141428 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 328 | 4 | 0 | 4 | 2.0 | COC(=O)CN1C(=O)C2(CCN(CC3CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL383561 | 141428 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 328 | 4 | 0 | 4 | 2.0 | COC(=O)CN1C(=O)C2(CCN(CC3CC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44404699 | 168893 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.7 | Cc1cccc2c1C1(CCN(CC3CCCCCCC3)CC1)C(=O)N2C | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL437505 | 168893 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.7 | Cc1cccc2c1C1(CCN(CC3CCCCCCC3)CC1)C(=O)N2C | 10.1016/j.bmcl.2005.08.009 | |||
| 118726272 | 117304 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 553 | 8 | 1 | 5 | 6.1 | Cc1cccc(SC[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)c1 | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394754 | 117304 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 553 | 8 | 1 | 5 | 6.1 | Cc1cccc(SC[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)c1 | 10.1016/j.bmcl.2014.12.015 | |||
| 44143415 | 178891 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 400 | 5 | 1 | 4 | 5.6 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1cccnc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL468937 | 178891 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 400 | 5 | 1 | 4 | 5.6 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1cccnc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL384866 | 214799 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(N)=O | 10.1021/jm010092i | |||||
| 11406629 | 141425 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| CHEMBL383539 | 141425 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| 44574003 | 178608 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 394 | 4 | 1 | 5 | 4.2 | CC(=O)CN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)C(C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466631 | 178608 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 394 | 4 | 1 | 5 | 4.2 | CC(=O)CN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)C(C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| 10937901 | 9912 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 385 | 3 | 1 | 6 | 4.0 | Oc1nc2ccccc2n1C1CCN(Cc2cc3c(cc2Cl)OCO3)CC1 | 10.1021/jm010878g | |||
| CHEMBL114379 | 9912 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 385 | 3 | 1 | 6 | 4.0 | Oc1nc2ccccc2n1C1CCN(Cc2cc3c(cc2Cl)OCO3)CC1 | 10.1021/jm010878g | |||
| 44404652 | 72601 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 326 | 2 | 1 | 2 | 4.3 | O=C1Nc2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL199248 | 72601 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 326 | 2 | 1 | 2 | 4.3 | O=C1Nc2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| 44406540 | 73035 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 439 | 3 | 2 | 4 | 3.9 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1cccc(Cl)c1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL200882 | 73035 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 439 | 3 | 2 | 4 | 3.9 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CCCC[C@@]1(O)c1cccc(Cl)c1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL406010 | 215051 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | None | None | None | C[C@@H]1NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm010092i | |||||
| 44143419 | 187711 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494767 | 187711 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 381 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 118726262 | 117294 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 610 | 12 | 2 | 7 | 5.3 | COc1ccc(CNC[C@@H](O)CN2CN(c3ccccc3)C3(CCN(CCc4ccccc4-c4cccs4)CC3)C2=O)cc1 | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394744 | 117294 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 610 | 12 | 2 | 7 | 5.3 | COc1ccc(CNC[C@@H](O)CN2CN(c3ccccc3)C3(CCN(CCc4ccccc4-c4cccs4)CC3)C2=O)cc1 | 10.1016/j.bmcl.2014.12.015 | |||
| 45268355 | 198696 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 320 | 4 | 1 | 4 | 3.2 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL561732 | 198696 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 320 | 4 | 1 | 4 | 3.2 | Cc1ncc(-c2c(C)c(CN[C@H]3CC[C@@H](F)C3)nn2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| 44143446 | 178561 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 465 | 5 | 1 | 6 | 4.5 | CCOC(=O)N1CCC(C)(Sc2nc3cc(Cl)c(N4CCN(CC)CC4)cc3[nH]2)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466222 | 178561 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 465 | 5 | 1 | 6 | 4.5 | CCOC(=O)N1CCC(C)(Sc2nc3cc(Cl)c(N4CCN(CC)CC4)cc3[nH]2)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 10763594 | 161371 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | 120 | 4 | ChEMBL | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CC[C@H]3CCCc4cccc1c43)CC2 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL412098 | 161371 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | 120 | 4 | ChEMBL | 401 | 2 | 1 | 3 | 4.4 | O=C1NCN(c2ccccc2)C12CCN([C@@H]1CC[C@H]3CCCc4cccc1c43)CC2 | 10.1016/j.ejmech.2011.01.040 | |||
| 17858448 | 96011 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 322 | 5 | 2 | 4 | 3.4 | CCC(CC)Sc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL259452 | 96011 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 322 | 5 | 2 | 4 | 3.4 | CCC(CC)Sc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 45269357 | 198646 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 409 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CNC3CCCC3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL561396 | 198646 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 409 | 6 | 1 | 5 | 5.4 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CNC3CCCC3)c2C(C)C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL424934 | 215788 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | None | None | None | C[C@@H]1NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC1=O | 10.1021/jm010092i | |||||
| 135458466 | 79553 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 422 | 5 | 1 | 6 | 3.8 | CN1CCN(c2[nH]ccc3nc(-c4nc(CCc5ccc(Cl)cc5)no4)cc2-3)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211390 | 79553 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 422 | 5 | 1 | 6 | 3.8 | CN1CCN(c2[nH]ccc3nc(-c4nc(CCc5ccc(Cl)cc5)no4)cc2-3)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| 118726270 | 117302 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 546 | 9 | 2 | 6 | 4.8 | CC(C)(C)NC[C@@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394752 | 117302 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 546 | 9 | 2 | 6 | 4.8 | CC(C)(C)NC[C@@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| 44406719 | 166191 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 423 | 3 | 1 | 3 | 4.8 | O=C1NCN(c2ccc(Cl)cc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| CHEMBL425929 | 166191 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 0 | ChEMBL | 423 | 3 | 1 | 3 | 4.8 | O=C1NCN(c2ccc(Cl)cc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| 52915514 | 60961 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 552 | 16 | 3 | 5 | 8.2 | CCCCCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762404 | 60961 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 552 | 16 | 3 | 5 | 8.2 | CCCCCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 136043824 | 79962 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 396 | 7 | 1 | 5 | 4.6 | CN(C)CCc1cccc2[nH]c(-c3nc(COc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL212520 | 79962 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 396 | 7 | 1 | 5 | 4.6 | CN(C)CCc1cccc2[nH]c(-c3nc(COc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 10905740 | 110733 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 413 | 3 | 1 | 6 | 2.9 | O=c1[nH]c2ccccc2n(C2CCN(Cc3cc4c(cc3Cl)OCO4)CC2)c1=O | 10.1021/jm010878g | |||
| CHEMBL325945 | 110733 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 413 | 3 | 1 | 6 | 2.9 | O=c1[nH]c2ccccc2n(C2CCN(Cc3cc4c(cc3Cl)OCO4)CC2)c1=O | 10.1021/jm010878g | |||
| 136043756 | 78414 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 378 | 7 | 1 | 4 | 4.7 | CN(C)CCc1cccc2[nH]c(-c3nc(CCC4CC5CCC4C5)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211053 | 78414 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 378 | 7 | 1 | 4 | 4.7 | CN(C)CCc1cccc2[nH]c(-c3nc(CCC4CC5CCC4C5)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 136043767 | 79763 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 352 | 6 | 1 | 4 | 4.4 | CN(C)CCc1cccc2[nH]c(-c3nc(CC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211617 | 79763 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 352 | 6 | 1 | 4 | 4.4 | CN(C)CCc1cccc2[nH]c(-c3nc(CC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 44456216 | 155490 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 979 | 32 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)CC)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL403588 | 155490 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 979 | 32 | 15 | 11 | -0.3 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)CC)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 44404698 | 132809 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.7 | Cc1ccc2c(c1)C1(CCN(CC3CCCCCCC3)CC1)C(=O)N2C | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL369945 | 132809 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 354 | 2 | 0 | 2 | 4.7 | Cc1ccc2c(c1)C1(CCN(CC3CCCCCCC3)CC1)C(=O)N2C | 10.1016/j.bmcl.2005.08.009 | |||
| 136043795 | 78113 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 378 | 7 | 1 | 4 | 4.2 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(F)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL210140 | 78113 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 378 | 7 | 1 | 4 | 4.2 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(F)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 136043817 | 79871 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 380 | 6 | 1 | 4 | 4.6 | CN(C)CCc1cccc2[nH]c(-c3nc(Cc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL212161 | 79871 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 380 | 6 | 1 | 4 | 4.6 | CN(C)CCc1cccc2[nH]c(-c3nc(Cc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 11525624 | 133608 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL370870 | 133608 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 431 | 7 | 1 | 3 | 4.1 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@@H]1CCCN1Cc1ccccc1 | 10.1021/jm0509851 | |||
| 44456298 | 168906 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 979 | 33 | 15 | 11 | -0.3 | CCCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL437601 | 168906 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 979 | 33 | 15 | 11 | -0.3 | CCCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 44404694 | 72421 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 414 | 4 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(Cc3cccc4ccccc34)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198678 | 72421 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 414 | 4 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(Cc3cccc4ccccc34)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 52916267 | 60930 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 860 | 16 | 4 | 10 | 10.2 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762373 | 60930 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 860 | 16 | 4 | 10 | 10.2 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52915392 | 60959 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 524 | 14 | 3 | 5 | 7.4 | CCCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762402 | 60959 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 524 | 14 | 3 | 5 | 7.4 | CCCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 136043800 | 77819 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 428 | 7 | 1 | 4 | 5.1 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(C(F)(F)F)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL209213 | 77819 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 428 | 7 | 1 | 4 | 5.1 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(C(F)(F)F)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 155533462 | 171936 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 15 | 2 | ChEMBL | 385 | 4 | 1 | 5 | 3.8 | CCn1c(=O)n([C@@H]2CCN(C3CCCCCCC3)C[C@H]2CO)c2ccccc21 | 10.1021/acs.jmedchem.5b01499 | |||
| CHEMBL4468676 | 171936 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | 15 | 2 | ChEMBL | 385 | 4 | 1 | 5 | 3.8 | CCn1c(=O)n([C@@H]2CCN(C3CCCCCCC3)C[C@H]2CO)c2ccccc21 | 10.1021/acs.jmedchem.5b01499 | |||
| 11191683 | 60929 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 524 | 13 | 0 | 4 | 6.6 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)N(CCCCCCCCCN(C)C)CN3c2ccccc2)CC1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762372 | 60929 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 524 | 13 | 0 | 4 | 6.6 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)N(CCCCCCCCCN(C)C)CN3c2ccccc2)CC1 | 10.1016/j.ejmech.2011.01.040 | |||
| 10199945 | 96739 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 382 | 6 | 2 | 5 | 3.6 | CCC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL263919 | 96739 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 382 | 6 | 2 | 5 | 3.6 | CCC(C)(C)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44456101 | 97887 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 965 | 33 | 15 | 11 | -0.5 | CCCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL272084 | 97887 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 965 | 33 | 15 | 11 | -0.5 | CCCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 44143434 | 178621 | None | 3 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 461 | 5 | 2 | 6 | 3.8 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466702 | 178621 | None | 3 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 461 | 5 | 2 | 6 | 3.8 | CCN1CCN(c2cc3[nH]c(C(=O)[C@]4(C)CC[C@@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 10832076 | 38062 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 355 | 3 | 1 | 4 | 4.8 | CC(c1ccccc1Cl)N1CCC(n2c(O)nc3ccccc32)CC1 | 10.1021/jm990517p | |||
| CHEMBL146054 | 38062 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 355 | 3 | 1 | 4 | 4.8 | CC(c1ccccc1Cl)N1CCC(n2c(O)nc3ccccc32)CC1 | 10.1021/jm990517p | |||
| 44407129 | 74054 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 445 | 7 | 1 | 3 | 3.7 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1CCC(=O)N1Cc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202204 | 74054 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 445 | 7 | 1 | 3 | 3.7 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)[C@H]1CCC(=O)N1Cc1ccccc1 | 10.1021/jm0509851 | |||
| 52916359 | 60932 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 888 | 18 | 4 | 10 | 10.9 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762375 | 60932 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 888 | 18 | 4 | 10 | 10.9 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 45270203 | 198906 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 483 | 7 | 1 | 3 | 7.5 | FC(F)Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL563073 | 198906 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 483 | 7 | 1 | 3 | 7.5 | FC(F)Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 15982524 | 166377 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 384 | 4 | 0 | 4 | 3.5 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL427010 | 166377 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 384 | 4 | 0 | 4 | 3.5 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 45271862 | 197585 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.7 | Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL550117 | 197585 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.7 | Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44143414 | 178890 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 400 | 5 | 1 | 4 | 5.6 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccccn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL468936 | 178890 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 400 | 5 | 1 | 4 | 5.6 | Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccccn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 45270196 | 197851 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 473 | 6 | 1 | 3 | 7.9 | Clc1ccc(-c2c(-c3ccc(Cl)cc3Cl)nc(CNC3CCCC3)n2C2CCC2)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL552011 | 197851 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 473 | 6 | 1 | 3 | 7.9 | Clc1ccc(-c2c(-c3ccc(Cl)cc3Cl)nc(CNC3CCCC3)n2C2CCC2)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 11559820 | 166066 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 374 | 6 | 1 | 2 | 4.2 | O=C(/C=C/c1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL425225 | 166066 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 374 | 6 | 1 | 2 | 4.2 | O=C(/C=C/c1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 45270202 | 197907 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 475 | 7 | 1 | 3 | 7.9 | CC(C)Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL552417 | 197907 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 475 | 7 | 1 | 3 | 7.9 | CC(C)Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44450210 | 96271 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3c(Cl)cccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL260822 | 96271 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3c(Cl)cccc3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 52916599 | 60939 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 878 | 19 | 6 | 10 | 9.9 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762382 | 60939 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 878 | 19 | 6 | 10 | 9.9 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44143412 | 178563 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 433 | 4 | 0 | 3 | 6.8 | Cc1c(CN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL466226 | 178563 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 433 | 4 | 0 | 3 | 6.8 | Cc1c(CN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 136043797 | 77523 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 390 | 8 | 1 | 5 | 4.1 | COc1ccc(CCc2noc(-c3cc4c(CCN(C)C)cccc4[nH]3)n2)cc1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL208725 | 77523 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 390 | 8 | 1 | 5 | 4.1 | COc1ccc(CCc2noc(-c3cc4c(CCN(C)C)cccc4[nH]3)n2)cc1 | 10.1016/j.bmcl.2006.03.086 | |||
| 136043781 | 78029 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 420 | 7 | 1 | 4 | 5.3 | Clc1ccc(CCc2noc(-c3cc4c(CCN5CCCC5)cccc4[nH]3)n2)cc1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL209728 | 78029 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 420 | 7 | 1 | 4 | 5.3 | Clc1ccc(CCc2noc(-c3cc4c(CCN5CCCC5)cccc4[nH]3)n2)cc1 | 10.1016/j.bmcl.2006.03.086 | |||
| 136043779 | 78142 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 408 | 8 | 1 | 4 | 5.2 | CCN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL210292 | 78142 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 408 | 8 | 1 | 4 | 5.2 | CCN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 11676849 | 73541 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 454 | 7 | 2 | 3 | 4.9 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1C(O)c1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL201694 | 73541 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 454 | 7 | 2 | 3 | 4.9 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1C(O)c1ccccc1 | 10.1021/jm0509851 | |||
| 136043765 | 79758 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 352 | 7 | 1 | 4 | 4.4 | CN(C)CCc1cccc2[nH]c(-c3nc(CCC4CCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211592 | 79758 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 352 | 7 | 1 | 4 | 4.4 | CN(C)CCc1cccc2[nH]c(-c3nc(CCC4CCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 44406550 | 136136 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 435 | 4 | 2 | 5 | 3.3 | COc1cccc([C@]2(O)CCCC[C@H]2N2CCC3(CC2)C(=O)NCN3c2ccccc2)c1 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL373198 | 136136 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 435 | 4 | 2 | 5 | 3.3 | COc1cccc([C@]2(O)CCCC[C@H]2N2CCC3(CC2)C(=O)NCN3c2ccccc2)c1 | 10.1016/j.bmcl.2005.09.067 | |||
| 44450208 | 96269 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3cccc(Cl)c3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL260820 | 96269 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 410 | 4 | 2 | 4 | 4.7 | Fc1cc2nc(SCc3cccc(Cl)c3Cl)[nH]c2cc1N1CCNCC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 45270082 | 197701 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1ccc(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL551002 | 197701 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 323 | 4 | 1 | 3 | 3.7 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1ccc(F)c(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 10451761 | 38012 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 369 | 4 | 0 | 4 | 4.8 | CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1021/jm990517p | |||
| CHEMBL146013 | 38012 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 369 | 4 | 0 | 4 | 4.8 | CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2)c2ccccc21 | 10.1021/jm990517p | |||
| 10783436 | 38212 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 341 | 3 | 1 | 4 | 4.7 | Oc1nc2ccccc2n1C1CCN(CC2CCCCCCC2)CC1 | 10.1021/jm990517p | |||
| CHEMBL146191 | 38212 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 341 | 3 | 1 | 4 | 4.7 | Oc1nc2ccccc2n1C1CCN(CC2CCCCCCC2)CC1 | 10.1021/jm990517p | |||
| 44143452 | 178842 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 470 | 5 | 1 | 6 | 4.2 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](S(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468524 | 178842 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 470 | 5 | 1 | 6 | 4.2 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](S(C)(=O)=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 15982530 | 72397 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 408 | 2 | 0 | 2 | 5.4 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2cc(C(F)(F)F)ccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198600 | 72397 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 408 | 2 | 0 | 2 | 5.4 | CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2cc(C(F)(F)F)ccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 136043792 | 77402 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 394 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3noc(CCc4ccc(Cl)cc4)n3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL208603 | 77402 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 394 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3noc(CCc4ccc(Cl)cc4)n3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 44406489 | 141438 | None | 4 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| 44406489 | 141438 | None | 4 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| 44406489 | 141438 | None | 4 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2006.05.064 | |||
| CHEMBL383610 | 141438 | None | 4 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL383610 | 141438 | None | 4 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2005.09.075 | |||
| CHEMBL383610 | 141438 | None | 4 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN([C@H]1CCCC[C@H]1c1ccccc1)CC2 | 10.1016/j.bmcl.2006.05.064 | |||
| 15965865 | 138450 | None | 5 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCC1c1ccccc1)CC2 | 10.1016/j.bmcl.2006.05.058 | |||
| CHEMBL377140 | 138450 | None | 5 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 389 | 3 | 1 | 3 | 4.1 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCC1c1ccccc1)CC2 | 10.1016/j.bmcl.2006.05.058 | |||
| 118726261 | 117293 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 610 | 12 | 2 | 7 | 5.3 | COc1ccc(CNC[C@H](O)CN2CN(c3ccccc3)C3(CCN(CCc4ccccc4-c4cccs4)CC3)C2=O)cc1 | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394743 | 117293 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 610 | 12 | 2 | 7 | 5.3 | COc1ccc(CNC[C@H](O)CN2CN(c3ccccc3)C3(CCN(CCc4ccccc4-c4cccs4)CC3)C2=O)cc1 | 10.1016/j.bmcl.2014.12.015 | |||
| 44143441 | 178579 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 377 | 3 | 1 | 5 | 4.1 | C[C@@H]1CN(CC#N)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL466427 | 178579 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 377 | 3 | 1 | 5 | 4.1 | C[C@@H]1CN(CC#N)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| 44143417 | 187320 | None | 17 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 367 | 5 | 1 | 5 | 4.3 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1cccnc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL492396 | 187320 | None | 17 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 367 | 5 | 1 | 5 | 4.3 | Cc1c(CNC2CCCC2)nn(-c2ncccc2Cl)c1-c1cccnc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 11372671 | 138454 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 388 | 3 | 1 | 2 | 4.8 | O=C1NCC(c2ccccc2)C12CCN(C1(c3ccccc3)CCCCC1)CC2 | 10.1016/j.bmcl.2006.05.063 | |||
| CHEMBL377164 | 138454 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 388 | 3 | 1 | 2 | 4.8 | O=C1NCC(c2ccccc2)C12CCN(C1(c3ccccc3)CCCCC1)CC2 | 10.1016/j.bmcl.2006.05.063 | |||
| 136043782 | 138751 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 380 | 6 | 1 | 4 | 4.7 | CN(C)Cc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL377736 | 138751 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 380 | 6 | 1 | 4 | 4.7 | CN(C)Cc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 136043788 | 139430 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 420 | 5 | 1 | 4 | 5.5 | CN1CCC(c2cccc3[nH]c(-c4nc(CCc5ccc(Cl)cc5)no4)cc23)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL379284 | 139430 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 420 | 5 | 1 | 4 | 5.5 | CN1CCC(c2cccc3[nH]c(-c4nc(CCc5ccc(Cl)cc5)no4)cc23)CC1 | 10.1016/j.bmcl.2006.03.086 | |||
| 45270174 | 197653 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 419 | 5 | 1 | 3 | 6.5 | Clc1ccc(-c2nc(CNC3CCCC3)cn2-c2ccc(Cl)cc2Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL550601 | 197653 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 419 | 5 | 1 | 3 | 6.5 | Clc1ccc(-c2nc(CNC3CCCC3)cn2-c2ccc(Cl)cc2Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44449822 | 95921 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 360 | 4 | 2 | 4 | 3.5 | Fc1ccc(CSc2nc3cc(F)c(N4CCNCC4)cc3[nH]2)cc1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL259065 | 95921 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 360 | 4 | 2 | 4 | 3.5 | Fc1ccc(CSc2nc3cc(F)c(N4CCNCC4)cc3[nH]2)cc1 | 10.1016/j.bmcl.2008.04.054 | |||
| 52916470 | 60934 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 916 | 20 | 4 | 10 | 11.7 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762377 | 60934 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 916 | 20 | 4 | 10 | 11.7 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44407013 | 74435 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 430 | 6 | 1 | 2 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)C1(c2ccccc2)CCCCC1 | 10.1021/jm0509851 | |||
| CHEMBL202575 | 74435 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 430 | 6 | 1 | 2 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)C1(c2ccccc2)CCCCC1 | 10.1021/jm0509851 | |||
| 44143440 | 178760 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 420 | 3 | 1 | 4 | 5.2 | C[C@@H]1CN(CC(F)(F)F)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL467669 | 178760 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 420 | 3 | 1 | 4 | 5.2 | C[C@@H]1CN(CC(F)(F)F)CCN1c1cc2[nH]c(SC(C)(C)C)nc2cc1Cl | 10.1016/j.bmcl.2009.04.022 | |||
| 52915391 | 60958 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 510 | 13 | 3 | 5 | 7.0 | CCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762401 | 60958 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 510 | 13 | 3 | 5 | 7.0 | CCCCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44143420 | 187712 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 395 | 6 | 1 | 5 | 4.9 | CCc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494768 | 187712 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 395 | 6 | 1 | 5 | 4.9 | CCc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 15982526 | 72107 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 422 | 4 | 0 | 2 | 6.3 | O=C1N(CC2CCCCC2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL197735 | 72107 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 422 | 4 | 0 | 2 | 6.3 | O=C1N(CC2CCCCC2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| 44143427 | 189595 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3F)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL513855 | 189595 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-c2c(C)c(CNC3CCCC3F)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44143454 | 189284 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnnn5C)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL511205 | 189284 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 474 | 5 | 1 | 8 | 4.1 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@@H](c5nnnn5C)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 44456028 | 155689 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 965 | 32 | 15 | 11 | -0.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL404530 | 155689 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 965 | 32 | 15 | 11 | -0.7 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2007.11.043 | |||
| 44517710 | 198979 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 393 | 8 | 1 | 4 | 5.0 | COCCc1nc(CN[C@H]2CC[C@@H](F)C2)n(C(C)C)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL563593 | 198979 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 393 | 8 | 1 | 4 | 5.0 | COCCc1nc(CN[C@H]2CC[C@@H](F)C2)n(C(C)C)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44406539 | 135244 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 435 | 4 | 2 | 5 | 3.3 | COc1ccc([C@]2(O)CCCC[C@H]2N2CCC3(CC2)C(=O)NCN3c2ccccc2)cc1 | 10.1016/j.bmcl.2005.09.067 | |||
| CHEMBL371966 | 135244 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 0 | ChEMBL | 435 | 4 | 2 | 5 | 3.3 | COc1ccc([C@]2(O)CCCC[C@H]2N2CCC3(CC2)C(=O)NCN3c2ccccc2)cc1 | 10.1016/j.bmcl.2005.09.067 | |||
| 136043759 | 78740 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 380 | 8 | 1 | 4 | 5.2 | CN(C)CCc1cccc2[nH]c(-c3nc(CCCC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL211254 | 78740 | None | 0 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 0 | ChEMBL | 380 | 8 | 1 | 4 | 5.2 | CN(C)CCc1cccc2[nH]c(-c3nc(CCCC4CCCCC4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 52916713 | 60941 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 906 | 21 | 6 | 10 | 10.7 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762384 | 60941 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 906 | 21 | 6 | 10 | 10.7 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44404693 | 136177 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 398 | 4 | 0 | 4 | 3.4 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc(Cl)cc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL373222 | 136177 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 398 | 4 | 0 | 4 | 3.4 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc(Cl)cc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44143425 | 187636 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 425 | 6 | 1 | 7 | 3.4 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2S(C)(=O)=O)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL494414 | 187636 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 425 | 6 | 1 | 7 | 3.4 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncccc2S(C)(=O)=O)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44576626 | 193475 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 410 | 7 | 2 | 5 | 4.4 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL525054 | 193475 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 410 | 7 | 2 | 5 | 4.4 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 11603249 | 73215 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 376 | 7 | 1 | 2 | 4.1 | O=C(CCc1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL201181 | 73215 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 376 | 7 | 1 | 2 | 4.1 | O=C(CCc1ccccc1)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 52915389 | 60956 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 482 | 11 | 3 | 5 | 6.2 | CCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762399 | 60956 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 482 | 11 | 3 | 5 | 6.2 | CCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 15982529 | 72166 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 382 | 3 | 0 | 2 | 5.5 | CC(C)c1ccc2c(c1)C1(CCN(CC3CCCCCCC3)CC1)C(=O)N2C | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL197895 | 72166 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 382 | 3 | 0 | 2 | 5.5 | CC(C)c1ccc2c(c1)C1(CCN(CC3CCCCCCC3)CC1)C(=O)N2C | 10.1016/j.bmcl.2005.08.009 | |||
| 44143409 | 178670 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 447 | 5 | 1 | 3 | 7.2 | Cc1c(CNC2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL467049 | 178670 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 447 | 5 | 1 | 3 | 7.2 | Cc1c(CNC2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.04.116 | |||
| 10981761 | 110701 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 379 | 3 | 1 | 6 | 2.6 | O=C1NCN(c2ccccc2)C12CCN(Cc1ccc3nsnc3c1)CC2 | 10.1021/jm010878g | |||
| CHEMBL325750 | 110701 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 379 | 3 | 1 | 6 | 2.6 | O=C1NCN(c2ccccc2)C12CCN(Cc1ccc3nsnc3c1)CC2 | 10.1021/jm010878g | |||
| 52916712 | 60940 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 892 | 20 | 6 | 10 | 10.3 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762383 | 60940 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 892 | 20 | 6 | 10 | 10.3 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52916598 | 60938 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 864 | 18 | 6 | 10 | 9.5 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762381 | 60938 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 864 | 18 | 6 | 10 | 9.5 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCNCc4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 44449766 | 155786 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1ccccc1CSc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL405078 | 155786 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 356 | 4 | 2 | 4 | 3.7 | Cc1ccccc1CSc1nc2cc(F)c(N3CCNCC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 52915516 | 60963 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 483 | 11 | 4 | 6 | 4.8 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762406 | 60963 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 483 | 11 | 4 | 6 | 4.8 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(CNCCCCN)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 118726266 | 117298 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 586 | 11 | 2 | 7 | 5.3 | O=C1N(C[C@H](O)CNCc2cccs2)CN(c2ccccc2)C12CCN(CCc1ccccc1-c1cccs1)CC2 | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394748 | 117298 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 586 | 11 | 2 | 7 | 5.3 | O=C1N(C[C@H](O)CNCc2cccs2)CN(c2ccccc2)C12CCN(CCc1ccccc1-c1cccs1)CC2 | 10.1016/j.bmcl.2014.12.015 | |||
| 44576625 | 187604 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL494219 | 187604 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 396 | 7 | 2 | 5 | 4.0 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)C(C)C3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 11583016 | 74379 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 440 | 7 | 1 | 3 | 5.6 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Oc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL202443 | 74379 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 440 | 7 | 1 | 3 | 5.6 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1Oc1ccccc1 | 10.1021/jm0509851 | |||
| 44178080 | 198536 | None | 2 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 362 | 6 | 1 | 4 | 4.0 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCC#N)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL560667 | 198536 | None | 2 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 362 | 6 | 1 | 4 | 4.0 | Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(CCC#N)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 44143426 | 178817 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 415 | 5 | 1 | 5 | 5.3 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncc(Cl)cc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL468307 | 178817 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 415 | 5 | 1 | 5 | 5.3 | Cc1ccc(-c2c(C)c(CNC3CCCC3)nn2-c2ncc(Cl)cc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 24882570 | 115195 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343946 | 115195 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343947 | 115195 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| 45273679 | 198091 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 351 | 5 | 1 | 3 | 4.6 | Cc1nc(CN[C@H]2CC[C@@H](F)C2)c(C(C)C)n1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL556300 | 198091 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 351 | 5 | 1 | 3 | 4.6 | Cc1nc(CN[C@H]2CC[C@@H](F)C2)c(C(C)C)n1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL266667 | 213152 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | None | None | None | C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 118726271 | 117303 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 610 | 12 | 2 | 7 | 4.8 | COc1ccc(CCNC[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)cc1OC | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394753 | 117303 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 610 | 12 | 2 | 7 | 4.8 | COc1ccc(CCNC[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)cc1OC | 10.1016/j.bmcl.2014.12.015 | |||
| 15983062 | 72238 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 370 | 4 | 0 | 4 | 3.1 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198099 | 72238 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 370 | 4 | 0 | 4 | 3.1 | COC(=O)CN1C(=O)C2(CCN(CC3CCCCC3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 23542106 | 117305 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 611 | 12 | 1 | 7 | 5.3 | COc1ccc(CCOC[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)cc1OC | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394755 | 117305 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 611 | 12 | 1 | 7 | 5.3 | COc1ccc(CCOC[C@H](O)CN2CN(c3ccc(F)cc3)C3(CCN(CC4CCCCCCC4)CC3)C2=O)cc1OC | 10.1016/j.bmcl.2014.12.015 | |||
| 52916597 | 60937 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 958 | 23 | 4 | 10 | 12.9 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762380 | 60937 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 958 | 23 | 4 | 10 | 12.9 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52916472 | 60936 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 944 | 22 | 4 | 10 | 12.5 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762379 | 60936 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 944 | 22 | 4 | 10 | 12.5 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 15982797 | 72264 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 358 | 7 | 0 | 4 | 3.1 | CCCCCCN1CCC2(CC1)C(=O)N(CC(=O)OC)c1ccccc12 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198167 | 72264 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 358 | 7 | 0 | 4 | 3.1 | CCCCCCN1CCC2(CC1)C(=O)N(CC(=O)OC)c1ccccc12 | 10.1016/j.bmcl.2005.08.009 | |||
| 9887195 | 38554 | None | 5 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | CCn1c(=O)n([C@H]2CCN(CC3CCCCCCC3)C[C@@H]2CO)c2ccccc21 | 10.1021/jm990517p | |||
| CHEMBL146462 | 38554 | None | 5 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.0 | CCn1c(=O)n([C@H]2CCN(CC3CCCCCCC3)C[C@@H]2CO)c2ccccc21 | 10.1021/jm990517p | |||
| 44449850 | 161335 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 450 | 6 | 1 | 4 | 5.5 | Fc1ccc(CSc2nc3cc(F)c(N4CCN(Cc5ccccc5)CC4)cc3[nH]2)cc1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL411890 | 161335 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 450 | 6 | 1 | 4 | 5.5 | Fc1ccc(CSc2nc3cc(F)c(N4CCN(Cc5ccccc5)CC4)cc3[nH]2)cc1 | 10.1016/j.bmcl.2008.04.054 | |||
| 15982660 | 72480 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 382 | 4 | 0 | 3 | 4.1 | O=C1N(CC2CO2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL198867 | 72480 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 382 | 4 | 0 | 3 | 4.1 | O=C1N(CC2CO2)c2ccccc2C12CCN(CC1CCCCCCC1)CC2 | 10.1016/j.bmcl.2005.08.009 | |||
| 11597677 | 73687 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 454 | 8 | 1 | 3 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1OCc1ccccc1 | 10.1021/jm0509851 | |||
| CHEMBL201805 | 73687 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 454 | 8 | 1 | 3 | 5.4 | O=C(NCCCN1CCC2(CCc3ccccc32)CC1)c1ccccc1OCc1ccccc1 | 10.1021/jm0509851 | |||
| 52915269 | 60954 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 454 | 9 | 3 | 5 | 5.5 | CCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762397 | 60954 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 454 | 9 | 3 | 5 | 5.5 | CCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 52916360 | 60933 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 902 | 19 | 4 | 10 | 11.3 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762376 | 60933 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 902 | 19 | 4 | 10 | 11.3 | Cc1cc(N)c2cc(NC(=O)c3ccccc3COc3ccc(/C=N/CCCCCC/N=C/c4ccc(OCc5ccccc5C(=O)Nc5ccc6nc(C)cc(N)c6c5)cc4)cc3)ccc2n1 | 10.1016/j.ejmech.2011.01.040 | |||
| 45271014 | 197916 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.7 | Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL552482 | 197916 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 433 | 5 | 1 | 3 | 6.7 | Cn1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2009.06.095 | |||
| 44407020 | 73992 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 440 | 7 | 1 | 3 | 5.0 | CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL202152 | 73992 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 440 | 7 | 1 | 3 | 5.0 | CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL405451 | 215022 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm010092i | |||||
| 15982657 | 72164 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 432 | 4 | 0 | 4 | 3.8 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL197880 | 72164 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 432 | 4 | 0 | 4 | 3.8 | COC(=O)CN1C(=O)C2(CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 45270184 | 197726 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL551208 | 197726 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 399 | 5 | 1 | 5 | 4.6 | Cc1ccc(-n2c(-c3ncccc3Cl)nc(CN[C@H]3CC[C@@H](F)C3)c2C)cn1 | 10.1016/j.bmcl.2009.06.095 | |||
| 44143438 | 178838 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 366 | 3 | 1 | 4 | 4.6 | CCN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)[C@H](C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468504 | 178838 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 366 | 3 | 1 | 4 | 4.6 | CCN1CCN(c2cc3[nH]c(SC(C)(C)C)nc3cc2Cl)[C@H](C)C1 | 10.1016/j.bmcl.2009.04.022 | |||
| 45267505 | 198517 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 343 | 4 | 1 | 3 | 4.0 | Cn1nc(CN[C@H]2CC[C@@H](F)C2)c(Cl)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL560468 | 198517 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 343 | 4 | 1 | 3 | 4.0 | Cn1nc(CN[C@H]2CC[C@@H](F)C2)c(Cl)c1-c1cc(F)cc(F)c1 | 10.1016/j.bmcl.2009.06.051 | |||
| 44143429 | 178841 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 417 | 5 | 1 | 5 | 4.9 | Cc1ccc(-c2c(C)c(CNC3CCC(F)(F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| CHEMBL468518 | 178841 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 417 | 5 | 1 | 5 | 4.9 | Cc1ccc(-c2c(C)c(CNC3CCC(F)(F)C3)nn2-c2ncccc2Cl)cn1 | 10.1016/j.bmcl.2009.04.116 | |||
| 44143432 | 178814 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| CHEMBL468301 | 178814 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 465 | 5 | 2 | 6 | 4.5 | CCN1CCN(c2cc3[nH]c(S[C@]4(C)CC[C@H](NC(=O)OC)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.022 | |||
| 10221539 | 157090 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL407325 | 157090 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.054 | |||
| 10221539 | 157090 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| CHEMBL407325 | 157090 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 382 | 7 | 2 | 5 | 3.6 | CCC(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 | 10.1016/j.bmcl.2008.04.037 | |||
| 44143436 | 178571 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 402 | 4 | 1 | 5 | 3.7 | CCN1CCN(c2cc3[nH]c(C(=O)C4(C)CCC(=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| CHEMBL466307 | 178571 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 402 | 4 | 1 | 5 | 3.7 | CCN1CCN(c2cc3[nH]c(C(=O)C4(C)CCC(=O)CC4)nc3cc2Cl)CC1 | 10.1016/j.bmcl.2009.04.023 | |||
| 45272626 | 198220 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 306 | 4 | 2 | 3 | 3.2 | Cc1ncc(-c2[nH]nc(CN[C@H]3CC[C@@H](F)C3)c2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| CHEMBL557653 | 198220 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 306 | 4 | 2 | 3 | 3.2 | Cc1ncc(-c2[nH]nc(CN[C@H]3CC[C@@H](F)C3)c2C)cc1F | 10.1016/j.bmcl.2009.06.051 | |||
| 15982937 | 140364 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 410 | 3 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(C3CCC4CCCCC4C3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| CHEMBL380580 | 140364 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 410 | 3 | 0 | 4 | 3.9 | COC(=O)CN1C(=O)C2(CCN(C3CCC4CCCCC4C3)CC2)c2ccccc21 | 10.1016/j.bmcl.2005.08.009 | |||
| 44407156 | 141416 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 392 | 7 | 1 | 3 | 3.9 | CC(Oc1ccccc1)C(=O)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| CHEMBL383489 | 141416 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 392 | 7 | 1 | 3 | 3.9 | CC(Oc1ccccc1)C(=O)NCCCN1CCC2(CCc3ccccc32)CC1 | 10.1021/jm0509851 | |||
| 44449851 | 95847 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 374 | 4 | 1 | 4 | 3.9 | CN1CCN(c2cc3[nH]c(SCc4ccc(F)cc4)nc3cc2F)CC1 | 10.1016/j.bmcl.2008.04.054 | |||
| CHEMBL258746 | 95847 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 374 | 4 | 1 | 4 | 3.9 | CN1CCN(c2cc3[nH]c(SCc4ccc(F)cc4)nc3cc2F)CC1 | 10.1016/j.bmcl.2008.04.054 | |||
| 44456217 | 169783 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 979 | 33 | 15 | 11 | -0.3 | CCC(CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| CHEMBL443765 | 169783 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 979 | 33 | 15 | 11 | -0.3 | CCC(CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC | 10.1016/j.bmc.2007.11.043 | |||
| 136043819 | 77966 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 394 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL209537 | 77966 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 394 | 7 | 1 | 4 | 4.8 | CN(C)CCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 45273702 | 198233 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 497 | 8 | 1 | 3 | 7.7 | FCC(CF)n1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| CHEMBL557729 | 198233 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 497 | 8 | 1 | 3 | 7.7 | FCC(CF)n1c(CNC2CCCC2)nc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.06.095 | |||
| 136043780 | 139355 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 438 | 10 | 1 | 5 | 4.8 | CN(C)CCOCCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| CHEMBL379048 | 139355 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 438 | 10 | 1 | 5 | 4.8 | CN(C)CCOCCc1cccc2[nH]c(-c3nc(CCc4ccc(Cl)cc4)no3)cc12 | 10.1016/j.bmcl.2006.03.086 | |||
| 11143820 | 10124 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 399 | 3 | 1 | 5 | 3.0 | O=C1NCN(c2ccccc2)C12CCN(Cc1cc3c(cc1Cl)OCO3)CC2 | 10.1021/jm010878g | |||
| CHEMBL115652 | 10124 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 399 | 3 | 1 | 5 | 3.0 | O=C1NCN(c2ccccc2)C12CCN(Cc1cc3c(cc1Cl)OCO3)CC2 | 10.1021/jm010878g | |||
| 52915143 | 60946 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 452 | 8 | 2 | 5 | 5.8 | CCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| CHEMBL1762389 | 60946 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 452 | 8 | 2 | 5 | 5.8 | CCC/N=C/c1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1 | 10.1016/j.ejmech.2011.01.040 | |||
| 118726263 | 117295 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 636 | 14 | 1 | 6 | 6.8 | CCCCN(Cc1ccccc1)C[C@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| CHEMBL3394745 | 117295 | None | 0 | Human | Binding | pIC50 | = | 7 | 7.0 | - | 0 | ChEMBL | 636 | 14 | 1 | 6 | 6.8 | CCCCN(Cc1ccccc1)C[C@H](O)CN1CN(c2ccccc2)C2(CCN(CCc3ccccc3-c3cccs3)CC2)C1=O | 10.1016/j.bmcl.2014.12.015 | |||
| 16131448 | 2849 | None | 24 | Rat | Binding | pKd | = | 10.1 | 10.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pKd | = | 10.1 | 10.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pKd | = | 10.1 | 10.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pKd | = | 10.1 | 10.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pKd | = | 10.1 | 10.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pKd | = | 10.1 | 10.1 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pKd | = | 10.0 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKd | = | 10.0 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKd | = | 10.0 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKd | = | 10.0 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKd | = | 10.0 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKd | = | 10.0 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pKd | = | 10 | 10.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pKd | = | 10 | 10.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pKd | = | 10 | 10.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pKd | = | 10 | 10.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pKd | = | 10 | 10.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pKd | = | 10 | 10.0 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00111-6 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pKd | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKd | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKd | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKd | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKd | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKd | = | 9.7 | 9.7 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.09.018 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.3 | 9.3 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 16131448 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1681 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 1688 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 44361543 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 56947112 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| CHEMBL396460 | 2849 | None | 24 | Rat | Binding | pKd | = | 9.2 | 9.2 | -1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2009.10.026 | |||||
| 24882570 | 115195 | None | 0 | Human | Binding | pKd | = | 8.9 | 8.9 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343946 | 115195 | None | 0 | Human | Binding | pKd | = | 8.9 | 8.9 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| CHEMBL3343947 | 115195 | None | 0 | Human | Binding | pKd | = | 8.9 | 8.9 | - | 1 | ChEMBL | 981 | 32 | 16 | 12 | -1.0 | CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1016/j.bmc.2014.09.018 | |||
| 101232765 | 179930 | None | 0 | Human | Binding | pKd | = | 7.0 | 7.0 | - | 1 | ChEMBL | 1384 | 48 | 23 | 20 | -7.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CSC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4745049 | 179930 | None | 0 | Human | Binding | pKd | = | 7.0 | 7.0 | - | 1 | ChEMBL | 1384 | 48 | 23 | 20 | -7.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CSC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 162657543 | 181241 | None | 0 | Human | Binding | pKd | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1395 | 48 | 24 | 20 | -8.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CN[C@@H](C)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4760649 | 181241 | None | 0 | Human | Binding | pKd | = | 7.9 | 7.9 | - | 1 | ChEMBL | 1395 | 48 | 24 | 20 | -8.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CN[C@@H](C)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 101232765 | 179930 | None | 0 | Human | Binding | pKd | = | 6.9 | 6.9 | - | 1 | ChEMBL | 1384 | 48 | 23 | 20 | -7.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CSC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4745049 | 179930 | None | 0 | Human | Binding | pKd | = | 6.9 | 6.9 | - | 1 | ChEMBL | 1384 | 48 | 23 | 20 | -7.2 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CSC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL410396 | 215278 | None | 13 | Human | Binding | pKd | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| 162657543 | 181241 | None | 0 | Human | Binding | pKd | = | 7.7 | 7.7 | - | 1 | ChEMBL | 1395 | 48 | 24 | 20 | -8.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CN[C@@H](C)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| CHEMBL4760649 | 181241 | None | 0 | Human | Binding | pKd | = | 7.7 | 7.7 | - | 1 | ChEMBL | 1395 | 48 | 24 | 20 | -8.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CN[C@@H](C)c1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||
| 10654047 | 215090 | None | 16 | Human | Binding | pKd | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL406946 | 215090 | None | 16 | Human | Binding | pKd | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL410396 | 215278 | None | 13 | Human | Binding | pKd | = | 8.2 | 8.2 | 1 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| 10654047 | 215090 | None | 16 | Human | Binding | pKd | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| CHEMBL406946 | 215090 | None | 16 | Human | Binding | pKd | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | None | None | None | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/acs.jmedchem.9b02057 | |||||
| 44388467 | 169508 | None | 0 | Human | Binding | pKi | = | 10.7 | 10.7 | - | 1 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL442297 | 169508 | None | 0 | Human | Binding | pKi | = | 10.7 | 10.7 | - | 1 | ChEMBL | 1956 | 69 | 33 | 31 | -14.8 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL415845 | 215664 | None | 0 | Human | Binding | pKi | = | 10.7 | 10.7 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| CHEMBL264846 | 213091 | None | 0 | Human | Binding | pKi | = | 10.7 | 10.7 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 44388474 | 161136 | None | 0 | Human | Binding | pKi | = | 10.6 | 10.6 | - | 1 | ChEMBL | 1970 | 69 | 33 | 31 | -15.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL411649 | 161136 | None | 0 | Human | Binding | pKi | = | 10.6 | 10.6 | - | 1 | ChEMBL | 1970 | 69 | 33 | 31 | -15.0 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 3917 | 3930 | None | 1 | Human | Binding | pKi | = | 10.6 | 10.6 | 154 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 44430609 | 3930 | None | 1 | Human | Binding | pKi | = | 10.6 | 10.6 | 154 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL409969 | 3930 | None | 1 | Human | Binding | pKi | = | 10.6 | 10.6 | 154 | 4 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2007.04.026 | |||||
| 1641 | 2728 | None | 8 | Human | Binding | pKi | = | 10.5 | 10.5 | 2 | 12 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1021/jm00038a019 | |||
| 3829 | 2728 | None | 8 | Human | Binding | pKi | = | 10.5 | 10.5 | 2 | 12 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1021/jm00038a019 | |||
| 5497186 | 2728 | None | 8 | Human | Binding | pKi | = | 10.5 | 10.5 | 2 | 12 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1021/jm00038a019 | |||
| CHEMBL567175 | 2728 | None | 8 | Human | Binding | pKi | = | 10.5 | 10.5 | 2 | 12 | ChEMBL | 414 | 2 | 3 | 4 | 3.6 | Oc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@]4(O)Cc2c1[nH]c1c2cccc1)CC1CC1 | 10.1021/jm00038a019 | |||
| 44388466 | 96554 | None | 0 | Human | Binding | pKi | = | 10.5 | 10.5 | - | 1 | ChEMBL | 1938 | 69 | 33 | 31 | -14.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL262544 | 96554 | None | 0 | Human | Binding | pKi | = | 10.5 | 10.5 | - | 1 | ChEMBL | 1938 | 69 | 33 | 31 | -14.9 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| 70689062 | 77631 | None | 0 | Human | Binding | pKi | = | 10.4 | 10.4 | - | 1 | ChEMBL | 438 | 5 | 1 | 4 | 4.3 | NC(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088054 | 77631 | None | 0 | Human | Binding | pKi | = | 10.4 | 10.4 | - | 1 | ChEMBL | 438 | 5 | 1 | 4 | 4.3 | NC(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| CHEMBL3810319 | 214737 | None | 0 | Human | Binding | pKi | = | 10.4 | 10.4 | - | 1 | ChEMBL | None | None | None | CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O | 10.1021/acs.jmedchem.5b01976 | |||||
| CHEMBL263588 | 213038 | None | 0 | Human | Binding | pKi | = | 10.3 | 10.3 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pKi | = | 10.3 | 10.3 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKi | = | 10.3 | 10.3 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKi | = | 10.3 | 10.3 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKi | = | 10.3 | 10.3 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKi | = | 10.3 | 10.3 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKi | = | 10.3 | 10.3 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm040106v | |||||
| CHEMBL266191 | 213138 | None | 0 | Human | Binding | pKi | = | 10.3 | 10.3 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| CHEMBL414542 | 215598 | None | 0 | Human | Binding | pKi | = | 10.3 | 10.3 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| CHEMBL3808650 | 214734 | None | 0 | Human | Binding | pKi | = | 10.3 | 10.3 | - | 1 | ChEMBL | None | None | None | CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O | 10.1021/acs.jmedchem.5b01976 | |||||
| CHEMBL2372052 | 212633 | None | 0 | Human | Binding | pKi | = | 10.3 | 10.3 | 5 | 7 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(C)(C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)CNC(=O)[C@H](CN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1016/j.bmc.2007.04.026 | |||||
| CHEMBL438537 | 216235 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pKi | = | 10.2 | 10.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.09.068 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKi | = | 10.2 | 10.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.09.068 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKi | = | 10.2 | 10.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.09.068 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKi | = | 10.2 | 10.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.09.068 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKi | = | 10.2 | 10.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.09.068 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKi | = | 10.2 | 10.2 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2003.09.068 | |||||
| 68182754 | 112752 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 472 | 5 | 0 | 6 | 4.6 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236476 | 112752 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 472 | 5 | 0 | 6 | 4.6 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3304248 | 112752 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 472 | 5 | 0 | 6 | 4.6 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| 70684842 | 77636 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 460 | 6 | 0 | 4 | 4.4 | CN(C(=O)C(Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12)C1CC1 | 10.1021/jm201629q | |||
| CHEMBL2088061 | 77636 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 460 | 6 | 0 | 4 | 4.4 | CN(C(=O)C(Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12)C1CC1 | 10.1021/jm201629q | |||
| 68182860 | 112766 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 433 | 3 | 0 | 5 | 4.7 | Cc1nn(-c2c(F)cccc2F)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236474 | 112766 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 433 | 3 | 0 | 5 | 4.7 | Cc1nn(-c2c(F)cccc2F)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3304364 | 112766 | None | 0 | Human | Binding | pKi | = | 10.2 | 10.2 | - | 1 | ChEMBL | 433 | 3 | 0 | 5 | 4.7 | Cc1nn(-c2c(F)cccc2F)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| 9885005 | 57564 | None | 0 | Rat | Binding | pKi | = | 10.1 | 10.1 | 40 | 4 | ChEMBL | 355 | 3 | 1 | 3 | 3.6 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)NCN3c2ccccc2)CC1 | 10.1016/s0960-894x(00)00111-6 | |||
| CHEMBL166387 | 57564 | None | 0 | Rat | Binding | pKi | = | 10.1 | 10.1 | 40 | 4 | ChEMBL | 355 | 3 | 1 | 3 | 3.6 | CC(C)[C@H]1CC[C@@H](N2CCC3(CC2)C(=O)NCN3c2ccccc2)CC1 | 10.1016/s0960-894x(00)00111-6 | |||
| CHEMBL408356 | 215168 | None | 0 | Human | Binding | pKi | = | 10.1 | 10.1 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm0202021 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm2003238 | |||||
| 9842289 | 120547 | None | 0 | Rat | Binding | pKi | = | 10.1 | 10.1 | 8 | 4 | ChEMBL | 369 | 2 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2 | 10.1016/s0960-894x(00)00111-6 | |||
| CHEMBL354291 | 120547 | None | 0 | Rat | Binding | pKi | = | 10.1 | 10.1 | 8 | 4 | ChEMBL | 369 | 2 | 1 | 3 | 4.3 | O=C1NCN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2 | 10.1016/s0960-894x(00)00111-6 | |||
| 12419 | 2474 | None | 22 | Human | Binding | pKi | = | 10.1 | 10.1 | 12 | 3 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 10.1021/jm7012979 | |||
| 24800108 | 2474 | None | 22 | Human | Binding | pKi | = | 10.1 | 10.1 | 12 | 3 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 10.1021/jm7012979 | |||
| CHEMBL481512 | 2474 | None | 22 | Human | Binding | pKi | = | 10.1 | 10.1 | 12 | 3 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=C3C=CC=C4)[C@H]5CNCCC5 | 10.1021/jm7012979 | |||
| 58268629 | 78356 | None | 0 | Human | Binding | pKi | = | 10.1 | 10.1 | - | 1 | ChEMBL | 450 | 5 | 0 | 4 | 4.4 | CN(C)C(=O)C(Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088055 | 78356 | None | 0 | Human | Binding | pKi | = | 10.1 | 10.1 | - | 1 | ChEMBL | 450 | 5 | 0 | 4 | 4.4 | CN(C)C(=O)C(Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| CHEMBL2109704 | 78356 | None | 0 | Human | Binding | pKi | = | 10.1 | 10.1 | - | 1 | ChEMBL | 450 | 5 | 0 | 4 | 4.4 | CN(C)C(=O)C(Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| 52951809 | 83628 | None | 0 | Human | Binding | pKi | = | 10.1 | 10.1 | - | 1 | ChEMBL | 436 | 5 | 1 | 4 | 4.0 | CNC(=O)[C@@H](Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| CHEMBL2204347 | 83628 | None | 0 | Human | Binding | pKi | = | 10.1 | 10.1 | - | 1 | ChEMBL | 436 | 5 | 1 | 4 | 4.0 | CNC(=O)[C@@H](Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| 70684841 | 77634 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 436 | 5 | 1 | 4 | 4.0 | CNC(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088058 | 77634 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 436 | 5 | 1 | 4 | 4.0 | CNC(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| 58268628 | 112714 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 458 | 5 | 0 | 7 | 4.5 | COCc1cccnc1-n1cc(CN2CCC3(CC2)OCCc2cc(Cl)sc23)c(C)n1 | 10.1021/jm500117r | |||
| CHEMBL3236478 | 112714 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 458 | 5 | 0 | 7 | 4.5 | COCc1cccnc1-n1cc(CN2CCC3(CC2)OCCc2cc(Cl)sc23)c(C)n1 | 10.1021/jm500117r | |||
| CHEMBL3303098 | 112714 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 458 | 5 | 0 | 7 | 4.5 | COCc1cccnc1-n1cc(CN2CCC3(CC2)OCCc2cc(Cl)sc23)c(C)n1 | 10.1021/jm500117r | |||
| 58268566 | 110176 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 516 | 4 | 1 | 7 | 5.3 | Cc1nn(-c2ncccc2-c2ncc[nH]2)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236486 | 110176 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 516 | 4 | 1 | 7 | 5.3 | Cc1nn(-c2ncccc2-c2ncc[nH]2)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| 58268647 | 112678 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 442 | 5 | 0 | 7 | 4.0 | COCc1cccnc1-n1cc(CN2CCC3(CC2)OCCc2cc(F)sc23)c(C)n1 | 10.1021/jm500117r | |||
| CHEMBL3236479 | 112678 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 442 | 5 | 0 | 7 | 4.0 | COCc1cccnc1-n1cc(CN2CCC3(CC2)OCCc2cc(F)sc23)c(C)n1 | 10.1021/jm500117r | |||
| CHEMBL3302393 | 112678 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 442 | 5 | 0 | 7 | 4.0 | COCc1cccnc1-n1cc(CN2CCC3(CC2)OCCc2cc(F)sc23)c(C)n1 | 10.1021/jm500117r | |||
| 68182857 | 112758 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 458 | 4 | 1 | 6 | 3.7 | Cc1nn(-c2c(F)cccc2C(N)=O)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236475 | 112758 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 458 | 4 | 1 | 6 | 3.7 | Cc1nn(-c2c(F)cccc2C(N)=O)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3304315 | 112758 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 458 | 4 | 1 | 6 | 3.7 | Cc1nn(-c2c(F)cccc2C(N)=O)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| 67168385 | 112764 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 510 | 5 | 1 | 6 | 5.4 | CNCc1cccc(F)c1-n1cc(CN2CCC3(CC2)OCC(F)(F)c2cc(Cl)sc23)c(C)n1 | 10.1021/jm500117r | |||
| CHEMBL3236485 | 112764 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 510 | 5 | 1 | 6 | 5.4 | CNCc1cccc(F)c1-n1cc(CN2CCC3(CC2)OCC(F)(F)c2cc(Cl)sc23)c(C)n1 | 10.1021/jm500117r | |||
| CHEMBL3304360 | 112764 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 510 | 5 | 1 | 6 | 5.4 | CNCc1cccc(F)c1-n1cc(CN2CCC3(CC2)OCC(F)(F)c2cc(Cl)sc23)c(C)n1 | 10.1021/jm500117r | |||
| CHEMBL264084 | 213064 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 16131448 | 2849 | None | 24 | Human | Binding | pKi | = | 10 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKi | = | 10 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKi | = | 10 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKi | = | 10 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKi | = | 10 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKi | = | 10 | 10.0 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm020078l | |||||
| CHEMBL1162359 | 210976 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | - | 1 | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccccc2)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(N)=O | 10.1021/jm800394v | |||||
| 25208097 | 184028 | None | 1 | Human | Binding | pKi | = | 10 | 10.0 | 5 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL481366 | 184028 | None | 1 | Human | Binding | pKi | = | 10 | 10.0 | 5 | 4 | ChEMBL | 408 | 3 | 1 | 4 | 5.6 | CC1(N2CCC(n3c([C@H]4CCCNC4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| 10406239 | 120624 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | 2 | 4 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3326224 | 120624 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | 2 | 4 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3326226 | 120624 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | 2 | 4 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500117c | |||
| CHEMBL3545624 | 120624 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | 2 | 4 | ChEMBL | 360 | 2 | 1 | 2 | 5.0 | CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3ccccc3[nH]c12 | 10.1021/ml500117c | |||
| 52951675 | 83631 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | - | 1 | ChEMBL | 422 | 5 | 1 | 4 | 3.7 | NC(=O)[C@@H](Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| CHEMBL2204353 | 83631 | None | 0 | Human | Binding | pKi | = | 10 | 10.0 | - | 1 | ChEMBL | 422 | 5 | 1 | 4 | 3.7 | NC(=O)[C@@H](Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| 52914971 | 2407 | None | 39 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 480 | 4 | 1 | 7 | 4.4 | OCc1cccnc1n1nc(c(c1)CN1CCC2(CC1)OCC(c1c2sc(c1)Cl)(F)F)C | 10.1021/jm500117r | |||
| 9462 | 2407 | None | 39 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 480 | 4 | 1 | 7 | 4.4 | OCc1cccnc1n1nc(c(c1)CN1CCC2(CC1)OCC(c1c2sc(c1)Cl)(F)F)C | 10.1021/jm500117r | |||
| CHEMBL3304244 | 2407 | None | 39 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 480 | 4 | 1 | 7 | 4.4 | OCc1cccnc1n1nc(c(c1)CN1CCC2(CC1)OCC(c1c2sc(c1)Cl)(F)F)C | 10.1021/jm500117r | |||
| DB16048 | 2407 | None | 39 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 480 | 4 | 1 | 7 | 4.4 | OCc1cccnc1n1nc(c(c1)CN1CCC2(CC1)OCC(c1c2sc(c1)Cl)(F)F)C | 10.1021/jm500117r | |||
| 52951807 | 77409 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 406 | 5 | 1 | 4 | 3.2 | NC(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| CHEMBL2086410 | 77409 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 406 | 5 | 1 | 4 | 3.2 | NC(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| 52951807 | 77409 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 406 | 5 | 1 | 4 | 3.2 | NC(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| CHEMBL2086410 | 77409 | None | 0 | Human | Binding | pKi | = | 10.0 | 10.0 | - | 1 | ChEMBL | 406 | 5 | 1 | 4 | 3.2 | NC(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| 68182737 | 112680 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 497 | 4 | 1 | 6 | 5.1 | Cc1nn(-c2c(F)cccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236484 | 112680 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 497 | 4 | 1 | 6 | 5.1 | Cc1nn(-c2c(F)cccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL3302404 | 112680 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 497 | 4 | 1 | 6 | 5.1 | Cc1nn(-c2c(F)cccc2CO)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| 60154264 | 77416 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 434 | 5 | 0 | 4 | 3.8 | CN(C)C(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| CHEMBL2086648 | 77416 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 434 | 5 | 0 | 4 | 3.8 | CN(C)C(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088060 | 77416 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 434 | 5 | 0 | 4 | 3.8 | CN(C)C(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1016/j.bmc.2014.02.047 | |||||
| 68182789 | 112686 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 488 | 5 | 0 | 6 | 5.2 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236477 | 112686 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 488 | 5 | 0 | 6 | 5.2 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL3302591 | 112686 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 488 | 5 | 0 | 6 | 5.2 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm500117r | |||
| 70697390 | 77630 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 452 | 5 | 1 | 4 | 4.5 | CNC(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088053 | 77630 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 452 | 5 | 1 | 4 | 4.5 | CNC(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| 70689063 | 77632 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 436 | 5 | 1 | 4 | 4.0 | CNC(=O)C(Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088056 | 77632 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 436 | 5 | 1 | 4 | 4.0 | CNC(=O)C(Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(Cl)sc12 | 10.1021/jm201629q | |||
| 44388473 | 159560 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 1952 | 69 | 33 | 31 | -15.1 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL410145 | 159560 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 1952 | 69 | 33 | 31 | -15.1 | C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N(N)N)C(=O)NN | 10.1021/jm040106v | |||
| CHEMBL414767 | 215614 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | 154 | 2 | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O | 10.1021/jm040106v | |||||
| 44253565 | 142499 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 2 | ChEMBL | 430 | 5 | 0 | 2 | 5.8 | CN(C)C1(c2ccccc2)CCC(c2ccccc2)(N(C)C(=O)c2cccc(F)c2)CC1 | nan | |||
| CHEMBL3889835 | 142499 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 2 | ChEMBL | 430 | 5 | 0 | 2 | 5.8 | CN(C)C1(c2ccccc2)CCC(c2ccccc2)(N(C)C(=O)c2cccc(F)c2)CC1 | nan | |||
| 16131448 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm7009606 | |||||
| 1681 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm7009606 | |||||
| 1688 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm7009606 | |||||
| 44361543 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm7009606 | |||||
| 56947112 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm7009606 | |||||
| CHEMBL396460 | 2849 | None | 24 | Human | Binding | pKi | = | 9.9 | 9.9 | 1 | 6 | ChEMBL | None | None | None | None | 10.1021/jm7009606 | |||||
| 70697391 | 77633 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 450 | 5 | 0 | 4 | 4.4 | CN(C)C(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088057 | 77633 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 450 | 5 | 0 | 4 | 4.4 | CN(C)C(=O)C(Cc1ccccc1Cl)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| 52951808 | 77618 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 462 | 6 | 0 | 4 | 4.6 | CC(C)N(C)C(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| CHEMBL2088029 | 77618 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 462 | 6 | 0 | 4 | 4.6 | CC(C)N(C)C(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm201629q | |||
| 52951808 | 77618 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 462 | 6 | 0 | 4 | 4.6 | CC(C)N(C)C(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| CHEMBL2088029 | 77618 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 462 | 6 | 0 | 4 | 4.6 | CC(C)N(C)C(=O)[C@@H](Cc1ccccc1F)CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm101487v | |||
| 58268595 | 112765 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 416 | 3 | 0 | 6 | 4.0 | Cc1nn(-c2ncccc2F)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236473 | 112765 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 416 | 3 | 0 | 6 | 4.0 | Cc1nn(-c2ncccc2F)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| CHEMBL3304363 | 112765 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | - | 1 | ChEMBL | 416 | 3 | 0 | 6 | 4.0 | Cc1nn(-c2ncccc2F)cc1CN1CCC2(CC1)OCCc1cc(F)sc12 | 10.1021/jm500117r | |||
| 68182794 | 112679 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | - | 1 | ChEMBL | 524 | 5 | 0 | 6 | 5.7 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL3236482 | 112679 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | - | 1 | ChEMBL | 524 | 5 | 0 | 6 | 5.7 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL3302403 | 112679 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | - | 1 | ChEMBL | 524 | 5 | 0 | 6 | 5.7 | Cc1nn(-c2c(F)cccc2CN(C)C)cc1CN1CCC2(CC1)OCC(F)(F)c1cc(Cl)sc12 | 10.1021/jm500117r | |||
| CHEMBL410979 | 215315 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | - | 1 | ChEMBL | None | None | None | CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O | 10.1021/jm0202021 | |||||
| 25208101 | 184029 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 41 | 2 | ChEMBL | 479 | 4 | 0 | 5 | 6.2 | CC1(N2CCC(n3c(-c4cccc(S(C)(=O)=O)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| CHEMBL481367 | 184029 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 41 | 2 | ChEMBL | 479 | 4 | 0 | 5 | 6.2 | CC1(N2CCC(n3c(-c4cccc(S(C)(=O)=O)c4)nc4ccccc43)CC2)CCCCCCC1 | 10.1021/jm7012979 | |||
| 53319615 | 57323 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 1174 | 3 | ChEMBL | 451 | 4 | 1 | 4 | 6.5 | OCC1(N2CCC(n3c(-c4ccc(Cl)cc4)nc4ccccc43)CC2)CCCCCCC1 | 10.1016/j.bmc.2010.07.034 | |||
| CHEMBL1650843 | 57323 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 1174 | ||||||||||||