Ligand source activities (1 row/activity)
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | ||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
AssayType |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
| CHEMBL427807 | 213385 | 0 | None | 1 | 2 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(N)=O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O | 10.1021/jm990590f | ||||
| 57397279 | 69999 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC(F)F)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939594 | 69999 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC(F)F)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 127032015 | 138638 | 0 | None | - | 1 | Mouse | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 3561 | 116 | 51 | 45 | -9.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](N)Cc2ccccc2)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | ||
| CHEMBL3775924 | 138638 | 0 | None | - | 1 | Mouse | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 3561 | 116 | 51 | 45 | -9.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](N)Cc2ccccc2)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | ||
| 127032315 | 138428 | 0 | None | 1 | 2 | Mouse | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 3880 | 126 | 55 | 49 | -10.4 | CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | ||
| CHEMBL3774395 | 138428 | 0 | None | 1 | 2 | Mouse | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 3880 | 126 | 55 | 49 | -10.4 | CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | ||
| CHEMBL4299295 | 213562 | 0 | None | 1 | 2 | Mouse | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | ||||
| 57390212 | 70007 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 367 | 5 | 0 | 5 | 4.5 | CCC(CC)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939601 | 70007 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 367 | 5 | 0 | 5 | 4.5 | CCC(CC)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 127030817 | 138507 | 0 | None | 1 | 2 | Mouse | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 3824 | 122 | 55 | 49 | -12.0 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | ||
| CHEMBL3774939 | 138507 | 0 | None | 1 | 2 | Mouse | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 3824 | 122 | 55 | 49 | -12.0 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | ||
| 57395433 | 69988 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 387 | 6 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939583 | 69988 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 387 | 6 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 11153312 | 65506 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 383 | 6 | 1 | 6 | 5.5 | CCC(CC)n1ccc2c(Nc3ccc(OC)cc3Cl)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830523 | 65506 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 383 | 6 | 1 | 6 | 5.5 | CCC(CC)n1ccc2c(Nc3ccc(OC)cc3Cl)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | ||
| 127033542 | 138622 | 0 | None | 1 | 2 | Mouse | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 3960 | 128 | 56 | 50 | -10.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | ||
| CHEMBL3775796 | 138622 | 0 | None | 1 | 2 | Mouse | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 3960 | 128 | 56 | 50 | -10.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | ||
| 25115057 | 69993 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 399 | 6 | 0 | 5 | 5.4 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939588 | 69993 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 399 | 6 | 0 | 5 | 5.4 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57393713 | 69998 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939593 | 69998 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57400682 | 70002 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 359 | 4 | 0 | 5 | 4.2 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939597 | 70002 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 359 | 4 | 0 | 5 | 4.2 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 145958142 | 162058 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 383 | 6 | 1 | 6 | 4.8 | CCCCN(CC)c1nc(C)nc2c1sc(=N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | ||
| CHEMBL4160471 | 162058 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | 383 | 6 | 1 | 6 | 4.8 | CCCCN(CC)c1nc(C)nc2c1sc(=N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | ||
| 57397276 | 69976 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 373 | 5 | 0 | 5 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939571 | 69976 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 373 | 5 | 0 | 5 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57392001 | 69987 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 367 | 6 | 0 | 5 | 4.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939582 | 69987 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 367 | 6 | 0 | 5 | 4.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57393711 | 69975 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 353 | 5 | 0 | 5 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939570 | 69975 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 353 | 5 | 0 | 5 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 24758072 | 69977 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 320 | 4 | 0 | 2 | 6.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939572 | 69977 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 320 | 4 | 0 | 2 | 6.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| 24758076 | 69981 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 380 | 7 | 0 | 4 | 6.1 | CCc1cc(OC)c(OC)cc1-c1nn2c(C)cc(C(CC)CC)c2cc1C | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939576 | 69981 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 380 | 7 | 0 | 4 | 6.1 | CCc1cc(OC)c(OC)cc1-c1nn2c(C)cc(C(CC)CC)c2cc1C | 10.1016/j.bmc.2011.11.015 | ||
| 56665181 | 64760 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 386 | 6 | 1 | 5 | 5.6 | CCC(CC)Nc1c(C)c(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819085 | 64760 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 386 | 6 | 1 | 5 | 5.6 | CCC(CC)Nc1c(C)c(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | ||
| 24758075 | 69982 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 350 | 5 | 0 | 4 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3cnc(N(C)C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939577 | 69982 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 350 | 5 | 0 | 4 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3cnc(N(C)C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| 10024020 | 203102 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 401 | 9 | 0 | 5 | 5.2 | CCCN(c1nccc(-c2c(Cl)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| CHEMBL63989 | 203102 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 401 | 9 | 0 | 5 | 5.2 | CCCN(c1nccc(-c2c(Cl)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| 56677028 | 65299 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 359 | 7 | 2 | 6 | 4.7 | CCC(CC)Nc1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828886 | 65299 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 359 | 7 | 2 | 6 | 4.7 | CCC(CC)Nc1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 44290322 | 101170 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm990590f | ||
| CHEMBL295563 | 101170 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm990590f | ||
| 10178898 | 64741 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 396 | 6 | 1 | 6 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CSC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819065 | 64741 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 396 | 6 | 1 | 6 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CSC2 | 10.1016/j.bmc.2011.07.055 | ||
| 10024020 | 203102 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 401 | 9 | 0 | 5 | 5.2 | CCCN(c1nccc(-c2c(Cl)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| CHEMBL63989 | 203102 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 401 | 9 | 0 | 5 | 5.2 | CCCN(c1nccc(-c2c(Cl)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| 57400680 | 69996 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939591 | 69996 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 10177704 | 64736 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 378 | 6 | 1 | 5 | 5.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819060 | 64736 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 378 | 6 | 1 | 5 | 5.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| 56680359 | 65311 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828897 | 65311 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 57400681 | 70000 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 339 | 4 | 0 | 5 | 3.8 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939595 | 70000 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 339 | 4 | 0 | 5 | 3.8 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 24758074 | 69980 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 350 | 4 | 0 | 4 | 5.6 | CCC(CC)c1cc(C)n2nc(-c3cc4c(cc3C)OCO4)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939575 | 69980 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 350 | 4 | 0 | 4 | 5.6 | CCC(CC)c1cc(C)n2nc(-c3cc4c(cc3C)OCO4)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| 25114821 | 69997 | 0 | None | -1 | 2 | Rat | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939592 | 69997 | 0 | None | -1 | 2 | Rat | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 10222795 | 64757 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 402 | 5 | 1 | 4 | 6.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(Cl)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819082 | 64757 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 402 | 5 | 1 | 4 | 6.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(Cl)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| 56668632 | 64758 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 434 | 7 | 1 | 5 | 6.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC(F)F)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819083 | 64758 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 434 | 7 | 1 | 5 | 6.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC(F)F)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| 56659877 | 65306 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 415 | 9 | 1 | 6 | 5.9 | CCCN(CCC)c1c(C(C)C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828892 | 65306 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 415 | 9 | 1 | 6 | 5.9 | CCCN(CCC)c1c(C(C)C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56683765 | 65505 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1nc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830522 | 65505 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1nc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56683688 | 65314 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 413 | 10 | 0 | 6 | 5.3 | C=CCN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828900 | 65314 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 413 | 10 | 0 | 6 | 5.3 | C=CCN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | ||
| 25114821 | 69997 | 0 | None | 1 | 2 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939592 | 69997 | 0 | None | 1 | 2 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 24758071 | 69978 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 334 | 4 | 0 | 2 | 6.4 | CCC(CC)c1cc(C)n2nc(-c3cc(C)c(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939573 | 69978 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 334 | 4 | 0 | 2 | 6.4 | CCC(CC)c1cc(C)n2nc(-c3cc(C)c(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL429560 | 213540 | 0 | None | -2 | 2 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(N)=O | 10.1021/jm990590f | ||||
| CHEMBL2372650 | 210279 | 0 | None | 3 | 2 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(N)=O | 10.1021/jm990590f | ||||
| 57398970 | 69990 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 403 | 7 | 1 | 6 | 4.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939585 | 69990 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 403 | 7 | 1 | 6 | 4.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57402456 | 70009 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 353 | 4 | 0 | 5 | 4.1 | CCC(C)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939603 | 70009 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 353 | 4 | 0 | 5 | 4.1 | CCC(C)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 11588927 | 65507 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 5.4 | CCc1cc(OC)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830524 | 65507 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 5.4 | CCc1cc(OC)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | ||
| 57397278 | 69992 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 379 | 6 | 0 | 5 | 5.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939587 | 69992 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 379 | 6 | 0 | 5 | 5.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 56659949 | 65508 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 381 | 6 | 1 | 5 | 6.0 | CCc1cc(Cl)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830525 | 65508 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 381 | 6 | 1 | 5 | 6.0 | CCc1cc(Cl)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | ||
| 56678852 | 64759 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 372 | 6 | 1 | 5 | 5.3 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819084 | 64759 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 372 | 6 | 1 | 5 | 5.3 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | ||
| 56670271 | 65509 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 360 | 5 | 0 | 4 | 5.6 | CCC(CC)n1ccc2c(Cc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830526 | 65509 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 360 | 5 | 0 | 4 | 5.6 | CCC(CC)n1ccc2c(Cc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | ||
| 57400683 | 70006 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 353 | 4 | 0 | 6 | 3.3 | CCC(C)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939600 | 70006 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 353 | 4 | 0 | 6 | 3.3 | CCC(C)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 56659947 | 65498 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 374 | 7 | 1 | 7 | 4.2 | CCC(CC)Nc1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830516 | 65498 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 374 | 7 | 1 | 7 | 4.2 | CCC(CC)Nc1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL428505 | 213452 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(N)=O | 10.1021/jm990590f | ||||
| 136042278 | 69986 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 359 | 5 | 1 | 4 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939581 | 69986 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 359 | 5 | 1 | 4 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 11383650 | 65302 | 0 | None | 14 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828889 | 65302 | 0 | None | 14 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56668633 | 64761 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819086 | 64761 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | ||
| 11552261 | 65510 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 361 | 5 | 1 | 5 | 5.7 | CCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830527 | 65510 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 361 | 5 | 1 | 5 | 5.7 | CCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | ||
| 57400679 | 69989 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 383 | 7 | 1 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939584 | 69989 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 383 | 7 | 1 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 54754517 | 65496 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 417 | 10 | 0 | 7 | 4.8 | CCCN(CCC)c1cc(N(COC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830514 | 65496 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 417 | 10 | 0 | 7 | 4.8 | CCCN(CCC)c1cc(N(COC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 57398972 | 70008 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 339 | 3 | 0 | 5 | 3.8 | COc1cc(C)c(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(C)c1 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939602 | 70008 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 339 | 3 | 0 | 5 | 3.8 | COc1cc(C)c(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(C)c1 | 10.1016/j.bmc.2011.11.015 | ||
| 16126888 | 69974 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 336 | 5 | 0 | 3 | 5.8 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939569 | 69974 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 336 | 5 | 0 | 3 | 5.8 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| 10376 | 2930 | 4 | None | 1 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | ||
| 9801039 | 2930 | 4 | None | 1 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819077 | 2930 | 4 | None | 1 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | ||
| 10376 | 2930 | 4 | None | -1 | 2 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | ||
| 9801039 | 2930 | 4 | None | -1 | 2 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819077 | 2930 | 4 | None | -1 | 2 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | ||
| 56683763 | 65501 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830519 | 65501 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | ||
| 10135150 | 64751 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4cc(C)c(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819075 | 64751 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4cc(C)c(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| 57390211 | 69994 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 395 | 7 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939589 | 69994 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 395 | 7 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57398971 | 69995 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 393 | 7 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939590 | 69995 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 393 | 7 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57397277 | 69991 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 381 | 6 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939586 | 69991 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 381 | 6 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57393714 | 70003 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 367 | 5 | 0 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939598 | 70003 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 367 | 5 | 0 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 11703582 | 65511 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 378 | 7 | 0 | 6 | 5.4 | CCc1ccc(Oc2nc3ccnn3c3c2ccn3C(CC)CC)c(OC)c1 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830528 | 65511 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 378 | 7 | 0 | 6 | 5.4 | CCc1ccc(Oc2nc3ccnn3c3c2ccn3C(CC)CC)c(OC)c1 | 10.1016/j.bmc.2011.08.055 | ||
| 56673724 | 65301 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 373 | 8 | 1 | 6 | 4.8 | CCCN(CCC)c1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828888 | 65301 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 373 | 8 | 1 | 6 | 4.8 | CCCN(CCC)c1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 57393712 | 69984 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 337 | 5 | 0 | 4 | 5.2 | CCC(CC)c1nc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939579 | 69984 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 337 | 5 | 0 | 4 | 5.2 | CCC(CC)c1nc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | ||
| 56670270 | 65497 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 374 | 7 | 2 | 7 | 4.4 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830515 | 65497 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 374 | 7 | 2 | 7 | 4.4 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL2373995 | 210382 | 0 | None | -4 | 2 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)N[C@@H](CC(=O)O)C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(N)=O)C(C)C | 10.1021/jm990590f | ||||
| 24758073 | 69979 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 364 | 7 | 0 | 3 | 6.5 | CCOc1ccc(-c2nn3c(C)cc(C(CC)CC)c3cc2C)c(CC)c1 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939574 | 69979 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 364 | 7 | 0 | 3 | 6.5 | CCOc1ccc(-c2nn3c(C)cc(C(CC)CC)c3cc2C)c(CC)c1 | 10.1016/j.bmc.2011.11.015 | ||
| 22177839 | 64737 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 380 | 6 | 1 | 6 | 4.6 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819061 | 64737 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 380 | 6 | 1 | 6 | 4.6 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | ||
| 22177742 | 64762 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 400 | 6 | 1 | 6 | 5.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819087 | 64762 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 400 | 6 | 1 | 6 | 5.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | ||
| 136042277 | 69985 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 339 | 5 | 1 | 4 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939580 | 69985 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 339 | 5 | 1 | 4 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | ||
| 57402455 | 70001 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 345 | 3 | 0 | 5 | 3.8 | COc1ccc(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(Cl)c1 | 10.1016/j.bmc.2011.11.015 | ||
| CHEMBL1939596 | 70001 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 345 | 3 | 0 | 5 | 3.8 | COc1ccc(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(Cl)c1 | 10.1016/j.bmc.2011.11.015 | ||
| 54754515 | 65300 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 373 | 7 | 2 | 6 | 5.0 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828887 | 65300 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 373 | 7 | 2 | 6 | 5.0 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 9970050 | 64740 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 380 | 6 | 1 | 6 | 4.7 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819064 | 64740 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 380 | 6 | 1 | 6 | 4.7 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | ||
| 56670201 | 65312 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 415 | 10 | 0 | 6 | 5.6 | CCCN(CCC)c1cc(N(CCC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828898 | 65312 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 415 | 10 | 0 | 6 | 5.6 | CCCN(CCC)c1cc(N(CCC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56663414 | 65504 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830521 | 65504 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56668634 | 64763 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)OCC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819088 | 64763 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)OCC2 | 10.1016/j.bmc.2011.07.055 | ||
| 54754516 | 65304 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 401 | 9 | 1 | 6 | 5.3 | CCCN(CCC)c1c(CC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828890 | 65304 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 401 | 9 | 1 | 6 | 5.3 | CCCN(CCC)c1c(CC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 10111139 | 64752 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4c(C)cc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819076 | 64752 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4c(C)cc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| 11383650 | 65302 | 0 | None | -14 | 2 | Rat | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828889 | 65302 | 0 | None | -14 | 2 | Rat | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56663337 | 65313 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 427 | 10 | 0 | 6 | 5.7 | C=C(C)CN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828899 | 65313 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 427 | 10 | 0 | 6 | 5.7 | C=C(C)CN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | ||
| 56673725 | 65309 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 403 | 9 | 1 | 7 | 4.8 | CCCN(CCC)c1c(OC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828895 | 65309 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 403 | 9 | 1 | 7 | 4.8 | CCCN(CCC)c1c(OC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56683762 | 65500 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830518 | 65500 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 56659948 | 65499 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 388 | 8 | 1 | 7 | 4.5 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1830517 | 65499 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 388 | 8 | 1 | 7 | 4.5 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1077301 | 208491 | 0 | None | -8 | 3 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990590f | ||||
| 22177924 | 64747 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 362 | 5 | 1 | 4 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(C)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL1819071 | 64747 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 362 | 5 | 1 | 4 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(C)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | ||
| 56663335 | 65305 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 415 | 10 | 1 | 6 | 5.7 | CCCc1c(Nc2ccc(OC)cc2Cl)nc2ccnn2c1N(CCC)CCC | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828891 | 65305 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 415 | 10 | 1 | 6 | 5.7 | CCCc1c(Nc2ccc(OC)cc2Cl)nc2ccnn2c1N(CCC)CCC | 10.1016/j.bmc.2011.08.055 | ||
| 56663336 | 65310 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 387 | 8 | 0 | 6 | 4.8 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| CHEMBL1828896 | 65310 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 387 | 8 | 0 | 6 | 4.8 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | ||
| 9865575 | 203397 | 1 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 397 | 10 | 0 | 6 | 4.6 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| CHEMBL65484 | 203397 | 1 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 397 | 10 | 0 | 6 | 4.6 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| 9865575 | 203397 | 1 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 397 | 10 | 0 | 6 | 4.6 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| CHEMBL65484 | 203397 | 1 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 397 | 10 | 0 | 6 | 4.6 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | ||
| CHEMBL2370939 | 209963 | 0 | None | 5 | 2 | Human | 9.6 | pIC50 | = | 9.6 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]1CCC(=O)NNC(=O)C[C@@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@](C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](C)NC(=O)[C@@H](C)NC1=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm0202122 | ||||
| 10408534 | 76210 | 0 | None | - | 1 | Rat | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 397 | 5 | 0 | 5 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058338 | 76210 | 0 | None | - | 1 | Rat | 9.2 | pIC50 | = | 9.2 | Functional | ChEMBL | 397 | 5 | 0 | 5 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL1794009 | 208935 | 0 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](CC(N)=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](CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@H](C)CC)[C@H](C)CC)NC(=O)[C@@H](Cc2c[nH]cn2)NC(=O)[C@H](C)NC1=O | 10.1021/jm0202122 | ||||
| 9979210 | 76287 | 0 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 414 | 5 | 0 | 5 | 5.0 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(N(C)C)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058596 | 76287 | 0 | None | - | 1 | Rat | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | 414 | 5 | 0 | 5 | 5.0 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(N(C)C)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL439883 | 213849 | 0 | None | -1 | 5 | Human | 9.1 | pIC50 | = | 9.1 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm0202122 | ||||
| 44362115 | 1169 | 0 | None | 2 | 6 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0202122 | ||||
| 6967 | 1169 | 0 | None | 2 | 6 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0202122 | ||||
| CHEMBL1201609 | 1169 | 0 | None | 2 | 6 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0202122 | ||||
| CHEMBL440057 | 1169 | 0 | None | 2 | 6 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | None | None | None | None | 10.1021/jm0202122 | ||||
| 44587375 | 193400 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 393 | 9 | 0 | 6 | 4.8 | CCCN(CCC)c1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | ||
| CHEMBL525716 | 193400 | 0 | None | - | 1 | Human | 9.0 | pIC50 | = | 9 | Functional | ChEMBL | 393 | 9 | 0 | 6 | 4.8 | CCCN(CCC)c1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | ||
| 70688491 | 76289 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 397 | 5 | 0 | 5 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(Cl)cc3OC)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058598 | 76289 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Functional | ChEMBL | 397 | 5 | 0 | 5 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(Cl)cc3OC)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 44610627 | 139975 | 0 | None | -1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 519 | 9 | 2 | 8 | 5.5 | Cc1cc(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2016.03.067 | ||
| CHEMBL3799870 | 139975 | 0 | None | -1 | 2 | Human | 8.9 | pIC50 | = | 8.9 | Functional | ChEMBL | 519 | 9 | 2 | 8 | 5.5 | Cc1cc(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2016.03.067 | ||
| 70690504 | 76083 | 0 | None | - | 1 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 417 | 6 | 0 | 6 | 4.2 | COCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057479 | 76083 | 0 | None | - | 1 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 417 | 6 | 0 | 6 | 4.2 | COCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70682137 | 76284 | 0 | None | - | 1 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 401 | 5 | 0 | 5 | 4.9 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058593 | 76284 | 0 | None | - | 1 | Rat | 8.8 | pIC50 | = | 8.8 | Functional | ChEMBL | 401 | 5 | 0 | 5 | 4.9 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 45483574 | 198034 | 0 | None | -2 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 425 | 8 | 1 | 8 | 3.4 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C#N)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | ||
| CHEMBL573978 | 198034 | 0 | None | -2 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 425 | 8 | 1 | 8 | 3.4 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C#N)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | ||
| 44194976 | 195934 | 0 | None | -7 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | ||
| CHEMBL559437 | 195934 | 0 | None | -7 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | ||
| CHEMBL2370938 | 209962 | 0 | None | -2 | 2 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@](C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm0202122 | ||||
| 9884878 | 173025 | 18 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL45187 | 173025 | 18 | None | - | 1 | Human | 8.0 | pIC50 | = | 8 | Functional | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | ||
| CHEMBL2369741 | 209665 | 0 | None | -2 | 2 | Human | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=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](CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm0202122 | ||||
| 21984762 | 77542 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 409 | 8 | 0 | 4 | 5.9 | CCc1nn2c(-c3ccc(OC)cc3Cl)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087550 | 77542 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 409 | 8 | 0 | 4 | 5.9 | CCc1nn2c(-c3ccc(OC)cc3Cl)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| 21984648 | 77544 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087552 | 77544 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| 10378 | 3985 | 37 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| 11596613 | 3985 | 37 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287935 | 3985 | 37 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| DB12512 | 3985 | 37 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| 11509708 | 18992 | 3 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CC[C@@H](Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287905 | 18992 | 3 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CC[C@@H](Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| 58317452 | 126486 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 424 | 5 | 2 | 2 | 6.1 | CC(Nc1ccccc1)[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652065 | 126486 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 424 | 5 | 2 | 2 | 6.1 | CC(Nc1ccccc1)[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 10044263 | 76291 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 363 | 5 | 0 | 5 | 4.4 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058600 | 76291 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 363 | 5 | 0 | 5 | 4.4 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 9820671 | 188818 | 0 | None | -6 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | ||
| CHEMBL506214 | 188818 | 0 | None | -6 | 2 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | ||
| 58801661 | 77565 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 495 | 11 | 0 | 8 | 4.8 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| CHEMBL2087573 | 77565 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 495 | 11 | 0 | 8 | 4.8 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| 53357662 | 126532 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 447 | 4 | 1 | 3 | 5.8 | Cc1nn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(C)c1Cl | nan | ||
| CHEMBL3652110 | 126532 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 447 | 4 | 1 | 3 | 5.8 | Cc1nn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(C)c1Cl | nan | ||
| 58317263 | 126528 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 435 | 4 | 1 | 3 | 5.7 | O=C(N[C@H]1CC[C@H](Cn2ncc3ccccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652106 | 126528 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 435 | 4 | 1 | 3 | 5.7 | O=C(N[C@H]1CC[C@H](Cn2ncc3ccccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 58398961 | 136333 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 431 | 4 | 1 | 4 | 4.6 | Cn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)ccc3Cl)CC2)c2ccccc21 | nan | ||
| CHEMBL3731086 | 136333 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 431 | 4 | 1 | 4 | 4.6 | Cn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)ccc3Cl)CC2)c2ccccc21 | nan | ||
| CHEMBL3734018 | 136333 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 431 | 4 | 1 | 4 | 4.6 | Cn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)ccc3Cl)CC2)c2ccccc21 | nan | ||
| 58317281 | 126521 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 415 | 5 | 3 | 4 | 4.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2cc(C(F)(F)F)n[nH]2)CC1 | nan | ||
| CHEMBL3652099 | 126521 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 415 | 5 | 3 | 4 | 4.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2cc(C(F)(F)F)n[nH]2)CC1 | nan | ||
| CHEMBL2369693 | 209647 | 0 | None | -1 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=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](CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](C)NC1=O | 10.1021/jm0202122 | ||||
| 53308745 | 135574 | 0 | None | 67 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 441 | 4 | 1 | 3 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C3(CC3)c3cc(F)ccc32)CC1 | nan | ||
| CHEMBL3729075 | 135574 | 0 | None | 67 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 441 | 4 | 1 | 3 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C3(CC3)c3cc(F)ccc32)CC1 | nan | ||
| 44446725 | 168953 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2008.07.063 | ||
| CHEMBL438888 | 168953 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2008.07.063 | ||
| CHEMBL2370930 | 209959 | 0 | None | -1 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=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](CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC1=O | 10.1021/jm0202122 | ||||
| 60155991 | 77579 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 515 | 12 | 0 | 9 | 4.8 | COCCN(CC1CCOCC1)c1c(SC)nn2c(-c3c(OC)cc(COC)cc3OC)cccc12 | 10.1021/jm300259r | ||
| CHEMBL2087801 | 77579 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 515 | 12 | 0 | 9 | 4.8 | COCCN(CC1CCOCC1)c1c(SC)nn2c(-c3c(OC)cc(COC)cc3OC)cccc12 | 10.1021/jm300259r | ||
| 59186840 | 126461 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 468 | 7 | 2 | 4 | 5.2 | CN(C)Cc1ccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1 | nan | ||
| CHEMBL3652040 | 126461 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 468 | 7 | 2 | 4 | 5.2 | CN(C)Cc1ccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1 | nan | ||
| 53341220 | 135576 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 444 | 4 | 1 | 2 | 5.6 | CC1(C)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)ccc3Cl)CC2)c2ccccc21 | nan | ||
| CHEMBL3729078 | 135576 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 444 | 4 | 1 | 2 | 5.6 | CC1(C)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)ccc3Cl)CC2)c2ccccc21 | nan | ||
| 10379 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | ||
| 9884366 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | ||
| CHEMBL482950 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | ||
| DB12572 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | ||
| 44621879 | 126491 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 443 | 5 | 2 | 3 | 5.6 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)ncc1F | nan | ||
| CHEMBL3652070 | 126491 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 443 | 5 | 2 | 3 | 5.6 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)ncc1F | nan | ||
| 70694747 | 76293 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 377 | 5 | 0 | 5 | 4.8 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058602 | 76293 | 0 | None | - | 1 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 377 | 5 | 0 | 5 | 4.8 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70686533 | 76618 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2063381 | 76618 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 70686533 | 76618 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063381 | 76618 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 44814766 | 126482 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 342 | 5 | 2 | 2 | 4.7 | O=C(N[C@H]1CC[C@H](CNc2ccccc2)CC1)c1cccc(Cl)c1 | nan | ||
| CHEMBL3652061 | 126482 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 342 | 5 | 2 | 2 | 4.7 | O=C(N[C@H]1CC[C@H](CNc2ccccc2)CC1)c1cccc(Cl)c1 | nan | ||
| 53341553 | 136020 | 0 | None | 331 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 459 | 4 | 1 | 3 | 5.3 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3ccc(Cl)cc32)CC1 | nan | ||
| CHEMBL3731783 | 136020 | 0 | None | 331 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 459 | 4 | 1 | 3 | 5.3 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3ccc(Cl)cc32)CC1 | nan | ||
| 44341743 | 110583 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 418 | 8 | 0 | 4 | 5.6 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| CHEMBL325430 | 110583 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 418 | 8 | 0 | 4 | 5.6 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| 44342075 | 167873 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 360 | 6 | 0 | 2 | 6.8 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| CHEMBL431076 | 167873 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | 360 | 6 | 0 | 2 | 6.8 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| CHEMBL2370931 | 209960 | 0 | None | -2 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NC1CCC(=O)NCCCC[C@@H](C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=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](CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O | 10.1021/jm0202122 | ||||
| 60155887 | 77573 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 465 | 9 | 0 | 7 | 5.0 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(OC)nn12 | 10.1021/jm300259r | ||
| CHEMBL2087795 | 77573 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 465 | 9 | 0 | 7 | 5.0 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(OC)nn12 | 10.1021/jm300259r | ||
| 58317445 | 124413 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 490 | 6 | 3 | 3 | 6.5 | Cc1n[nH]c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1-c1ccccc1 | nan | ||
| CHEMBL3639509 | 124413 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 490 | 6 | 3 | 3 | 6.5 | Cc1n[nH]c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1-c1ccccc1 | nan | ||
| 58317390 | 126533 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 427 | 4 | 1 | 3 | 5.5 | Cc1nn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(C)c1C | nan | ||
| CHEMBL3652111 | 126533 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | ChEMBL | 427 | 4 | 1 | 3 | 5.5 | Cc1nn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(C)c1C | nan | ||
| 59186797 | 126495 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 401 | 5 | 3 | 4 | 4.0 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2n[nH]c3c2CCCC3)CC1 | nan | ||
| CHEMBL3652074 | 126495 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 401 | 5 | 3 | 4 | 4.0 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2n[nH]c3c2CCCC3)CC1 | nan | ||
| 58398959 | 135897 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 466 | 4 | 1 | 5 | 4.4 | Cn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ncccc21 | nan | ||
| CHEMBL3731041 | 135897 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 466 | 4 | 1 | 5 | 4.4 | Cn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ncccc21 | nan | ||
| 53341428 | 136219 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 520 | 4 | 1 | 2 | 6.4 | O=C(N[C@H]1CC[C@H](CN2C(=O)C(F)(F)c3ccc(Cl)cc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3732979 | 136219 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 520 | 4 | 1 | 2 | 6.4 | O=C(N[C@H]1CC[C@H](CN2C(=O)C(F)(F)c3ccc(Cl)cc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 70696789 | 76281 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 425 | 6 | 0 | 5 | 5.9 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC(C)C)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058590 | 76281 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 425 | 6 | 0 | 5 | 5.9 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC(C)C)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70686397 | 76294 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 378 | 5 | 0 | 6 | 4.1 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC)nc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058603 | 76294 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 378 | 5 | 0 | 6 | 4.1 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(OC)nc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 59186799 | 126511 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 510 | 6 | 3 | 3 | 6.8 | O=C(N[C@H]1CC[C@H](CNc2n[nH]cc2-c2ccc(Cl)cc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652089 | 126511 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 510 | 6 | 3 | 3 | 6.8 | O=C(N[C@H]1CC[C@H](CNc2n[nH]cc2-c2ccc(Cl)cc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 44342014 | 9543 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 392 | 6 | 0 | 5 | 4.7 | CCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL112290 | 9543 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 392 | 6 | 0 | 5 | 4.7 | CCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| 9909978 | 10038 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | ||
| CHEMBL115142 | 10038 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | ||
| 21984613 | 77543 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087551 | 77543 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| 10385822 | 76080 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 391 | 5 | 0 | 5 | 4.7 | CC[C@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)nccc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057476 | 76080 | 0 | None | - | 1 | Rat | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 391 | 5 | 0 | 5 | 4.7 | CC[C@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)nccc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 58317503 | 126524 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 475 | 6 | 2 | 4 | 5.8 | COc1ncc(Cl)cc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652102 | 126524 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 475 | 6 | 2 | 4 | 5.8 | COc1ncc(Cl)cc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 53341600 | 135369 | 0 | None | 30 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 439 | 4 | 1 | 3 | 5.0 | Cc1cccc2c1C(C)(C)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(Cl)cnc2C)CC1 | nan | ||
| CHEMBL3727810 | 135369 | 0 | None | 30 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 439 | 4 | 1 | 3 | 5.0 | Cc1cccc2c1C(C)(C)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(Cl)cnc2C)CC1 | nan | ||
| 53341554 | 135732 | 0 | None | 19 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 467 | 4 | 1 | 3 | 5.1 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(F)(F)c3ccc(Cl)cc32)CC1 | nan | ||
| CHEMBL3730045 | 135732 | 0 | None | 19 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 467 | 4 | 1 | 3 | 5.1 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(F)(F)c3ccc(Cl)cc32)CC1 | nan | ||
| 67185290 | 126531 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 483 | 5 | 2 | 4 | 4.4 | Cc1cc(N2CCNC2=O)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652109 | 126531 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 483 | 5 | 2 | 4 | 4.4 | Cc1cc(N2CCNC2=O)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 53341474 | 136016 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 482 | 4 | 1 | 2 | 5.9 | C[C@]1(F)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| CHEMBL3731745 | 136016 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 482 | 4 | 1 | 2 | 5.9 | C[C@]1(F)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| 62705998 | 76077 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 406 | 6 | 0 | 7 | 3.6 | CCC(COC)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057473 | 76077 | 0 | None | - | 1 | Rat | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 406 | 6 | 0 | 7 | 3.6 | CCC(COC)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 44341832 | 9418 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | ||
| CHEMBL111665 | 9418 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | ||
| 9952997 | 170603 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL445075 | 170603 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| 44341832 | 9418 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL111665 | 9418 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| 9908879 | 10080 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 398 | 6 | 0 | 2 | 7.1 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| CHEMBL115389 | 10080 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 398 | 6 | 0 | 2 | 7.1 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| 70696576 | 75583 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2046526 | 75583 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 70696576 | 75583 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | ||
| CHEMBL2046526 | 75583 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | ||
| 53341472 | 135391 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 508 | 5 | 1 | 3 | 6.0 | COc1ccc2c(c1)C(C)(C)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3727976 | 135391 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 508 | 5 | 1 | 3 | 6.0 | COc1ccc2c(c1)C(C)(C)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 60141295 | 75588 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 410 | 9 | 0 | 6 | 5.3 | CCN(CC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | ||
| CHEMBL2046534 | 75588 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 410 | 9 | 0 | 6 | 5.3 | CCN(CC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | ||
| 58398963 | 136181 | 0 | None | 54 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 459 | 4 | 1 | 3 | 5.3 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3cccc(Cl)c32)CC1 | nan | ||
| CHEMBL3732730 | 136181 | 0 | None | 54 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 459 | 4 | 1 | 3 | 5.3 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3cccc(Cl)c32)CC1 | nan | ||
| 59186812 | 126500 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 468 | 5 | 3 | 3 | 5.8 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3cccc(F)c23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652079 | 126500 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 468 | 5 | 3 | 3 | 5.8 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3cccc(F)c23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 9821586 | 168103 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| CHEMBL432800 | 168103 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| 70684375 | 76613 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 424 | 9 | 0 | 6 | 4.8 | COCCN(C)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063374 | 76613 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 424 | 9 | 0 | 6 | 4.8 | COCCN(C)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 44816479 | 126481 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 470 | 7 | 2 | 3 | 5.8 | CN(Cc1cc(-c2ccccc2)n[nH]1)C[C@H]1CC[C@H](NC(=O)c2cc(Cl)ccc2Cl)CC1 | nan | ||
| CHEMBL3652060 | 126481 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 470 | 7 | 2 | 3 | 5.8 | CN(Cc1cc(-c2ccccc2)n[nH]1)C[C@H]1CC[C@H](NC(=O)c2cc(Cl)ccc2Cl)CC1 | nan | ||
| 58398949 | 135319 | 0 | None | 109 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 479 | 5 | 1 | 4 | 5.5 | CCn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| CHEMBL3727515 | 135319 | 0 | None | 109 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 479 | 5 | 1 | 4 | 5.5 | CCn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| 53341019 | 136240 | 0 | None | 16 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 454 | 6 | 1 | 5 | 4.8 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2c(=O)n(CC(C)C)c3ccccc32)CC1 | nan | ||
| CHEMBL3733118 | 136240 | 0 | None | 16 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 454 | 6 | 1 | 5 | 4.8 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2c(=O)n(CC(C)C)c3ccccc32)CC1 | nan | ||
| 44341739 | 113501 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 392 | 6 | 1 | 5 | 4.5 | CCCN(CCO)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL332040 | 113501 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Functional | ChEMBL | 392 | 6 | 1 | 5 | 4.5 | CCCN(CCO)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL2368116 | 209587 | 0 | None | -43 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@](C)(CC(C)C)C(=O)N[C@@H](C(N)=O)[C@H](C)CC)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm0202122 | ||||
| 60155989 | 77577 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 513 | 11 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CC4)CC4COCCO4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| CHEMBL2087799 | 77577 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | ChEMBL | 513 | 11 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CC4)CC4COCCO4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| 145968888 | 165158 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | ||
| CHEMBL4228089 | 165158 | 0 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | ||
| 58317267 | 126535 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 414 | 4 | 1 | 4 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C(F)(F)F)cc2C)CC1 | nan | ||
| CHEMBL3652113 | 126535 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 414 | 4 | 1 | 4 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C(F)(F)F)cc2C)CC1 | nan | ||
| 44587456 | 188048 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 344 | 7 | 0 | 5 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | ||
| CHEMBL497652 | 188048 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 344 | 7 | 0 | 5 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | ||
| 44816314 | 126458 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1ncccc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652037 | 126458 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1ncccc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 58317442 | 126507 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1ncc(Cl)cc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652085 | 126507 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1ncc(Cl)cc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 59186841 | 126462 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 508 | 6 | 3 | 3 | 6.5 | C[C@@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC[C@@H]1CNc1cc(-c2ccc(F)cc2)[nH]n1 | nan | ||
| CHEMBL3652041 | 126462 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 508 | 6 | 3 | 3 | 6.5 | C[C@@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC[C@@H]1CNc1cc(-c2ccc(F)cc2)[nH]n1 | nan | ||
| 70696788 | 76279 | 0 | None | - | 1 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 411 | 6 | 0 | 5 | 5.5 | CCOc1cc(Cl)c(-c2ccnc3c2nc(C)c(=O)n3C(CC)C2CC2)cc1C | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058589 | 76279 | 0 | None | - | 1 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 411 | 6 | 0 | 5 | 5.5 | CCOc1cc(Cl)c(-c2ccnc3c2nc(C)c(=O)n3C(CC)C2CC2)cc1C | 10.1016/j.bmcl.2012.06.034 | ||
| 10069877 | 76082 | 0 | None | - | 1 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 405 | 6 | 0 | 6 | 4.2 | CCC(COC)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057478 | 76082 | 0 | None | - | 1 | Rat | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 405 | 6 | 0 | 6 | 4.2 | CCC(COC)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 60155709 | 77554 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 463 | 9 | 0 | 6 | 5.5 | CCc1nn2c(-c3c(OC)cc(C)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087562 | 77554 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 463 | 9 | 0 | 6 | 5.5 | CCc1nn2c(-c3c(OC)cc(C)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| 10200135 | 77547 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 385 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3Cl)cccc12 | 10.1021/jm300259r | ||
| CHEMBL2087555 | 77547 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 385 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3Cl)cccc12 | 10.1021/jm300259r | ||
| 127035055 | 135655 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 516 | 4 | 1 | 2 | 6.5 | C[C@@]1(F)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2cc(Cl)ccc21 | nan | ||
| CHEMBL3729578 | 135655 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 516 | 4 | 1 | 2 | 6.5 | C[C@@]1(F)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2cc(Cl)ccc21 | nan | ||
| 53341116 | 135809 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 484 | 4 | 1 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3cc(Cl)ccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3730505 | 135809 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 484 | 4 | 1 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3cc(Cl)ccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 10454889 | 76206 | 0 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 421 | 4 | 0 | 4 | 5.8 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(C(F)(F)F)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058334 | 76206 | 0 | None | - | 1 | Rat | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 421 | 4 | 0 | 4 | 5.8 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(C(F)(F)F)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 44129684 | 165030 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | ||
| CHEMBL4226158 | 165030 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | ||
| 44815438 | 126464 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 439 | 5 | 2 | 3 | 5.8 | Cc1cc(C)nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | ||
| CHEMBL3652043 | 126464 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Functional | ChEMBL | 439 | 5 | 2 | 3 | 5.8 | Cc1cc(C)nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | ||
| 71449705 | 81508 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(Cl)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160157 | 81508 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(Cl)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 58317483 | 126477 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 413 | 4 | 1 | 3 | 5.2 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| CHEMBL3652056 | 126477 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 413 | 4 | 1 | 3 | 5.2 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| 58317373 | 126505 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)ncc1Cl | nan | ||
| CHEMBL3652083 | 126505 | 0 | None | - | 1 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)ncc1Cl | nan | ||
| 44816481 | 126485 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1ccncc1NC[C@H]1CC[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652064 | 126485 | 0 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1ccncc1NC[C@H]1CC[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 70690704 | 76614 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2063375 | 76614 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 10255153 | 77559 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087549 | 77559 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087567 | 77559 | 8 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| 70690704 | 76614 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063375 | 76614 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 44816989 | 126490 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 429 | 5 | 2 | 3 | 5.3 | O=C(N[C@H]1CC[C@H](CNc2ccc(F)cn2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652069 | 126490 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 429 | 5 | 2 | 3 | 5.3 | O=C(N[C@H]1CC[C@H](CNc2ccc(F)cn2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 58317471 | 126534 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 461 | 5 | 1 | 3 | 6.2 | O=C(N[C@H]1CC[C@H](Cn2ccc(-c3ccccc3)n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652112 | 126534 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 461 | 5 | 1 | 3 | 6.2 | O=C(N[C@H]1CC[C@H](Cn2ccc(-c3ccccc3)n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 70686532 | 76611 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 408 | 8 | 0 | 5 | 5.5 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063372 | 76611 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 408 | 8 | 0 | 5 | 5.5 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 62705994 | 76295 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 388 | 4 | 0 | 5 | 4.8 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058604 | 76295 | 0 | None | - | 1 | Rat | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 388 | 4 | 0 | 5 | 4.8 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2369694 | 209648 | 0 | None | -4 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=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](CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)[C@H](CC(C)C)NC1=O | 10.1021/jm0202122 | ||||
| 53341430 | 136232 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 426 | 4 | 1 | 4 | 4.1 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3cccnc32)CC1 | nan | ||
| CHEMBL3733081 | 136232 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 426 | 4 | 1 | 4 | 4.1 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3cccnc32)CC1 | nan | ||
| 70690481 | 75905 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 429 | 6 | 1 | 4 | 6.6 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | ||
| CHEMBL2049196 | 75905 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 429 | 6 | 1 | 4 | 6.6 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | ||
| 71458702 | 81514 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 462 | 8 | 0 | 5 | 6.2 | CCN(CC)c1ccc(C(F)(F)F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160163 | 81514 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 462 | 8 | 0 | 5 | 6.2 | CCN(CC)c1ccc(C(F)(F)F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 44816824 | 126489 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 429 | 5 | 2 | 3 | 5.3 | O=C(N[C@H]1CC[C@H](CNc2cncc(F)c2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652068 | 126489 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 429 | 5 | 2 | 3 | 5.3 | O=C(N[C@H]1CC[C@H](CNc2cncc(F)c2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL526149 | 215675 | 10 | None | -8 | 2 | Rat | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(N)=O | 10.1021/jm9000242 | ||||
| 53340970 | 136233 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 427 | 5 | 1 | 6 | 3.6 | CCn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)c2ccncc21 | nan | ||
| CHEMBL3733082 | 136233 | 0 | None | - | 1 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 427 | 5 | 1 | 6 | 3.6 | CCn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)c2ccncc21 | nan | ||
| 53341118 | 135556 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 496 | 4 | 1 | 2 | 6.1 | CC1(C)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccc(F)cc21 | nan | ||
| CHEMBL3728921 | 135556 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 496 | 4 | 1 | 2 | 6.1 | CC1(C)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccc(F)cc21 | nan | ||
| 71455050 | 81512 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(Cl)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160161 | 81512 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(Cl)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 58317277 | 126493 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 439 | 6 | 2 | 3 | 5.7 | CCc1cncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | ||
| CHEMBL3652072 | 126493 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 439 | 6 | 2 | 3 | 5.7 | CCc1cncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | ||
| 58317419 | 126506 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 464 | 5 | 2 | 4 | 5.6 | Cn1nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| CHEMBL3652084 | 126506 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 464 | 5 | 2 | 4 | 5.6 | Cn1nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| 58317366 | 126517 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 478 | 6 | 2 | 6 | 4.7 | O=C(N[C@H]1CC[C@H](CNc2nnnn2-c2ccccc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652095 | 126517 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 478 | 6 | 2 | 6 | 4.7 | O=C(N[C@H]1CC[C@H](CNc2nnnn2-c2ccccc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 58317417 | 126530 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 414 | 4 | 1 | 4 | 4.6 | Cc1nc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| CHEMBL3652108 | 126530 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 414 | 4 | 1 | 4 | 4.6 | Cc1nc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| 70684210 | 76081 | 0 | None | - | 1 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 375 | 5 | 0 | 5 | 4.4 | COc1ccc(-c2ccnc3c2nc(C)c(=O)n3C(C2CC2)C2CC2)c(C)c1 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057477 | 76081 | 0 | None | - | 1 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 375 | 5 | 0 | 5 | 4.4 | COc1ccc(-c2ccnc3c2nc(C)c(=O)n3C(C2CC2)C2CC2)c(C)c1 | 10.1016/j.bmcl.2012.06.034 | ||
| 44341723 | 168133 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 416 | 7 | 0 | 4 | 6.3 | CCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL432976 | 168133 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 416 | 7 | 0 | 4 | 6.3 | CCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| 70686396 | 76290 | 0 | None | - | 1 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 413 | 6 | 0 | 6 | 4.8 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC)cc3OC)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058599 | 76290 | 0 | None | - | 1 | Rat | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 413 | 6 | 0 | 6 | 4.8 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC)cc3OC)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2370929 | 209958 | 0 | None | -6 | 2 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@](C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm0202122 | ||||
| 10075105 | 77566 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 511 | 11 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| CHEMBL2087574 | 77566 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 511 | 11 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| CHEMBL1794007 | 208934 | 0 | None | 1 | 2 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=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](CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@H](C)CC)[C@H](C)CC)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC1=O | 10.1021/jm0202122 | ||||
| 3663 | 99967 | 83 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | 10.1021/np1000329 | ||
| CHEMBL286494 | 99967 | 83 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | 10.1021/np1000329 | ||
| 58317349 | 126459 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 412 | 5 | 2 | 5 | 4.9 | Cc1nc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3Cl)CC2)sc1C | nan | ||
| CHEMBL3652038 | 126459 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 412 | 5 | 2 | 5 | 4.9 | Cc1nc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3Cl)CC2)sc1C | nan | ||
| 59186870 | 126492 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 454 | 5 | 3 | 3 | 5.4 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3c2CCCC3)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652071 | 126492 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 454 | 5 | 3 | 3 | 5.4 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3c2CCCC3)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 71458705 | 81521 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 438 | 10 | 0 | 6 | 5.5 | CCc1cc2c(N(CC)CC)ccc(OC)c2nc1-c1c(OC)cc(COC)cc1OC | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160170 | 81521 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 438 | 10 | 0 | 6 | 5.5 | CCc1cc2c(N(CC)CC)ccc(OC)c2nc1-c1c(OC)cc(COC)cc1OC | 10.1016/j.bmc.2012.09.028 | ||
| 59186828 | 126504 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 480 | 6 | 3 | 4 | 5.6 | COc1ccc2c(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n[nH]c2c1 | nan | ||
| CHEMBL3652082 | 126504 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 480 | 6 | 3 | 4 | 5.6 | COc1ccc2c(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n[nH]c2c1 | nan | ||
| 44815273 | 126484 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 494 | 6 | 3 | 3 | 6.3 | O=C(N[C@H]1CC[C@@H](CNc2cc(-c3ccc(F)cc3)n[nH]2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652063 | 126484 | 0 | None | - | 1 | Human | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 494 | 6 | 3 | 3 | 6.3 | O=C(N[C@H]1CC[C@@H](CNc2cc(-c3ccc(F)cc3)n[nH]2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 71458704 | 81517 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 410 | 9 | 0 | 6 | 4.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160167 | 81517 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 410 | 9 | 0 | 6 | 4.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | ||
| 58317316 | 126529 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 435 | 4 | 1 | 3 | 5.7 | O=C(N[C@H]1CC[C@H](Cn2cc3ccccc3n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652107 | 126529 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 435 | 4 | 1 | 3 | 5.7 | O=C(N[C@H]1CC[C@H](Cn2cc3ccccc3n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 58317324 | 126525 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 448 | 5 | 3 | 3 | 5.4 | Cc1n[nH]c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1Cl | nan | ||
| CHEMBL3652103 | 126525 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 448 | 5 | 3 | 3 | 5.4 | Cc1n[nH]c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1Cl | nan | ||
| 70692691 | 76205 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 375 | 4 | 0 | 4 | 5.4 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(C)c(C)c3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058333 | 76205 | 0 | None | - | 1 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 375 | 4 | 0 | 4 | 5.4 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(C)c(C)c3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 44815603 | 126468 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 491 | 7 | 2 | 4 | 6.1 | O=C(N[C@H]1CC[C@H](CNCc2cc(-c3ccccc3)on2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652047 | 126468 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 491 | 7 | 2 | 4 | 6.1 | O=C(N[C@H]1CC[C@H](CNCc2cc(-c3ccccc3)on2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 53341473 | 135564 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 509 | 5 | 1 | 4 | 5.4 | COc1cc2c(cn1)C(C)(C)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3729005 | 135564 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 509 | 5 | 1 | 4 | 5.4 | COc1cc2c(cn1)C(C)(C)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 53357410 | 126538 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 360 | 4 | 1 | 4 | 3.8 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | ||
| CHEMBL3652116 | 126538 | 0 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 360 | 4 | 1 | 4 | 3.8 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | ||
| 9906984 | 76183 | 0 | None | - | 1 | Rat | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 361 | 3 | 0 | 4 | 4.7 | Cc1nc2c(-c3ccc(Cl)cc3Cl)ccnc2n(CC(C)C)c1=O | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058066 | 76183 | 0 | None | - | 1 | Rat | 5.5 | pIC50 | = | 5.5 | Functional | ChEMBL | 361 | 3 | 0 | 4 | 4.7 | Cc1nc2c(-c3ccc(Cl)cc3Cl)ccnc2n(CC(C)C)c1=O | 10.1016/j.bmcl.2012.06.034 | ||
| 42618197 | 184306 | 0 | None | -5 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 391 | 6 | 1 | 6 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | ||
| CHEMBL484158 | 184306 | 0 | None | -5 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 391 | 6 | 1 | 6 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | ||
| 71458703 | 81515 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 419 | 8 | 0 | 6 | 5.1 | CCN(CC)c1ccc(C#N)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160164 | 81515 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 419 | 8 | 0 | 6 | 5.1 | CCN(CC)c1ccc(C#N)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 44815437 | 126463 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 431 | 5 | 2 | 4 | 5.5 | Cc1cnc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)s1 | nan | ||
| CHEMBL3652042 | 126463 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 431 | 5 | 2 | 4 | 5.5 | Cc1cnc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)s1 | nan | ||
| 12086065 | 10835 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 406 | 7 | 0 | 5 | 5.1 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL117209 | 10835 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 406 | 7 | 0 | 5 | 5.1 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| 9908466 | 114804 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | ||
| CHEMBL334039 | 114804 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | ||
| 53341173 | 135307 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 465 | 4 | 1 | 4 | 5.0 | Cn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| CHEMBL3727446 | 135307 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 465 | 4 | 1 | 4 | 5.0 | Cn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c2ccccc21 | nan | ||
| 62705997 | 76076 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 376 | 5 | 0 | 6 | 3.8 | COc1ccc(-c2ncnc3c2nc(C)c(=O)n3C(C2CC2)C2CC2)c(C)c1 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057472 | 76076 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 376 | 5 | 0 | 6 | 3.8 | COc1ccc(-c2ncnc3c2nc(C)c(=O)n3C(C2CC2)C2CC2)c(C)c1 | 10.1016/j.bmcl.2012.06.034 | ||
| 59186851 | 126510 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 490 | 6 | 3 | 3 | 6.5 | Cc1c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n[nH]c1-c1ccccc1 | nan | ||
| CHEMBL3652088 | 126510 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 490 | 6 | 3 | 3 | 6.5 | Cc1c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n[nH]c1-c1ccccc1 | nan | ||
| 59186801 | 126520 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 477 | 6 | 3 | 4 | 5.5 | O=C(N[C@H]1CC[C@H](CNc2[nH]ncc2-c2cccnc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652098 | 126520 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 477 | 6 | 3 | 4 | 5.5 | O=C(N[C@H]1CC[C@H](CNc2[nH]ncc2-c2cccnc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 70688432 | 75902 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 375 | 7 | 1 | 3 | 6.8 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | ||
| CHEMBL2049193 | 75902 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 375 | 7 | 1 | 3 | 6.8 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | ||
| 70696935 | 76609 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 450 | 11 | 0 | 5 | 6.6 | CCCN(CCC)c1ccc(CC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063370 | 76609 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 450 | 11 | 0 | 5 | 6.6 | CCCN(CCC)c1ccc(CC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 53341596 | 135662 | 0 | None | 79 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 455 | 5 | 1 | 4 | 4.7 | COc1ccc2c(c1)N(C[C@H]1CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC1)C(=O)C2(C)C | nan | ||
| CHEMBL3729602 | 135662 | 0 | None | 79 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 455 | 5 | 1 | 4 | 4.7 | COc1ccc2c(c1)N(C[C@H]1CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC1)C(=O)C2(C)C | nan | ||
| 42618195 | 184286 | 0 | None | 1 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(C)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | ||
| CHEMBL483993 | 184286 | 0 | None | 1 | 2 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(C)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | ||
| 62705996 | 76297 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 434 | 6 | 0 | 6 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC(F)F)cc3C)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058606 | 76297 | 0 | None | - | 1 | Rat | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 434 | 6 | 0 | 6 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC(F)F)cc3C)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 44814573 | 126457 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1cccnc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652036 | 126457 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1cccnc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 58317295 | 126512 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 406 | 5 | 2 | 4 | 4.8 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)ncc1Cl | nan | ||
| CHEMBL3652090 | 126512 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 406 | 5 | 2 | 4 | 4.8 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)ncc1Cl | nan | ||
| 44341814 | 110664 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 422 | 8 | 0 | 6 | 4.4 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL325918 | 110664 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 422 | 8 | 0 | 6 | 4.4 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| 22052143 | 76184 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 375 | 3 | 0 | 4 | 5.3 | Cc1nc2c(-c3ccc(Cl)cc3Cl)ccnc2n(C(C)C(C)C)c1=O | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058067 | 76184 | 0 | None | - | 1 | Rat | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 375 | 3 | 0 | 4 | 5.3 | Cc1nc2c(-c3ccc(Cl)cc3Cl)ccnc2n(C(C)C(C)C)c1=O | 10.1016/j.bmcl.2012.06.034 | ||
| 70682294 | 76617 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2063380 | 76617 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | ||
| 70682294 | 76617 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063380 | 76617 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 60155888 | 77574 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 481 | 9 | 0 | 7 | 5.7 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(SC)nn12 | 10.1021/jm300259r | ||
| CHEMBL2087796 | 77574 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 481 | 9 | 0 | 7 | 5.7 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(SC)nn12 | 10.1021/jm300259r | ||
| 59186815 | 126466 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1cccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| CHEMBL3652045 | 126466 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1cccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| 3520 | 3267 | 54 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm300864p | ||
| 9821250 | 3267 | 54 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm300864p | ||
| CHEMBL309138 | 3267 | 54 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm300864p | ||
| 9977800 | 76200 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 391 | 5 | 0 | 5 | 4.7 | CC[C@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058329 | 76200 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 391 | 5 | 0 | 5 | 4.7 | CC[C@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 10339953 | 76208 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 383 | 5 | 0 | 5 | 4.8 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058336 | 76208 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 383 | 5 | 0 | 5 | 4.8 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 22052073 | 76198 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 401 | 5 | 0 | 4 | 5.8 | CCCC(C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058327 | 76198 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 401 | 5 | 0 | 4 | 5.8 | CCCC(C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 57786006 | 164963 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 422 | 4 | 0 | 4 | 6.4 | CCN(CC)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | ||
| CHEMBL4225254 | 164963 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 422 | 4 | 0 | 4 | 6.4 | CCN(CC)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | ||
| 10362573 | 76209 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 383 | 5 | 0 | 5 | 4.8 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058337 | 76209 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 383 | 5 | 0 | 5 | 4.8 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70694746 | 76282 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 397 | 5 | 0 | 5 | 5.1 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058591 | 76282 | 0 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Functional | ChEMBL | 397 | 5 | 0 | 5 | 5.1 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70682138 | 76288 | 0 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 392 | 4 | 0 | 5 | 5.0 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C#N)c(C)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058597 | 76288 | 0 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 392 | 4 | 0 | 5 | 5.0 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C#N)c(C)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 44194975 | 196310 | 16 | None | -4 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 423 | 6 | 1 | 5 | 5.5 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | ||
| CHEMBL562219 | 196310 | 16 | None | -4 | 2 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 423 | 6 | 1 | 5 | 5.5 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | ||
| 44816316 | 126480 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1cncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | ||
| CHEMBL3652059 | 126480 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1cncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | ||
| 53340971 | 135346 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 427 | 4 | 1 | 6 | 3.4 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2c(=O)n(C)c3nccc(C)c32)CC1 | nan | ||
| CHEMBL3727694 | 135346 | 0 | None | - | 1 | Human | 6.4 | pIC50 | = | 6.4 | Functional | ChEMBL | 427 | 4 | 1 | 6 | 3.4 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2c(=O)n(C)c3nccc(C)c32)CC1 | nan | ||
| 71456848 | 81510 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 394 | 7 | 0 | 5 | 5.4 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160159 | 81510 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 394 | 7 | 0 | 5 | 5.4 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 59186833 | 126527 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 442 | 6 | 3 | 3 | 5.4 | CCc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1C | nan | ||
| CHEMBL3652105 | 126527 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 442 | 6 | 3 | 3 | 5.4 | CCc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1C | nan | ||
| 53340926 | 135775 | 0 | None | 19 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 463 | 4 | 1 | 3 | 5.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(F)c3ccc(Cl)cc32)CC1 | nan | ||
| CHEMBL3730298 | 135775 | 0 | None | 19 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 463 | 4 | 1 | 3 | 5.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(F)c3ccc(Cl)cc32)CC1 | nan | ||
| 53341018 | 135944 | 0 | None | 5 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 426 | 5 | 1 | 5 | 4.2 | CCn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)c2ccccc21 | nan | ||
| CHEMBL3731280 | 135944 | 0 | None | 5 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 426 | 5 | 1 | 5 | 4.2 | CCn1c(=O)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)c2ccccc21 | nan | ||
| 11948286 | 156669 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | ||
| CHEMBL4069551 | 156669 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | ||
| 70684376 | 76619 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2063382 | 76619 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 70684376 | 76619 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063382 | 76619 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2370917 | 209952 | 0 | None | -34 | 2 | Human | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@](C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm0202122 | ||||
| 70692846 | 76612 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 460 | 10 | 0 | 5 | 6.3 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063373 | 76612 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 460 | 10 | 0 | 5 | 6.3 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | ||
| 70692631 | 75900 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.bmcl.2012.05.066 | ||
| CHEMBL2049190 | 75900 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.bmcl.2012.05.066 | ||
| 53341117 | 136107 | 0 | None | 83 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 468 | 4 | 1 | 2 | 5.4 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3ccc(F)cc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3732322 | 136107 | 0 | None | 83 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 468 | 4 | 1 | 2 | 5.4 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3ccc(F)cc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 44815110 | 126478 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 440 | 6 | 3 | 3 | 5.4 | O=C(N[C@H]1CC[C@H](CNc2cc(C3CC3)n[nH]2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652057 | 126478 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 440 | 6 | 3 | 3 | 5.4 | O=C(N[C@H]1CC[C@H](CNc2cc(C3CC3)n[nH]2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 53341427 | 135344 | 0 | None | 79 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 425 | 4 | 1 | 3 | 4.7 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3ccccc32)CC1 | nan | ||
| CHEMBL3727689 | 135344 | 0 | None | 79 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 425 | 4 | 1 | 3 | 4.7 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3ccccc32)CC1 | nan | ||
| 21984746 | 77548 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 365 | 8 | 0 | 4 | 5.5 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3C)cccc12 | 10.1021/jm300259r | ||
| CHEMBL2087556 | 77548 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 365 | 8 | 0 | 4 | 5.5 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3C)cccc12 | 10.1021/jm300259r | ||
| 9952997 | 170603 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | ||
| CHEMBL445075 | 170603 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | ||
| 9909978 | 10038 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| CHEMBL115142 | 10038 | 0 | None | - | 1 | Human | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | ||
| 70696779 | 76204 | 0 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 361 | 4 | 0 | 4 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(C)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058332 | 76204 | 0 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Functional | ChEMBL | 361 | 4 | 0 | 4 | 5.1 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(C)c(C)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2370933 | 209961 | 0 | None | -9 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@](C)(CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NC(CC(=O)O)C(=O)N[C@@](C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC1=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm0202122 | ||||
| 53341556 | 135595 | 0 | None | 33 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 508 | 5 | 1 | 3 | 6.0 | COc1cccc2c1N(C[C@H]1CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC1)C(=O)C2(C)C | nan | ||
| CHEMBL3729197 | 135595 | 0 | None | 33 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 508 | 5 | 1 | 3 | 6.0 | COc1cccc2c1N(C[C@H]1CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC1)C(=O)C2(C)C | nan | ||
| 58801647 | 77567 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 479 | 10 | 0 | 7 | 5.1 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| CHEMBL2087575 | 77567 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 479 | 10 | 0 | 7 | 5.1 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| 59186865 | 126474 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 410 | 5 | 2 | 2 | 5.8 | O=C(N[C@H]1CC[C@H](CNc2ccccc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652053 | 126474 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 410 | 5 | 2 | 2 | 5.8 | O=C(N[C@H]1CC[C@H](CNc2ccccc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 44815774 | 126479 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 428 | 5 | 2 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CNc2cccc(F)c2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652058 | 126479 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 428 | 5 | 2 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CNc2cccc(F)c2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 3520 | 3267 | 54 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm050384+ | ||
| 9821250 | 3267 | 54 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm050384+ | ||
| CHEMBL309138 | 3267 | 54 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm050384+ | ||
| 59186804 | 126487 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 424 | 5 | 2 | 2 | 6.0 | C[C@H]1CC(CNc2ccccc2)CCC1NC(=O)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652066 | 126487 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 424 | 5 | 2 | 2 | 6.0 | C[C@H]1CC(CNc2ccccc2)CCC1NC(=O)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 44341636 | 9695 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| CHEMBL113097 | 9695 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | ||
| 60155540 | 77572 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 490 | 10 | 0 | 8 | 4.7 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C#N)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| CHEMBL2087794 | 77572 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 490 | 10 | 0 | 8 | 4.7 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C#N)nn23)c(OC)c1 | 10.1021/jm300259r | ||
| 70688490 | 76286 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 385 | 5 | 0 | 5 | 4.4 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3F)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058595 | 76286 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 385 | 5 | 0 | 5 | 4.4 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3F)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 58317486 | 126516 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 475 | 6 | 2 | 4 | 5.8 | COc1ccc(Cl)c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| CHEMBL3652094 | 126516 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 475 | 6 | 2 | 4 | 5.8 | COc1ccc(Cl)c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| 59186805 | 126502 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 464 | 5 | 3 | 3 | 5.9 | Cc1cccc2[nH]nc(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)c12 | nan | ||
| CHEMBL3652080 | 126502 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 464 | 5 | 3 | 3 | 5.9 | Cc1cccc2[nH]nc(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)c12 | nan | ||
| 59186875 | 126508 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 465 | 5 | 3 | 4 | 5.3 | Cc1ccc2c(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n[nH]c2n1 | nan | ||
| CHEMBL3652086 | 126508 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 465 | 5 | 3 | 4 | 5.3 | Cc1ccc2c(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n[nH]c2n1 | nan | ||
| 58317325 | 126536 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1ncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1Cl | nan | ||
| CHEMBL3652114 | 126536 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1ncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1Cl | nan | ||
| 145969226 | 164997 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | ||
| CHEMBL4225709 | 164997 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | ||
| 11740957 | 76079 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 387 | 4 | 0 | 4 | 5.4 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)nccc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057475 | 76079 | 0 | None | - | 1 | Rat | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 387 | 4 | 0 | 4 | 5.4 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)nccc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70692630 | 75898 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.bmcl.2012.05.066 | ||
| CHEMBL2049188 | 75898 | 0 | None | - | 1 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.bmcl.2012.05.066 | ||
| 53341597 | 135296 | 0 | None | 37 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 492 | 4 | 1 | 2 | 6.3 | Cc1cccc2c1N(C[C@H]1CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC1)C(=O)C2(C)C | nan | ||
| CHEMBL3727391 | 135296 | 0 | None | 37 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 492 | 4 | 1 | 2 | 6.3 | Cc1cccc2c1N(C[C@H]1CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC1)C(=O)C2(C)C | nan | ||
| 71453344 | 81519 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 444 | 9 | 0 | 6 | 5.6 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160169 | 81519 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 444 | 9 | 0 | 6 | 5.6 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 59186854 | 126513 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 524 | 6 | 3 | 3 | 7.1 | Cc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1-c1ccc(Cl)cc1 | nan | ||
| CHEMBL3652091 | 126513 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 524 | 6 | 3 | 3 | 7.1 | Cc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1-c1ccc(Cl)cc1 | nan | ||
| 53358726 | 126488 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 374 | 4 | 1 | 4 | 4.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C)c(C)c2C)CC1 | nan | ||
| CHEMBL3652067 | 126488 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 374 | 4 | 1 | 4 | 4.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C)c(C)c2C)CC1 | nan | ||
| 53341068 | 136123 | 0 | None | 77 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 457 | 4 | 1 | 3 | 5.2 | Cc1cc2c(cc1C)C(C)(F)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(Cl)cnc2C)CC1 | nan | ||
| CHEMBL3732415 | 136123 | 0 | None | 77 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 457 | 4 | 1 | 3 | 5.2 | Cc1cc2c(cc1C)C(C)(F)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(Cl)cnc2C)CC1 | nan | ||
| 21984771 | 77545 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087553 | 77545 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| 59186844 | 126515 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 476 | 6 | 3 | 3 | 6.2 | O=C(N[C@H]1CC[C@H](CNc2n[nH]cc2-c2ccccc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652093 | 126515 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 476 | 6 | 3 | 3 | 6.2 | O=C(N[C@H]1CC[C@H](CNc2n[nH]cc2-c2ccccc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 58317306 | 126526 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 524 | 6 | 2 | 4 | 6.9 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n(-c2ccc(Cl)cc2)n1 | nan | ||
| CHEMBL3652104 | 126526 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 524 | 6 | 2 | 4 | 6.9 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n(-c2ccc(Cl)cc2)n1 | nan | ||
| 53341068 | 136123 | 0 | None | 77 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 457 | 4 | 1 | 3 | 5.2 | Cc1cc2c(cc1C)C(C)(F)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(Cl)cnc2C)CC1 | nan | ||
| CHEMBL3732415 | 136123 | 0 | None | 77 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 457 | 4 | 1 | 3 | 5.2 | Cc1cc2c(cc1C)C(C)(F)C(=O)N2C[C@H]1CC[C@H](NC(=O)c2cc(Cl)cnc2C)CC1 | nan | ||
| 59186847 | 126469 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 445 | 5 | 2 | 4 | 5.8 | Cc1nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)sc1C | nan | ||
| CHEMBL3652048 | 126469 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 445 | 5 | 2 | 4 | 5.8 | Cc1nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)sc1C | nan | ||
| 44815273 | 126470 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 494 | 6 | 3 | 3 | 6.3 | O=C(N[C@H]1CC[C@H](CNc2cc(-c3ccc(F)cc3)n[nH]2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652049 | 126470 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 494 | 6 | 3 | 3 | 6.3 | O=C(N[C@H]1CC[C@H](CNc2cc(-c3ccc(F)cc3)n[nH]2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 59186813 | 126471 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 442 | 7 | 3 | 3 | 5.4 | CCCc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n[nH]1 | nan | ||
| CHEMBL3652050 | 126471 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 442 | 7 | 3 | 3 | 5.4 | CCCc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n[nH]1 | nan | ||
| 53341066 | 135601 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 459 | 4 | 1 | 3 | 5.0 | Cc1ncc(C(F)(F)F)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3ccccc32)CC1 | nan | ||
| CHEMBL3729224 | 135601 | 0 | None | - | 1 | Human | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 459 | 4 | 1 | 3 | 5.0 | Cc1ncc(C(F)(F)F)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C(C)(C)c3ccccc32)CC1 | nan | ||
| 53341558 | 136115 | 0 | None | 74 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 429 | 4 | 1 | 3 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)[C@@](C)(F)c3ccccc32)CC1 | nan | ||
| CHEMBL3732369 | 136115 | 0 | None | 74 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 429 | 4 | 1 | 3 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)[C@@](C)(F)c3ccccc32)CC1 | nan | ||
| 22052205 | 76185 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 375 | 4 | 0 | 4 | 5.4 | CCCC(C)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058068 | 76185 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 375 | 4 | 0 | 4 | 5.4 | CCCC(C)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 59186819 | 126494 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 390 | 5 | 2 | 4 | 4.3 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)ncc1F | nan | ||
| CHEMBL3652073 | 126494 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 390 | 5 | 2 | 4 | 4.3 | Cc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)ncc1F | nan | ||
| 59186796 | 126503 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 484 | 5 | 3 | 3 | 6.3 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3ccc(Cl)cc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652081 | 126503 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 484 | 5 | 3 | 3 | 6.3 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3ccc(Cl)cc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 71451515 | 81509 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 405 | 7 | 0 | 6 | 5.0 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C#N)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160158 | 81509 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 405 | 7 | 0 | 6 | 5.0 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C#N)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 22052069 | 76199 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 377 | 4 | 0 | 5 | 4.3 | COCC(C)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058328 | 76199 | 0 | None | - | 1 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 377 | 4 | 0 | 5 | 4.3 | COCC(C)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 59186871 | 126467 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 444 | 5 | 2 | 2 | 6.4 | O=C(N[C@H]1CC[C@H](CNc2ccccc2Cl)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652046 | 126467 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 444 | 5 | 2 | 2 | 6.4 | O=C(N[C@H]1CC[C@H](CNc2ccccc2Cl)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 44815276 | 126472 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 442 | 6 | 3 | 3 | 5.6 | CC(C)c1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n[nH]1 | nan | ||
| CHEMBL3652051 | 126472 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 442 | 6 | 3 | 3 | 5.6 | CC(C)c1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n[nH]1 | nan | ||
| 67238091 | 126460 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 455 | 6 | 3 | 4 | 4.9 | O=C(O)c1ccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1 | nan | ||
| CHEMBL3652039 | 126460 | 0 | None | - | 1 | Human | 5.2 | pIC50 | = | 5.2 | Functional | ChEMBL | 455 | 6 | 3 | 4 | 4.9 | O=C(O)c1ccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1 | nan | ||
| 53341425 | 135952 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 484 | 4 | 1 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3ccc(Cl)cc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3731360 | 135952 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 484 | 4 | 1 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3ccc(Cl)cc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 71455053 | 81524 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 482 | 12 | 0 | 7 | 5.5 | COCCN(CC(C)C)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160173 | 81524 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 482 | 12 | 0 | 7 | 5.5 | COCCN(CC(C)C)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 9908904 | 180487 | 4 | None | -5 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | ||
| CHEMBL474287 | 180487 | 4 | None | -5 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | ||
| CHEMBL475306 | 180487 | 4 | None | -5 | 2 | Rat | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | ||
| 44815440 | 126465 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1ccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1 | nan | ||
| CHEMBL3652044 | 126465 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 425 | 5 | 2 | 3 | 5.5 | Cc1ccc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1 | nan | ||
| 58317463 | 126475 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 392 | 5 | 2 | 5 | 4.5 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2nc(C)c(C)s2)CC1 | nan | ||
| CHEMBL3652054 | 126475 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 392 | 5 | 2 | 5 | 4.5 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2nc(C)c(C)s2)CC1 | nan | ||
| 71453343 | 81511 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160160 | 81511 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 59186843 | 126514 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 451 | 5 | 3 | 4 | 5.0 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3cccnc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652092 | 126514 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 451 | 5 | 3 | 4 | 5.0 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3cccnc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 58317395 | 126518 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 490 | 6 | 2 | 4 | 6.2 | Cn1cc(-c2ccccc2)c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| CHEMBL3652096 | 126518 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 490 | 6 | 2 | 4 | 6.2 | Cn1cc(-c2ccccc2)c(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | ||
| 24971237 | 188049 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 380 | 8 | 0 | 6 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | ||
| CHEMBL497653 | 188049 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 380 | 8 | 0 | 6 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | ||
| 57912459 | 82617 | 5 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | ||
| CHEMBL2179195 | 82617 | 5 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Functional | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | ||
| 69658040 | 76207 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 419 | 6 | 0 | 5 | 5.4 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC(F)F)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058335 | 76207 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 419 | 6 | 0 | 5 | 5.4 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC(F)F)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 10249650 | 76197 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 387 | 4 | 0 | 4 | 5.4 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058326 | 76197 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 387 | 4 | 0 | 4 | 5.4 | CC[C@@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 62706160 | 76078 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 418 | 6 | 0 | 7 | 3.6 | COCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2057474 | 76078 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 418 | 6 | 0 | 7 | 3.6 | COCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2370916 | 209951 | 0 | None | -13 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](C(=O)N(C)[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)O)NC(=O)[C@@H](C)NC(=O)[C@H](CCC(N)=O)NC1=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm0202122 | ||||
| 70682293 | 76608 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2063369 | 76608 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 70682293 | 76608 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063369 | 76608 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 58317340 | 126483 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 427 | 5 | 2 | 3 | 5.7 | O=C(N[C@H]1CC[C@H](CNc2cccc3ncccc23)CC1)c1cccc(C(F)(F)F)c1 | nan | ||
| CHEMBL3652062 | 126483 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 427 | 5 | 2 | 3 | 5.7 | O=C(N[C@H]1CC[C@H](CNc2cccc3ncccc23)CC1)c1cccc(C(F)(F)F)c1 | nan | ||
| 58317279 | 126537 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 394 | 4 | 1 | 4 | 4.5 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C)c(Cl)c2C)CC1 | nan | ||
| CHEMBL3652115 | 126537 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 394 | 4 | 1 | 4 | 4.5 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C)c(Cl)c2C)CC1 | nan | ||
| 9843598 | 67776 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | ||
| CHEMBL190845 | 67776 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | ||
| 58317422 | 126522 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 376 | 5 | 2 | 4 | 4.0 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2ccc(F)cn2)CC1 | nan | ||
| CHEMBL3652100 | 126522 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 376 | 5 | 2 | 4 | 4.0 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CNc2ccc(F)cn2)CC1 | nan | ||
| 9908904 | 180487 | 4 | None | -5 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | ||
| CHEMBL474287 | 180487 | 4 | None | -5 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | ||
| CHEMBL475306 | 180487 | 4 | None | -5 | 2 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | ||
| 10363079 | 76202 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 391 | 5 | 0 | 5 | 4.7 | CC[C@@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058330 | 76202 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 391 | 5 | 0 | 5 | 4.7 | CC[C@@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 71455052 | 81518 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 428 | 9 | 0 | 6 | 5.1 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160168 | 81518 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 428 | 9 | 0 | 6 | 5.1 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 9865624 | 15544 | 12 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmc.2022.116614 | ||
| CHEMBL121896 | 15544 | 12 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmc.2022.116614 | ||
| 11774042 | 203352 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2022.116614 | ||
| CHEMBL65078 | 203352 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2022.116614 | ||
| 10338811 | 76292 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 364 | 5 | 0 | 6 | 3.8 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058601 | 76292 | 0 | None | - | 1 | Rat | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 364 | 5 | 0 | 6 | 3.8 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 44815112 | 126473 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 411 | 5 | 2 | 3 | 5.2 | O=C(N[C@H]1CC[C@H](CNc2cccnc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652052 | 126473 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 411 | 5 | 2 | 3 | 5.2 | O=C(N[C@H]1CC[C@H](CNc2cccnc2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 59186853 | 126519 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 429 | 5 | 2 | 4 | 5.4 | Cc1noc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1C | nan | ||
| CHEMBL3652097 | 126519 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 429 | 5 | 2 | 4 | 5.4 | Cc1noc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1C | nan | ||
| 59186802 | 126509 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 520 | 7 | 3 | 3 | 6.2 | CCCc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1Br | nan | ||
| CHEMBL3652087 | 126509 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 520 | 7 | 3 | 3 | 6.2 | CCCc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1Br | nan | ||
| 11025 | 2740 | 7 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 10.1021/jm049085v | ||
| 11713007 | 2740 | 7 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 10.1021/jm049085v | ||
| CHEMBL380800 | 2740 | 7 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 10.1021/jm049085v | ||
| 10407938 | 76186 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 387 | 4 | 0 | 4 | 5.4 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058069 | 76186 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 387 | 4 | 0 | 4 | 5.4 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70692690 | 76203 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 347 | 4 | 0 | 4 | 4.7 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3ccc(C)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058331 | 76203 | 0 | None | - | 1 | Rat | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 347 | 4 | 0 | 4 | 4.7 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3ccc(C)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 58317325 | 126536 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1ncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1Cl | nan | ||
| CHEMBL3652114 | 126536 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 459 | 5 | 2 | 3 | 6.1 | Cc1ncc(NC[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1Cl | nan | ||
| 58317360 | 126496 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 455 | 6 | 2 | 4 | 5.5 | COc1ncc(C)cc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| CHEMBL3652075 | 126496 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 455 | 6 | 2 | 4 | 5.5 | COc1ncc(C)cc1NC[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | ||
| 53341022 | 136179 | 0 | None | 41 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 412 | 4 | 1 | 5 | 3.7 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2c(=O)n(C)c3ccccc32)CC1 | nan | ||
| CHEMBL3732721 | 136179 | 0 | None | 41 | 2 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 412 | 4 | 1 | 5 | 3.7 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2c(=O)n(C)c3ccccc32)CC1 | nan | ||
| 59186825 | 126498 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 464 | 5 | 3 | 3 | 5.9 | Cc1ccc2[nH]nc(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)c2c1 | nan | ||
| CHEMBL3652077 | 126498 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 464 | 5 | 3 | 3 | 5.9 | Cc1ccc2[nH]nc(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)c2c1 | nan | ||
| 70909805 | 139314 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 434 | 8 | 1 | 5 | 6.6 | CCCN(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | ||
| CHEMBL3792517 | 139314 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 434 | 8 | 1 | 5 | 6.6 | CCCN(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | ||
| 59186817 | 126497 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 451 | 5 | 3 | 4 | 5.0 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3ncccc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652076 | 126497 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 451 | 5 | 3 | 4 | 5.0 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3ncccc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 53341471 | 135585 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 494 | 4 | 1 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CN2C(=O)C3(CC3)c3cc(F)ccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3729128 | 135585 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 494 | 4 | 1 | 2 | 5.9 | O=C(N[C@H]1CC[C@H](CN2C(=O)C3(CC3)c3cc(F)ccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 10429933 | 76285 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 381 | 5 | 0 | 5 | 4.6 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058594 | 76285 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 381 | 5 | 0 | 5 | 4.6 | CC[C@H](C1CC1)n1c(=O)c(C)nc2c(-c3cc(F)c(OC)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 70692700 | 76283 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 433 | 6 | 0 | 5 | 5.7 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC(F)F)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058592 | 76283 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Functional | ChEMBL | 433 | 6 | 0 | 5 | 5.7 | CCC(C1CC1)n1c(=O)c(C)nc2c(-c3cc(Cl)c(OC(F)F)cc3C)ccnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 21984718 | 77546 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087554 | 77546 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | ||
| 44816141 | 126476 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 469 | 5 | 2 | 4 | 4.1 | O=C(N[C@H]1CC[C@H](Cn2ccc(N3CCNC3=O)n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652055 | 126476 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 469 | 5 | 2 | 4 | 4.1 | O=C(N[C@H]1CC[C@H](Cn2ccc(N3CCNC3=O)n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 59186860 | 126499 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 468 | 5 | 3 | 3 | 5.8 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3ccc(F)cc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3652078 | 126499 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 468 | 5 | 3 | 3 | 5.8 | O=C(N[C@H]1CC[C@H](CNc2n[nH]c3ccc(F)cc23)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 53341470 | 135387 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 451 | 4 | 1 | 3 | 4.6 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3cccnc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3727930 | 135387 | 0 | None | - | 1 | Human | 6.1 | pIC50 | = | 6.1 | Functional | ChEMBL | 451 | 4 | 1 | 3 | 4.6 | O=C(N[C@H]1CC[C@H](CN2C(=O)Cc3cccnc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 53341172 | 136184 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 451 | 4 | 2 | 3 | 5.0 | O=C(N[C@H]1CC[C@H](Cn2c(=O)[nH]c3ccccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| CHEMBL3732765 | 136184 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 451 | 4 | 2 | 3 | 5.0 | O=C(N[C@H]1CC[C@H](Cn2c(=O)[nH]c3ccccc32)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | ||
| 71456850 | 81516 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 424 | 9 | 0 | 6 | 5.2 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160166 | 81516 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 424 | 9 | 0 | 6 | 5.2 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 9822241 | 64009 | 8 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 399 | 8 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | ||
| CHEMBL1807053 | 64009 | 8 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 399 | 8 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | ||
| 70692845 | 76607 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 422 | 10 | 0 | 5 | 6.0 | CCCN(CCC)c1cccc2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| CHEMBL2063368 | 76607 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 422 | 10 | 0 | 5 | 6.0 | CCCN(CCC)c1cccc2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | ||
| 70692701 | 76296 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 392 | 5 | 0 | 6 | 4.1 | CC[C@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| CHEMBL2058605 | 76296 | 0 | None | - | 1 | Rat | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 392 | 5 | 0 | 6 | 4.1 | CC[C@H](COC)n1c(=O)c(C)nc2c(-c3ccc(Cl)cc3Cl)ncnc21 | 10.1016/j.bmcl.2012.06.034 | ||
| 59186874 | 126523 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 389 | 7 | 3 | 4 | 4.1 | CCCc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n[nH]1 | nan | ||
| CHEMBL3652101 | 126523 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 389 | 7 | 3 | 4 | 4.1 | CCCc1cc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n[nH]1 | nan | ||
| 71462234 | 81522 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 452 | 11 | 0 | 6 | 6.0 | CCCN(CCC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| CHEMBL2160171 | 81522 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7 | Functional | ChEMBL | 452 | 11 | 0 | 6 | 6.0 | CCCN(CCC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | ||
| 11223423 | 189542 | 30 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 404 | 4 | 1 | 6 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | ||
| CHEMBL514270 | 189542 | 30 | None | - | 1 | Human | 7.1 | pKd | = | 7.1 | Functional | ChEMBL | 404 | 4 | 1 | 6 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | ||
| 11546255 | 188117 | 0 | None | - | 0 | Human | 9.7 | pKi | = | 9.7 | Functional | ChEMBL | 419 | 5 | 0 | 7 | 4.9 | CCC(CC)c1cc(C)nn2c(-c3sc(N4CCOCC4)nc3Cl)c(C)nc12 | 10.1021/jm200365y | ||
| CHEMBL498311 | 188117 | 0 | None | - | 0 | Human | 9.7 | pKi | = | 9.7 | Functional | ChEMBL | 419 | 5 | 0 | 7 | 4.9 | CCC(CC)c1cc(C)nn2c(-c3sc(N4CCOCC4)nc3Cl)c(C)nc12 | 10.1021/jm200365y | ||
| 54591779 | 66030 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 429 | 8 | 1 | 7 | 4.6 | COc1cc(OC(F)F)ccc1-n1c(C)nc2c(NC(C3CC3)C3CC3)nc(C)nc21 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836947 | 66030 | 0 | None | - | 0 | Human | 9.5 | pKi | = | 9.5 | Functional | ChEMBL | 429 | 8 | 1 | 7 | 4.6 | COc1cc(OC(F)F)ccc1-n1c(C)nc2c(NC(C3CC3)C3CC3)nc(C)nc21 | 10.1016/j.bmcl.2011.08.040 | ||
| 44545165 | 66028 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | Functional | ChEMBL | 433 | 7 | 1 | 6 | 5.3 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3Cl)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836945 | 66028 | 0 | None | - | 0 | Human | 9.4 | pKi | = | 9.4 | Functional | ChEMBL | 433 | 7 | 1 | 6 | 5.3 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3Cl)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 9821586 | 168103 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1021/jm200365y | ||
| CHEMBL432800 | 168103 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1021/jm200365y | ||
| 9884878 | 173025 | 18 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL45187 | 173025 | 18 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Functional | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2011.08.040 | ||
| 11509708 | 18992 | 3 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CC[C@@H](Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287905 | 18992 | 3 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CC[C@@H](Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| 11509709 | 19002 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CCC(Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nnc(C)o1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287996 | 19002 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CCC(Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nnc(C)o1 | 10.1016/j.bmcl.2010.10.095 | ||
| 45485065 | 197030 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 378 | 7 | 0 | 7 | 3.5 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C#N)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL567164 | 197030 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7 | Functional | ChEMBL | 378 | 7 | 0 | 7 | 3.5 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C#N)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 56663539 | 63939 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1c(C)ncc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1021/jm200365y | ||
| CHEMBL1806727 | 63939 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1c(C)ncc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1021/jm200365y | ||
| 9980466 | 154128 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 436 | 9 | 1 | 6 | 5.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1021/jm200365y | ||
| CHEMBL398531 | 154128 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 436 | 9 | 1 | 6 | 5.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1021/jm200365y | ||
| 10255153 | 77559 | 8 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087549 | 77559 | 8 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| CHEMBL2087567 | 77559 | 8 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | ||
| 56835113 | 69617 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 408 | 8 | 0 | 5 | 5.7 | CCCCN(CC)c1nc(C)nc2c1c(C)c(COC)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2011.10.066 | ||
| CHEMBL1934751 | 69617 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 408 | 8 | 0 | 5 | 5.7 | CCCCN(CC)c1nc(C)nc2c1c(C)c(COC)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2011.10.066 | ||
| 56672697 | 66023 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 367 | 5 | 1 | 5 | 4.7 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(Cl)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836940 | 66023 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 367 | 5 | 1 | 5 | 4.7 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(Cl)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 45485057 | 197008 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6.0 | Functional | ChEMBL | 355 | 6 | 2 | 7 | 2.9 | CC[C@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL566939 | 197008 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6.0 | Functional | ChEMBL | 355 | 6 | 2 | 7 | 2.9 | CC[C@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 45485022 | 197065 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 369 | 7 | 0 | 7 | 3.2 | CCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL567383 | 197065 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 369 | 7 | 0 | 7 | 3.2 | CCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 44446725 | 168953 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | ||
| CHEMBL438888 | 168953 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | ||
| 3496 | 1180 | 42 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | ||
| 9862166 | 1180 | 42 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | ||
| CHEMBL270948 | 1180 | 42 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | ||
| 3496 | 1180 | 42 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | ||
| 9862166 | 1180 | 42 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | ||
| CHEMBL270948 | 1180 | 42 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | ||
| 3520 | 3267 | 54 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2011.08.040 | ||
| 9821250 | 3267 | 54 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL309138 | 3267 | 54 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2011.08.040 | ||
| 44545284 | 66029 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 397 | 6 | 1 | 6 | 4.7 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(Cl)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836946 | 66029 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 397 | 6 | 1 | 6 | 4.7 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(Cl)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| 45485056 | 197007 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 422 | 8 | 2 | 10 | 3.4 | CCCNCc1nc(Nc2nc(C)nc3c2c(C)nn3-c2ccc(OC)cc2C)no1 | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL566938 | 197007 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 422 | 8 | 2 | 10 | 3.4 | CCCNCc1nc(Nc2nc(C)nc3c2c(C)nn3-c2ccc(OC)cc2C)no1 | 10.1016/j.bmcl.2009.09.016 | ||
| 45485032 | 197002 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 369 | 7 | 1 | 7 | 3.0 | CCCN(CCO)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL566910 | 197002 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 369 | 7 | 1 | 7 | 3.0 | CCCN(CCO)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 45485040 | 197284 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 383 | 8 | 0 | 7 | 3.6 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL568606 | 197284 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 383 | 8 | 0 | 7 | 3.6 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 45485040 | 197284 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 383 | 8 | 0 | 7 | 3.6 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL568606 | 197284 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 383 | 8 | 0 | 7 | 3.6 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2011.08.040 | ||
| 45484977 | 197290 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 383 | 9 | 1 | 7 | 4.1 | CCCC(CCOC)Nc1nc(C)nc2c1cnn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL568656 | 197290 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 383 | 9 | 1 | 7 | 4.1 | CCCC(CCOC)Nc1nc(C)nc2c1cnn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 45485009 | 198436 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 369 | 7 | 1 | 7 | 3.6 | CC[C@@H](COC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL577239 | 198436 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 369 | 7 | 1 | 7 | 3.6 | CC[C@@H](COC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 44543774 | 66016 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 377 | 6 | 1 | 6 | 4.4 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(C)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836933 | 66016 | 0 | None | - | 0 | Human | 7.9 | pKi | = | 7.9 | Functional | ChEMBL | 377 | 6 | 1 | 6 | 4.4 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(C)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| 56658150 | 65617 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 411 | 6 | 1 | 7 | 3.4 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(S(C)(=O)=O)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1834003 | 65617 | 0 | None | - | 0 | Human | 6.9 | pKi | = | 6.9 | Functional | ChEMBL | 411 | 6 | 1 | 7 | 3.4 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(S(C)(=O)=O)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 45485033 | 197003 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 410 | 7 | 0 | 7 | 3.1 | CCCN(CC(=O)N(C)C)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL566911 | 197003 | 0 | None | - | 0 | Human | 5.9 | pKi | = | 5.9 | Functional | ChEMBL | 410 | 7 | 0 | 7 | 3.1 | CCCN(CC(=O)N(C)C)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 56682683 | 66017 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 393 | 8 | 1 | 7 | 3.9 | COCc1nc2c(NC(C3CC3)C3CC3)nc(C)nc2n1-c1ccc(OC)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836934 | 66017 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 393 | 8 | 1 | 7 | 3.9 | COCc1nc2c(NC(C3CC3)C3CC3)nc(C)nc2n1-c1ccc(OC)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| 18691322 | 4661 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 397 | 2 | 0 | 5 | 5.1 | Cc1cc(C)c(-n2nnc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(C)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10315 | 4661 | 0 | None | - | 0 | Human | 6.8 | pKi | = | 6.8 | Functional | ChEMBL | 397 | 2 | 0 | 5 | 5.1 | Cc1cc(C)c(-n2nnc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(C)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 45484988 | 197301 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 400 | 9 | 0 | 9 | 2.7 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)nc1OC | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL568685 | 197301 | 0 | None | - | 0 | Human | 7.8 | pKi | = | 7.8 | Functional | ChEMBL | 400 | 9 | 0 | 9 | 2.7 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)nc1OC | 10.1016/j.bmcl.2009.09.016 | ||
| 45484992 | 198902 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 397 | 8 | 0 | 8 | 3.1 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1cnc(N(C)C)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL584472 | 198902 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 397 | 8 | 0 | 8 | 3.1 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1cnc(N(C)C)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 54591854 | 66015 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836932 | 66015 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| 45485023 | 198752 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL583005 | 198752 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 3533 | 1206 | 24 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1021/jm200365y | ||
| 5282340 | 1206 | 24 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1021/jm200365y | ||
| CHEMBL291657 | 1206 | 24 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1021/jm200365y | ||
| 3499 | 1448 | 28 | None | -25 | 2 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm200365y | ||
| 9909468 | 1448 | 28 | None | -25 | 2 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm200365y | ||
| CHEMBL44698 | 1448 | 28 | None | -25 | 2 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm200365y | ||
| 176157 | 2738 | 28 | None | - | 2 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm200365y | ||
| 3512 | 2738 | 28 | None | - | 2 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm200365y | ||
| CHEMBL45281 | 2738 | 28 | None | - | 2 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm200365y | ||
| 44266581 | 4427 | 0 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 398 | 6 | 1 | 4 | 6.0 | CCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10154 | 4427 | 0 | None | - | 0 | Human | 8.7 | pKi | = | 8.7 | Functional | ChEMBL | 398 | 6 | 1 | 4 | 6.0 | CCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1016/s0960-894x(99)00133-x | ||
| 3495 | 1175 | 28 | None | -14 | 2 | Human | 8.6 | pKi | = | 8.6 | Functional | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(99)00133-x | ||
| 5311055 | 1175 | 28 | None | -14 | 2 | Human | 8.6 | pKi | = | 8.6 | Functional | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL9946 | 1175 | 28 | None | -14 | 2 | Human | 8.6 | pKi | = | 8.6 | Functional | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(99)00133-x | ||
| 56662343 | 66025 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 4.4 | CCOc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836942 | 66025 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 377 | 7 | 1 | 6 | 4.4 | CCOc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| 18691310 | 4607 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 508 | 4 | 1 | 7 | 5.3 | COc1cc(Br)c(-n2c(O)nc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10279 | 4607 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 508 | 4 | 1 | 7 | 5.3 | COc1cc(Br)c(-n2c(O)nc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 44266488 | 98524 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 493 | 4 | 0 | 7 | 5.0 | COc1cc(Br)c(-n2nnc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL276263 | 98524 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 493 | 4 | 0 | 7 | 5.0 | COc1cc(Br)c(-n2nnc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 45485034 | 197004 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 369 | 7 | 1 | 7 | 3.6 | CC[C@H](COC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL566912 | 197004 | 0 | None | - | 0 | Human | 6.7 | pKi | = | 6.7 | Functional | ChEMBL | 369 | 7 | 1 | 7 | 3.6 | CC[C@H](COC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 44446726 | 94834 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 476 | 11 | 0 | 3 | 7.5 | CCCN(CCC)c1c(C)nc(-c2c(CC(F)F)cc(CC(F)F)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | ||
| CHEMBL253699 | 94834 | 0 | None | - | 0 | Human | 7.7 | pKi | = | 7.7 | Functional | ChEMBL | 476 | 11 | 0 | 3 | 7.5 | CCCN(CCC)c1c(C)nc(-c2c(CC(F)F)cc(CC(F)F)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | ||
| 18691303 | 4301 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 512 | 6 | 1 | 7 | 5.9 | COc1cc(Br)c(Nc2nc(C)nc(-c3ccccc3C(F)(F)F)c2[N+](=O)[O-])c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10080 | 4301 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 512 | 6 | 1 | 7 | 5.9 | COc1cc(Br)c(Nc2nc(C)nc(-c3ccccc3C(F)(F)F)c2[N+](=O)[O-])c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 52947302 | 18988 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 392 | 5 | 1 | 8 | 4.2 | COc1ccc(-c2c(C)nn3c(NC(C)c4nc(C)no4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287878 | 18988 | 0 | None | - | 0 | Human | 7.6 | pKi | = | 7.6 | Functional | ChEMBL | 392 | 5 | 1 | 8 | 4.2 | COc1ccc(-c2c(C)nn3c(NC(C)c4nc(C)no4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| 45484976 | 197064 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 420 | 8 | 2 | 9 | 3.3 | CCCNCc1cncn1Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL567382 | 197064 | 0 | None | - | 0 | Human | 5.6 | pKi | = | 5.6 | Functional | ChEMBL | 420 | 8 | 2 | 9 | 3.3 | CCCNCc1cncn1Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 11697131 | 19003 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC(C)Cc4nnc(C)o4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287997 | 19003 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC(C)Cc4nnc(C)o4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| 56682684 | 66021 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 439 | 7 | 1 | 6 | 5.2 | COc1ccc(-n2c(C3CC(F)(F)C3)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836938 | 66021 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 439 | 7 | 1 | 6 | 5.2 | COc1ccc(-n2c(C3CC(F)(F)C3)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| 45485079 | 197091 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 396 | 8 | 1 | 7 | 2.7 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C(N)=O)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL567538 | 197091 | 0 | None | - | 0 | Human | 6.6 | pKi | = | 6.6 | Functional | ChEMBL | 396 | 8 | 1 | 7 | 2.7 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C(N)=O)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 3495 | 1175 | 28 | None | -14 | 2 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | ||
| 5311055 | 1175 | 28 | None | -14 | 2 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | ||
| CHEMBL9946 | 1175 | 28 | None | -14 | 2 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | ||
| 3520 | 3267 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm200365y | ||
| 9821250 | 3267 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm200365y | ||
| CHEMBL309138 | 3267 | 54 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm200365y | ||
| 9955329 | 207830 | 0 | None | - | 0 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 448 | 8 | 0 | 8 | 3.9 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL9633 | 207830 | 0 | None | - | 0 | Human | 8.5 | pKi | = | 8.5 | Functional | ChEMBL | 448 | 8 | 0 | 8 | 3.9 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00133-x | ||
| 9934089 | 5007 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 462 | 9 | 0 | 8 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10504 | 5007 | 0 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 462 | 9 | 0 | 8 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00133-x | ||
| 3520 | 3267 | 54 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2010.10.095 | ||
| 9821250 | 3267 | 54 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL309138 | 3267 | 54 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2010.10.095 | ||
| 56658860 | 66018 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 403 | 8 | 1 | 6 | 4.7 | COc1ccc(-n2c(CC3CC3)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836935 | 66018 | 0 | None | - | 0 | Human | 6.5 | pKi | = | 6.5 | Functional | ChEMBL | 403 | 8 | 1 | 6 | 4.7 | COc1ccc(-n2c(CC3CC3)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| 11509641 | 18993 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 404 | 5 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC4(c5nc(C)no5)CC4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287936 | 18993 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 404 | 5 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC4(c5nc(C)no5)CC4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| 11531570 | 18999 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC(C)Cc4nc(C)no4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287966 | 18999 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC(C)Cc4nc(C)no4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| 45485105 | 197428 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 367 | 8 | 1 | 6 | 4.8 | CCCC(CCC)Nc1nc(C)nc2c1cnn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL569666 | 197428 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 367 | 8 | 1 | 6 | 4.8 | CCCC(CCC)Nc1nc(C)nc2c1cnn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 177990 | 426 | 23 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.bmcl.2011.10.066 | ||
| 3489 | 426 | 23 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.bmcl.2011.10.066 | ||
| CHEMBL296641 | 426 | 23 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.bmcl.2011.10.066 | ||
| 46175148 | 66032 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2ncc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(C)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836950 | 66032 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2ncc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(C)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| 18691329 | 4403 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 506 | 4 | 0 | 6 | 5.9 | COc1cc(Br)c(-n2c(C)nc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10142 | 4403 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 506 | 4 | 0 | 6 | 5.9 | COc1cc(Br)c(-n2c(C)nc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 44266555 | 4460 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 502 | 3 | 0 | 5 | 7.5 | CSc1nn(-c2c(Cl)cc(Cl)cc2Cl)c2nc(C)nc(-c3ccccc3C(F)(F)F)c12 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10174 | 4460 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 502 | 3 | 0 | 5 | 7.5 | CSc1nn(-c2c(Cl)cc(Cl)cc2Cl)c2nc(C)nc(-c3ccccc3C(F)(F)F)c12 | 10.1016/s0960-894x(99)00133-x | ||
| 45485086 | 196924 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 381 | 8 | 1 | 6 | 5.1 | CCCC(CCC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL566279 | 196924 | 0 | None | - | 0 | Human | 7.5 | pKi | = | 7.5 | Functional | ChEMBL | 381 | 8 | 1 | 6 | 5.1 | CCCC(CCC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 10375 | 2739 | 18 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm200365y | ||
| 9888194 | 2739 | 18 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm200365y | ||
| CHEMBL188907 | 2739 | 18 | None | - | 0 | Human | 8.4 | pKi | = | 8.4 | Functional | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm200365y | ||
| 45485080 | 197124 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 420 | 8 | 2 | 9 | 3.3 | CCCNCc1nccn1Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL567741 | 197124 | 0 | None | - | 0 | Human | 6.4 | pKi | = | 6.4 | Functional | ChEMBL | 420 | 8 | 2 | 9 | 3.3 | CCCNCc1nccn1Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 45485073 | 196777 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 353 | 6 | 1 | 6 | 4.4 | CCC(CC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL565442 | 196777 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 353 | 6 | 1 | 6 | 4.4 | CCC(CC)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 45484980 | 197293 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 384 | 8 | 0 | 8 | 3.0 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)nc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL568665 | 197293 | 0 | None | - | 0 | Human | 7.4 | pKi | = | 7.4 | Functional | ChEMBL | 384 | 8 | 0 | 8 | 3.0 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)nc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 56676057 | 66014 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2cnc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(C)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836931 | 66014 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2cnc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(C)c1 | 10.1016/j.bmcl.2011.08.040 | ||
| 44545161 | 66027 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 399 | 7 | 1 | 6 | 4.6 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836944 | 66027 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 399 | 7 | 1 | 6 | 4.6 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 11589539 | 18987 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 406 | 6 | 0 | 8 | 4.0 | CCN(Cc1nc(C)no1)c1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287877 | 18987 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 406 | 6 | 0 | 8 | 4.0 | CCN(Cc1nc(C)no1)c1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2010.10.095 | ||
| 10367821 | 4305 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 478 | 5 | 0 | 4 | 6.9 | CCN(c1nc(C)nc(-c2ccccc2C(F)(F)F)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10082 | 4305 | 0 | None | - | 0 | Human | 8.3 | pKi | = | 8.3 | Functional | ChEMBL | 478 | 5 | 0 | 4 | 6.9 | CCN(c1nc(C)nc(-c2ccccc2C(F)(F)F)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00133-x | ||
| 52944875 | 18998 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 418 | 5 | 1 | 8 | 4.5 | COc1ccc(-c2c(C)nn3c(NC4(c5nc(C)no5)CCC4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287965 | 18998 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 418 | 5 | 1 | 8 | 4.5 | COc1ccc(-c2c(C)nn3c(NC4(c5nc(C)no5)CCC4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| 52947334 | 19007 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 420 | 6 | 1 | 9 | 4.0 | CCC(Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1288027 | 19007 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 420 | 6 | 1 | 9 | 4.0 | CCC(Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| 11531898 | 19012 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 422 | 7 | 1 | 9 | 4.3 | CCC(Nc1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1288058 | 19012 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 422 | 7 | 1 | 9 | 4.3 | CCC(Nc1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| 57390674 | 69616 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 392 | 7 | 0 | 5 | 5.4 | CCCCN(CC)c1nc(C)nc2c1c(C)c(C=O)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2011.10.066 | ||
| CHEMBL1934750 | 69616 | 0 | None | - | 0 | Human | 7.3 | pKi | = | 7.3 | Functional | ChEMBL | 392 | 7 | 0 | 5 | 5.4 | CCCCN(CC)c1nc(C)nc2c1c(C)c(C=O)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2011.10.066 | ||
| 45485042 | 197367 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 369 | 7 | 2 | 7 | 3.3 | CCC[C@@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL569202 | 197367 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 369 | 7 | 2 | 7 | 3.3 | CCC[C@@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 45485008 | 198370 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 397 | 8 | 1 | 8 | 2.1 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C(N)=O)nc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL576639 | 198370 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 397 | 8 | 1 | 8 | 2.1 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C(N)=O)nc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 56835112 | 69615 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 394 | 7 | 1 | 5 | 5.1 | CCCCN(CC)c1nc(C)nc2c1c(C)c(CO)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2011.10.066 | ||
| CHEMBL1934749 | 69615 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 394 | 7 | 1 | 5 | 5.1 | CCCCN(CC)c1nc(C)nc2c1c(C)c(CO)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2011.10.066 | ||
| 10378 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| 11596613 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287935 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| DB12512 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 10.1016/j.bmcl.2010.10.095 | ||
| 18691308 | 4326 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 482 | 5 | 2 | 6 | 5.6 | COc1cc(Br)c(Nc2nc(C)nc(-c3ccccc3C(F)(F)F)c2N)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10091 | 4326 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 482 | 5 | 2 | 6 | 5.6 | COc1cc(Br)c(Nc2nc(C)nc(-c3ccccc3C(F)(F)F)c2N)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 56672696 | 66019 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 405 | 8 | 1 | 6 | 4.9 | COc1ccc(-n2c(CC(C)C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836936 | 66019 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 405 | 8 | 1 | 6 | 4.9 | COc1ccc(-n2c(CC(C)C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| 56682685 | 66022 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 358 | 5 | 1 | 6 | 3.9 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(C#N)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836939 | 66022 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 358 | 5 | 1 | 6 | 3.9 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(C#N)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 45485045 | 197249 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 355 | 6 | 2 | 7 | 2.9 | CC[C@@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL568397 | 197249 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 355 | 6 | 2 | 7 | 2.9 | CC[C@@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 11538121 | 18984 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 378 | 5 | 1 | 8 | 3.6 | COc1ccc(-c2c(C)nn3c(NCc4nc(C)no4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287848 | 18984 | 0 | None | - | 0 | Human | 7.2 | pKi | = | 7.2 | Functional | ChEMBL | 378 | 5 | 1 | 8 | 3.6 | COc1ccc(-c2c(C)nn3c(NCc4nc(C)no4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| 45485078 | 198782 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 389 | 7 | 0 | 8 | 3.0 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C#N)cc1C#N | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL583223 | 198782 | 0 | None | - | 0 | Human | 6.2 | pKi | = | 6.2 | Functional | ChEMBL | 389 | 7 | 0 | 8 | 3.0 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(C#N)cc1C#N | 10.1016/j.bmcl.2009.09.016 | ||
| 44545396 | 66031 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 417 | 7 | 1 | 6 | 4.8 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3F)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836948 | 66031 | 0 | None | - | 0 | Human | 8.2 | pKi | = | 8.2 | Functional | ChEMBL | 417 | 7 | 1 | 6 | 4.8 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3F)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 10377 | 1179 | 27 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | ||
| 9818802 | 1179 | 27 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | ||
| CHEMBL270738 | 1179 | 27 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | ||
| 11545949 | 18991 | 10 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CCC(Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1287904 | 18991 | 10 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.6 | CCC(Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12)c1nc(C)no1 | 10.1016/j.bmcl.2010.10.095 | ||
| 45485064 | 198785 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 3.3 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1OC | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL583237 | 198785 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 399 | 9 | 0 | 8 | 3.3 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1OC | 10.1016/j.bmcl.2009.09.016 | ||
| 45485035 | 196886 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 369 | 7 | 2 | 7 | 3.3 | CCC[C@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL566073 | 196886 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 369 | 7 | 2 | 7 | 3.3 | CCC[C@H](CO)Nc1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 52947738 | 19006 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC(C)Cc4noc(C)n4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| CHEMBL1288026 | 19006 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 406 | 6 | 1 | 8 | 4.1 | COc1ccc(-c2c(C)nn3c(NC(C)Cc4noc(C)n4)cc(C)nc23)c(C)c1 | 10.1016/j.bmcl.2010.10.095 | ||
| 3520 | 3267 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm300259r | ||
| 9821250 | 3267 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm300259r | ||
| CHEMBL309138 | 3267 | 54 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm300259r | ||
| 10377 | 1179 | 27 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | ||
| 9818802 | 1179 | 27 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | ||
| CHEMBL270738 | 1179 | 27 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | ||
| 45485050 | 197206 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 422 | 8 | 2 | 10 | 3.4 | CCCNCc1noc(Nc2nc(C)nc3c2c(C)nn3-c2ccc(OC)cc2C)n1 | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL568188 | 197206 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 422 | 8 | 2 | 10 | 3.4 | CCCNCc1noc(Nc2nc(C)nc3c2c(C)nn3-c2ccc(OC)cc2C)n1 | 10.1016/j.bmcl.2009.09.016 | ||
| 45484981 | 198373 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 339 | 6 | 1 | 6 | 4.0 | CCC(CC)Nc1nc(C)nc2c1cnn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL576664 | 198373 | 0 | None | - | 0 | Human | 7.1 | pKi | = | 7.1 | Functional | ChEMBL | 339 | 6 | 1 | 6 | 4.0 | CCC(CC)Nc1nc(C)nc2c1cnn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 56662342 | 66020 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 419 | 7 | 1 | 7 | 4.6 | COc1ccc(-n2c(C3CCCO3)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836937 | 66020 | 0 | None | - | 0 | Human | 6.1 | pKi | = | 6.1 | Functional | ChEMBL | 419 | 7 | 1 | 7 | 4.6 | COc1ccc(-n2c(C3CCCO3)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | ||
| 24971237 | 188049 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 380 | 8 | 0 | 6 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1021/jm200365y | ||
| CHEMBL497653 | 188049 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 380 | 8 | 0 | 6 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1021/jm200365y | ||
| 22004628 | 198306 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 365 | 6 | 0 | 5 | 5.0 | CCCCN(CC)c1nc(C)nc2c1c(C)nn2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL576049 | 198306 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 365 | 6 | 0 | 5 | 5.0 | CCCCN(CC)c1nc(C)nc2c1c(C)nn2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2009.09.016 | ||
| 56672698 | 66026 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 417 | 6 | 1 | 6 | 4.9 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)(F)F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836943 | 66026 | 0 | None | - | 0 | Human | 8.1 | pKi | = | 8.1 | Functional | ChEMBL | 417 | 6 | 1 | 6 | 4.9 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)(F)F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 18691298 | 98159 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 423 | 2 | 0 | 3 | 7.0 | Cc1cc(C)c(-n2c(C)c(C)c3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(C)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL273839 | 98159 | 0 | None | - | 0 | Human | 8.0 | pKi | = | 8.0 | Functional | ChEMBL | 423 | 2 | 0 | 3 | 7.0 | Cc1cc(C)c(-n2c(C)c(C)c3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(C)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 44545281 | 66024 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 351 | 5 | 1 | 5 | 4.2 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| CHEMBL1836941 | 66024 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 351 | 5 | 1 | 5 | 4.2 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | ||
| 18691301 | 4324 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 522 | 4 | 0 | 7 | 4.9 | COc1cc(Br)c(-n2c(=O)n(C)c3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| CHEMBL10090 | 4324 | 0 | None | - | 0 | Human | 7.0 | pKi | = | 7.0 | Functional | ChEMBL | 522 | 4 | 0 | 7 | 4.9 | COc1cc(Br)c(-n2c(=O)n(C)c3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(OC)c1 | 10.1016/s0960-894x(99)00133-x | ||
| 45485041 | 197285 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 422 | 8 | 2 | 10 | 3.4 | CCCNCc1nnc(Nc2nc(C)nc3c2c(C)nn3-c2ccc(OC)cc2C)o1 | 10.1016/j.bmcl.2009.09.016 | ||
| CHEMBL568607 | 197285 | 0 | None | - | 0 | Human | 6.0 | pKi | = | 6 | Functional | ChEMBL | 422 | 8 | 2 | 10 | 3.4 | CCCNCc1nnc(Nc2nc(C)nc3c2c(C)nn3-c2ccc(OC)cc2C)o1 | 10.1016/j.bmcl.2009.09.016 | ||
| 10379 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | ||
| 9884366 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | ||
| CHEMBL482950 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | ||
| DB12572 | 3059 | 39 | None | -1 | 3 | Rat | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | ||
| 3498 | 1204 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | Guide to Pharmacology | 476 | 7 | 0 | 5 | 7.2 | CCN(c1ccc(cc1SC)C(C)C)c1nc(cc(n1)C)N1CCC(=CC1)c1cccc(c1)F | 10357258 | ||
| 9849313 | 1204 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | Guide to Pharmacology | 476 | 7 | 0 | 5 | 7.2 | CCN(c1ccc(cc1SC)C(C)C)c1nc(cc(n1)C)N1CCC(=CC1)c1cccc(c1)F | 10357258 | ||
| CHEMBL297986 | 1204 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Functional | Guide to Pharmacology | 476 | 7 | 0 | 5 | 7.2 | CCN(c1ccc(cc1SC)C(C)C)c1nc(cc(n1)C)N1CCC(=CC1)c1cccc(c1)F | 10357258 | ||
| 3496 | 1180 | 42 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18288792 | ||
| 9862166 | 1180 | 42 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18288792 | ||
| CHEMBL270948 | 1180 | 42 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Functional | Guide to Pharmacology | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18288792 | ||
| 10376 | 2930 | 4 | None | 1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 21865047 | ||
| 9801039 | 2930 | 4 | None | 1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 21865047 | ||
| CHEMBL1819077 | 2930 | 4 | None | 1 | 2 | Human | 8.4 | pIC50 | = | 8.4 | Functional | Guide to Pharmacology | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 21865047 | ||
| 16133798 | 506 | 0 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | Guide to Pharmacology | None | None | None | None | 12361401 | ||||
| 925 | 506 | 0 | None | -1 | 2 | Human | 9.1 | pIC50 | = | 9.1 | Functional | Guide to Pharmacology | None | None | None | None | 12361401 | ||||
| 3495 | 1175 | 28 | None | 14 | 2 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 8874139 | ||
| 5311055 | 1175 | 28 | None | 14 | 2 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 8874139 | ||
| CHEMBL9946 | 1175 | 28 | None | 14 | 2 | Rat | 9.9 | pIC50 | = | 9.9 | Functional | Guide to Pharmacology | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 8874139 | ||
| 10335 | 507 | 0 | None | -389 | 2 | Human | 6.3 | pIC50 | > | 6.3 | Functional | Guide to Pharmacology | None | None | None | None | 12361401 | ||||
| 90488758 | 507 | 0 | None | -389 | 2 | Human | 6.3 | pIC50 | > | 6.3 | Functional | Guide to Pharmacology | None | None | None | None | 12361401 | ||||
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Similar- ity |
Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
Assay Type |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
| CHEMBL264275 | 210611 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL442112 | 213906 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL263862 | 210596 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL427923 | 213394 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL427811 | 213386 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL437089 | 213704 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438391 | 213768 | 0 | None | - | 0 | Mouse | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL414130 | 213112 | 0 | None | - | 0 | Mouse | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL439883 | 213849 | 0 | None | - | 1 | Mouse | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438220 | 213756 | 0 | None | - | 0 | Mouse | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL410568 | 212826 | 0 | None | - | 0 | Mouse | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| 44362115 | 1169 | 0 | None | - | 0 | Mouse | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm049490m | |||||
| 6967 | 1169 | 0 | None | - | 0 | Mouse | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm049490m | |||||
| CHEMBL1201609 | 1169 | 0 | None | - | 0 | Mouse | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm049490m | |||||
| CHEMBL440057 | 1169 | 0 | None | - | 0 | Mouse | 7.7 | pEC50 | = | 7.7 | Binding | ChEMBL | None | None | None | None | 10.1021/jm049490m | |||||
| CHEMBL428127 | 213417 | 0 | None | - | 0 | Mouse | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL415130 | 213170 | 0 | None | - | 0 | Mouse | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438601 | 213782 | 0 | None | - | 0 | Mouse | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL412296 | 212982 | 0 | None | - | 0 | Mouse | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL429403 | 213528 | 0 | None | - | 0 | Mouse | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL427611 | 213355 | 0 | None | - | 0 | Mouse | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL428809 | 213474 | 0 | None | - | 0 | Mouse | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL268549 | 210758 | 0 | None | - | 0 | Mouse | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL428296 | 213435 | 0 | None | - | 0 | Mouse | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL409748 | 212781 | 0 | None | - | 0 | Mouse | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL427792 | 213383 | 0 | None | - | 0 | Mouse | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438760 | 213794 | 0 | None | - | 0 | Mouse | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL413414 | 213064 | 0 | None | - | 0 | Mouse | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL267635 | 210726 | 0 | None | - | 0 | Mouse | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL429547 | 213539 | 0 | None | - | 0 | Mouse | 6.3 | pEC50 | = | 6.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL410814 | 212844 | 0 | None | - | 0 | Mouse | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL429719 | 213543 | 0 | None | - | 0 | Mouse | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438210 | 213754 | 0 | None | - | 0 | Mouse | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL411590 | 212950 | 0 | None | - | 0 | Mouse | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438948 | 213816 | 0 | None | - | 0 | Mouse | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438928 | 213812 | 0 | None | - | 0 | Mouse | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL412026 | 212971 | 0 | None | - | 0 | Mouse | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL437289 | 213715 | 0 | None | - | 0 | Mouse | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL439102 | 213822 | 0 | None | - | 0 | Mouse | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL438939 | 213815 | 0 | None | - | 0 | Mouse | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL428824 | 213477 | 0 | None | - | 0 | Mouse | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL436912 | 213696 | 0 | None | - | 0 | Mouse | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL436914 | 213697 | 0 | None | - | 0 | Mouse | 7.1 | pEC50 | = | 7.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL430078 | 213608 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL441929 | 213902 | 0 | None | - | 0 | Mouse | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL414711 | 213148 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| CHEMBL410347 | 212813 | 0 | None | - | 0 | Mouse | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1021/jm049490m | |||||
| 44596586 | 198776 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 398 | 7 | 1 | 6 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL583153 | 198776 | 0 | None | - | 0 | Rat | 9.7 | pIC50 | = | 9.7 | Binding | ChEMBL | 398 | 7 | 1 | 6 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| 44596589 | 198164 | 3 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL574852 | 198164 | 3 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| 44596589 | 198164 | 3 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL574852 | 198164 | 3 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 44194976 | 195934 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL559437 | 195934 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 44194976 | 195934 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL559437 | 195934 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 44194976 | 195934 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900302q | |||
| CHEMBL559437 | 195934 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900302q | |||
| 44190059 | 195249 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL551033 | 195249 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 44596809 | 198891 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 362 | 6 | 1 | 6 | 4.0 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL584343 | 198891 | 0 | None | - | 0 | Rat | 9.6 | pIC50 | = | 9.6 | Binding | ChEMBL | 362 | 6 | 1 | 6 | 4.0 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| 44596589 | 198164 | 3 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL574852 | 198164 | 3 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| 44190148 | 196006 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL560036 | 196006 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 44596812 | 198804 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 384 | 6 | 1 | 6 | 4.2 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1021/jm900716v | |||
| CHEMBL583387 | 198804 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 384 | 6 | 1 | 6 | 4.2 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1021/jm900716v | |||
| 44596812 | 198804 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 384 | 6 | 1 | 6 | 4.2 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL583387 | 198804 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 384 | 6 | 1 | 6 | 4.2 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2010.01.129 | |||
| 11420978 | 11764 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 402 | 7 | 1 | 5 | 4.8 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL1181645 | 11764 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 402 | 7 | 1 | 5 | 4.8 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL187073 | 11764 | 0 | None | - | 0 | Rat | 9.5 | pIC50 | = | 9.5 | Binding | ChEMBL | 402 | 7 | 1 | 5 | 4.8 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1Cl | 10.1021/jm049737f | |||
| 44190143 | 194841 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 347 | 5 | 1 | 5 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900301y | |||
| CHEMBL539670 | 194841 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 347 | 5 | 1 | 5 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900301y | |||
| 44190143 | 194841 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 347 | 5 | 1 | 5 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900302q | |||
| CHEMBL539670 | 194841 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 347 | 5 | 1 | 5 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900302q | |||
| 44190915 | 196004 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 401 | 6 | 1 | 5 | 5.3 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL560033 | 196004 | 0 | None | - | 0 | Rat | 9.4 | pIC50 | = | 9.4 | Binding | ChEMBL | 401 | 6 | 1 | 5 | 5.3 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 71580213 | 88432 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 409 | 9 | 1 | 6 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@@H](COCCF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349558 | 88432 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 409 | 9 | 1 | 6 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@@H](COCCF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| 71580215 | 88434 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 493 | 9 | 1 | 6 | 5.0 | COc1cc(Cl)c(Nc2nc(Br)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349560 | 88434 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 493 | 9 | 1 | 6 | 5.0 | COc1cc(Cl)c(Nc2nc(Br)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| 44190828 | 196309 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 423 | 6 | 1 | 5 | 5.5 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL562218 | 196309 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 423 | 6 | 1 | 5 | 5.5 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 11384238 | 66850 | 0 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 5.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL186203 | 66850 | 0 | None | - | 1 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 5.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049737f | |||
| 44596588 | 197864 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL572589 | 197864 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| 9931946 | 11770 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 420 | 7 | 1 | 5 | 4.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1cc(F)c(OC)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL1181679 | 11770 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 420 | 7 | 1 | 5 | 4.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1cc(F)c(OC)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL188464 | 11770 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 420 | 7 | 1 | 5 | 4.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1cc(F)c(OC)cc1Cl | 10.1021/jm049737f | |||
| 45266992 | 196076 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL560634 | 196076 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 44190242 | 195209 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 385 | 5 | 1 | 4 | 5.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(Cl)cc2Cl)c1=O | 10.1021/jm900301y | |||
| CHEMBL550686 | 195209 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 385 | 5 | 1 | 4 | 5.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(Cl)cc2Cl)c1=O | 10.1021/jm900301y | |||
| 44190242 | 195209 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 385 | 5 | 1 | 4 | 5.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(Cl)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL550686 | 195209 | 0 | None | - | 0 | Rat | 9.3 | pIC50 | = | 9.3 | Binding | ChEMBL | 385 | 5 | 1 | 4 | 5.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(Cl)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 44190144 | 195465 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 365 | 7 | 1 | 6 | 3.9 | CC[C@H](COC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL552504 | 195465 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 365 | 7 | 1 | 6 | 3.9 | CC[C@H](COC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 71580214 | 88433 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 449 | 9 | 1 | 6 | 4.9 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349559 | 88433 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 449 | 9 | 1 | 6 | 4.9 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| 71580426 | 88443 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 345 | 6 | 1 | 5 | 3.8 | COc1cc(C)c(Nc2nc(C)cn([C@@H](CF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349570 | 88443 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 345 | 6 | 1 | 5 | 3.8 | COc1cc(C)c(Nc2nc(C)cn([C@@H](CF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| 44190058 | 196044 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 377 | 8 | 1 | 5 | 5.4 | CCCC(CCC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL560350 | 196044 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 377 | 8 | 1 | 5 | 5.4 | CCCC(CCC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 44190446 | 196678 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 379 | 4 | 0 | 5 | 4.2 | COc1cc(Cl)c2c(c1)CCN2c1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| CHEMBL564588 | 196678 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 379 | 4 | 0 | 5 | 4.2 | COc1cc(Cl)c2c(c1)CCN2c1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| 44189950 | 196509 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 345 | 5 | 1 | 4 | 4.9 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL563489 | 196509 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 345 | 5 | 1 | 4 | 4.9 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 44189950 | 196509 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 345 | 5 | 1 | 4 | 4.9 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900302q | |||
| CHEMBL563489 | 196509 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 345 | 5 | 1 | 4 | 4.9 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900302q | |||
| 56961965 | 81997 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 425 | 8 | 1 | 7 | 3.2 | COCC(COC)n1cc(Br)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165202 | 81997 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 425 | 8 | 1 | 7 | 3.2 | COCC(COC)n1cc(Br)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 46881748 | 6925 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 361 | 5 | 1 | 6 | 3.7 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1N(C)C | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1084423 | 6925 | 0 | None | - | 0 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 361 | 5 | 1 | 6 | 3.7 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1N(C)C | 10.1016/j.bmcl.2010.01.129 | |||
| 10027220 | 66865 | 0 | None | - | 1 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.0 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1021/jm049737f | |||
| CHEMBL186252 | 66865 | 0 | None | - | 1 | Rat | 9.2 | pIC50 | = | 9.2 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.0 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1021/jm049737f | |||
| 44610627 | 139975 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 519 | 9 | 2 | 8 | 5.5 | Cc1cc(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799870 | 139975 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 519 | 9 | 2 | 8 | 5.5 | Cc1cc(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2016.03.067 | |||
| 46881834 | 7742 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 400 | 8 | 1 | 7 | 3.5 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2ccc(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1089036 | 7742 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 400 | 8 | 1 | 7 | 3.5 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2ccc(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 44190057 | 195548 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 349 | 6 | 1 | 5 | 4.6 | CCC(CC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL554517 | 195548 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 349 | 6 | 1 | 5 | 4.6 | CCC(CC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 45483573 | 198165 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 395 | 6 | 1 | 7 | 3.8 | Cc1nc(OC(F)F)c(C#N)cc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900716v | |||
| CHEMBL574853 | 198165 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 395 | 6 | 1 | 7 | 3.8 | Cc1nc(OC(F)F)c(C#N)cc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900716v | |||
| 10363553 | 66826 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 399 | 8 | 1 | 7 | 3.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| CHEMBL186097 | 66826 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 399 | 8 | 1 | 7 | 3.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| 10363553 | 66826 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 399 | 8 | 1 | 7 | 3.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1OC | 10.1021/jm049737f | |||
| CHEMBL186097 | 66826 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 399 | 8 | 1 | 7 | 3.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1OC | 10.1021/jm049737f | |||
| 45483574 | 198034 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 425 | 8 | 1 | 8 | 3.4 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C#N)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL573978 | 198034 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 425 | 8 | 1 | 8 | 3.4 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C#N)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| 44190145 | 195208 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 351 | 6 | 1 | 6 | 3.5 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL550685 | 195208 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 351 | 6 | 1 | 6 | 3.5 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 46891155 | 7236 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 342 | 6 | 1 | 6 | 3.7 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1085753 | 7236 | 0 | None | - | 0 | Rat | 9.1 | pIC50 | = | 9.1 | Binding | ChEMBL | 342 | 6 | 1 | 6 | 3.7 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 44191013 | 196248 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 391 | 4 | 1 | 4 | 5.6 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL561758 | 196248 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 391 | 4 | 1 | 4 | 5.6 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 11752878 | 12263 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 414 | 7 | 1 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL1184703 | 12263 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 414 | 7 | 1 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL364883 | 12263 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 414 | 7 | 1 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| 11417694 | 67453 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL189089 | 67453 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| 11417694 | 67453 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm049737f | |||
| CHEMBL189089 | 67453 | 0 | None | - | 1 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm049737f | |||
| 44190447 | 196304 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 423 | 4 | 0 | 5 | 4.3 | COc1cc(Br)c2c(c1)CCN2c1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| CHEMBL562161 | 196304 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 423 | 4 | 0 | 5 | 4.3 | COc1cc(Br)c2c(c1)CCN2c1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| 44191012 | 196236 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 351 | 4 | 1 | 4 | 4.9 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1021/jm900302q | |||
| CHEMBL561698 | 196236 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 351 | 4 | 1 | 4 | 4.9 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1021/jm900302q | |||
| 42618183 | 179813 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 393 | 8 | 0 | 7 | 3.9 | C=CCN(CC=C)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474498 | 179813 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 393 | 8 | 0 | 7 | 3.9 | C=CCN(CC=C)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618197 | 184306 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 391 | 6 | 1 | 6 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL484158 | 184306 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 391 | 6 | 1 | 6 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| 44194975 | 196310 | 16 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 423 | 6 | 1 | 5 | 5.5 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL562219 | 196310 | 16 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 423 | 6 | 1 | 5 | 5.5 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 71580425 | 88442 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 365 | 6 | 1 | 5 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@@H](CF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349569 | 88442 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 365 | 6 | 1 | 5 | 4.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@@H](CF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| 44596808 | 198240 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 378 | 7 | 1 | 7 | 3.3 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL575491 | 198240 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 378 | 7 | 1 | 7 | 3.3 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| 46891337 | 6410 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 395 | 8 | 1 | 8 | 2.9 | COCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082349 | 6410 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 395 | 8 | 1 | 8 | 2.9 | COCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891439 | 7067 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 395 | 8 | 1 | 8 | 2.9 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084987 | 7067 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 395 | 8 | 1 | 8 | 2.9 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 44190826 | 194820 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 387 | 5 | 1 | 5 | 4.9 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1021/jm900301y | |||
| CHEMBL539184 | 194820 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 387 | 5 | 1 | 5 | 4.9 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1021/jm900301y | |||
| 44190826 | 194820 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 387 | 5 | 1 | 5 | 4.9 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1021/jm900302q | |||
| CHEMBL539184 | 194820 | 0 | None | - | 0 | Rat | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | 387 | 5 | 1 | 5 | 4.9 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1021/jm900302q | |||
| 42618199 | 184164 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 437 | 9 | 0 | 8 | 3.3 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL482982 | 184164 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 437 | 9 | 0 | 8 | 3.3 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618197 | 184306 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 391 | 6 | 1 | 6 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL484158 | 184306 | 0 | None | - | 0 | Human | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 391 | 6 | 1 | 6 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| 3499 | 1448 | 28 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.bmcl.2016.03.067 | |||
| 9909468 | 1448 | 28 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.bmcl.2016.03.067 | |||
| 127047546 | 139658 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 441 | 8 | 1 | 8 | 4.1 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3ccccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3797830 | 139658 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 441 | 8 | 1 | 8 | 4.1 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3ccccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 46881792 | 7334 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 402 | 5 | 1 | 6 | 4.3 | COc1nc(C(F)(F)F)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1086179 | 7334 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 402 | 5 | 1 | 6 | 4.3 | COc1nc(C(F)(F)F)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.01.129 | |||
| 46881793 | 7336 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 370 | 6 | 1 | 6 | 3.9 | Cc1nc(OC(F)F)ccc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1086180 | 7336 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 370 | 6 | 1 | 6 | 3.9 | Cc1nc(OC(F)F)ccc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 46881835 | 7743 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 400 | 8 | 1 | 7 | 3.5 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2ccc(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1089037 | 7743 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 400 | 8 | 1 | 7 | 3.5 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2ccc(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 44190149 | 195060 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 5.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| CHEMBL549538 | 195060 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 5.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| 44190450 | 195658 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 4.1 | COc1ccc(Nc2nc(Br)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL556462 | 195658 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 4.1 | COc1ccc(Nc2nc(Br)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL1077301 | 208491 | 0 | None | - | 2 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(N)=O | 10.1016/j.bmcl.2010.01.129 | |||||
| 42618181 | 184358 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 369 | 6 | 0 | 7 | 3.6 | CCN(CC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL484420 | 184358 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 369 | 6 | 0 | 7 | 3.6 | CCN(CC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 3499 | 1448 | 28 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm900302q | |||
| 9909468 | 1448 | 28 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm900302q | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm900302q | |||
| 44190149 | 195060 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 5.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL549538 | 195060 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 5.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 44190829 | 195301 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 371 | 4 | 1 | 4 | 5.2 | Cc1cc(Cl)cc(Cl)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900302q | |||
| CHEMBL551433 | 195301 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 371 | 4 | 1 | 4 | 5.2 | Cc1cc(Cl)cc(Cl)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900302q | |||
| 44190913 | 195945 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.6 | CCOc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900302q | |||
| CHEMBL559507 | 195945 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.6 | CCOc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900302q | |||
| 11246513 | 66860 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 397 | 6 | 1 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL186241 | 66860 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 397 | 6 | 1 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL526149 | 215675 | 10 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(N)=O | 10.1021/jm9000242 | |||||
| 44629380 | 139886 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 508 | 8 | 2 | 9 | 4.7 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cccc(C#N)c3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799337 | 139886 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 508 | 8 | 2 | 9 | 4.7 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cccc(C#N)c3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44189947 | 195100 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.2 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL549875 | 195100 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.2 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 44191008 | 196257 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 439 | 5 | 1 | 4 | 6.3 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL561819 | 196257 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 439 | 5 | 1 | 4 | 6.3 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 45483576 | 198365 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 425 | 8 | 1 | 8 | 3.4 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C#N)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL576589 | 198365 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 425 | 8 | 1 | 8 | 3.4 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C#N)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| 44189951 | 195027 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 349 | 6 | 1 | 5 | 4.2 | CC[C@H](COC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL549329 | 195027 | 0 | None | - | 0 | Rat | 8.9 | pIC50 | = | 8.9 | Binding | ChEMBL | 349 | 6 | 1 | 5 | 4.2 | CC[C@H](COC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 44591500 | 189732 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 4.1 | CCCN(c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12)C1CC1 | 10.1021/jm9000242 | |||
| CHEMBL515740 | 189732 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 4.1 | CCCN(c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12)C1CC1 | 10.1021/jm9000242 | |||
| 44596810 | 198002 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 348 | 5 | 1 | 6 | 3.6 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900716v | |||
| CHEMBL573748 | 198002 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 348 | 5 | 1 | 6 | 3.6 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900716v | |||
| 44596807 | 198097 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 378 | 7 | 1 | 7 | 3.3 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL574436 | 198097 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 378 | 7 | 1 | 7 | 3.3 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| 44629379 | 139685 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 517 | 8 | 2 | 8 | 5.5 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3Cl)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3797992 | 139685 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 517 | 8 | 2 | 8 | 5.5 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3Cl)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44629309 | 139819 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 483 | 8 | 2 | 8 | 4.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3798885 | 139819 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 483 | 8 | 2 | 8 | 4.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccccc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 127047519 | 139908 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 468 | 8 | 1 | 8 | 4.5 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3ccccc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799452 | 139908 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 468 | 8 | 1 | 8 | 4.5 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3ccccc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 127047547 | 140077 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 519 | 8 | 1 | 8 | 4.8 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3cc(Br)ccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3800497 | 140077 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 519 | 8 | 1 | 8 | 4.8 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3cc(Br)ccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44596807 | 198097 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 378 | 7 | 1 | 7 | 3.3 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL574436 | 198097 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 378 | 7 | 1 | 7 | 3.3 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| 44190340 | 195470 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 373 | 6 | 0 | 4 | 5.3 | CC[C@H](C1CC1)n1cc(Cl)nc(N(CC)c2cc(C)c(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL552559 | 195470 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 373 | 6 | 0 | 4 | 5.3 | CC[C@H](C1CC1)n1cc(Cl)nc(N(CC)c2cc(C)c(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 44190337 | 196133 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 391 | 8 | 1 | 6 | 4.3 | CCOc1cc(C)c(Nc2nc(Cl)cn([C@@H](COC)C3CC3)c2=O)cc1C | 10.1021/jm900301y | |||
| CHEMBL561097 | 196133 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 391 | 8 | 1 | 6 | 4.3 | CCOc1cc(C)c(Nc2nc(Cl)cn([C@@H](COC)C3CC3)c2=O)cc1C | 10.1021/jm900301y | |||
| 44596810 | 198002 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 348 | 5 | 1 | 6 | 3.6 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL573748 | 198002 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 348 | 5 | 1 | 6 | 3.6 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.01.129 | |||
| 11211931 | 124343 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 4.5 | CCN(c1cc(C)nc2c1NC(=O)CN2c1cc(F)c(OC)cc1Cl)C(C)C | 10.1021/jm049737f | |||
| CHEMBL363654 | 124343 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 406 | 5 | 1 | 5 | 4.5 | CCN(c1cc(C)nc2c1NC(=O)CN2c1cc(F)c(OC)cc1Cl)C(C)C | 10.1021/jm049737f | |||
| 54582097 | 61039 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 372 | 7 | 0 | 7 | 3.3 | CCN(CCCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| CHEMBL1762820 | 61039 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 372 | 7 | 0 | 7 | 3.3 | CCN(CCCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| 44596587 | 197863 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 388 | 7 | 1 | 7 | 3.5 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL572588 | 197863 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 388 | 7 | 1 | 7 | 3.5 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1021/jm900716v | |||
| 127047548 | 139686 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 509 | 8 | 1 | 8 | 5.1 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3ccc(C(F)(F)F)cn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3798004 | 139686 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 509 | 8 | 1 | 8 | 5.1 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3ccc(C(F)(F)F)cn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44629378 | 139834 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 517 | 8 | 2 | 8 | 5.5 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccc(Cl)cc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799036 | 139834 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 517 | 8 | 2 | 8 | 5.5 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccc(Cl)cc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44190449 | 195977 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 388 | 5 | 1 | 6 | 4.0 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL559764 | 195977 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 388 | 5 | 1 | 6 | 4.0 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| 42618230 | 191338 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 380 | 7 | 0 | 7 | 3.7 | CCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL519159 | 191338 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 380 | 7 | 0 | 7 | 3.7 | CCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 44191010 | 195147 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.6 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL550216 | 195147 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 5.6 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 42618198 | 184163 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 377 | 5 | 0 | 6 | 4.1 | CCN(CC)c1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL482981 | 184163 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 377 | 5 | 0 | 6 | 4.1 | CCN(CC)c1nc(C)nc2c(-c3cc(F)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| 44596701 | 198033 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 353 | 6 | 1 | 7 | 3.2 | CC[C@H](C1CC1)n1cc(C#N)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL573976 | 198033 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 353 | 6 | 1 | 7 | 3.2 | CC[C@H](C1CC1)n1cc(C#N)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| 44629377 | 139965 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 551 | 8 | 2 | 8 | 6.2 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cc(Cl)cc(Cl)c3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799825 | 139965 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 551 | 8 | 2 | 8 | 6.2 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cc(Cl)cc(Cl)c3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44629312 | 140061 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 551 | 8 | 2 | 8 | 6.2 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccc(Cl)cc3Cl)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3800413 | 140061 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 551 | 8 | 2 | 8 | 6.2 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3ccc(Cl)cc3Cl)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44190145 | 195208 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 351 | 6 | 1 | 6 | 3.5 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL550685 | 195208 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 351 | 6 | 1 | 6 | 3.5 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 44189946 | 195828 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)c1 | 10.1016/j.bmcl.2010.01.129 | |||
| 44189946 | 195828 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)c1 | 10.1021/jm900301y | |||
| CHEMBL558280 | 195828 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)c1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL558280 | 195828 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)c1 | 10.1021/jm900301y | |||
| 44189946 | 195828 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)c1 | 10.1021/jm900302q | |||
| CHEMBL558280 | 195828 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)c1 | 10.1021/jm900302q | |||
| 44190918 | 196005 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 4.4 | CC[C@H](COC)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL560034 | 196005 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 4.4 | CC[C@H](COC)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 42618187 | 180164 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 397 | 8 | 0 | 7 | 4.4 | CCCCN(CC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474901 | 180164 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 397 | 8 | 0 | 7 | 4.4 | CCCCN(CC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618188 | 179278 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 399 | 8 | 0 | 8 | 3.2 | CCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL473075 | 179278 | 0 | None | - | 0 | Rat | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 399 | 8 | 0 | 8 | 3.2 | CCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 44190449 | 195977 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 388 | 5 | 1 | 6 | 4.0 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL559764 | 195977 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 388 | 5 | 1 | 6 | 4.0 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| 42618189 | 189690 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 425 | 9 | 0 | 8 | 3.6 | COCCN(CC1CC1)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL515396 | 189690 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 425 | 9 | 0 | 8 | 3.6 | COCCN(CC1CC1)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 44190823 | 196197 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 6.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL561416 | 196197 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 455 | 6 | 1 | 5 | 6.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 11154464 | 67470 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 423 | 6 | 1 | 5 | 5.0 | CCCN(CC1CCC1)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL189196 | 67470 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 423 | 6 | 1 | 5 | 5.0 | CCCN(CC1CCC1)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1Cl | 10.1021/jm049737f | |||
| 42618172 | 179998 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 376 | 6 | 0 | 7 | 3.6 | COc1ccc(-c2c(C)nn3c(N(CCC#N)C4CC4)nc(C)nc23)c(C)c1 | 10.1021/jm9000242 | |||
| CHEMBL474701 | 179998 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 376 | 6 | 0 | 7 | 3.6 | COc1ccc(-c2c(C)nn3c(N(CCC#N)C4CC4)nc(C)nc23)c(C)c1 | 10.1021/jm9000242 | |||
| 52918270 | 61040 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 402 | 9 | 0 | 8 | 2.9 | COCCN(CCCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| CHEMBL1762821 | 61040 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 402 | 9 | 0 | 8 | 2.9 | COCCN(CCCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| 44629381 | 139960 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 520 | 9 | 2 | 9 | 4.8 | Cc1cc(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cccnc3)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799784 | 139960 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 520 | 9 | 2 | 9 | 4.8 | Cc1cc(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cccnc3)C3CC3)c2=O)c(C)nc1OC(F)F | 10.1016/j.bmcl.2016.03.067 | |||
| 42618196 | 191473 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 371 | 6 | 1 | 6 | 4.5 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL519340 | 191473 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 371 | 6 | 1 | 6 | 4.5 | CCC(CC)Nc1nc(C)nc2c(-c3cc(F)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618170 | 180839 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 379 | 7 | 0 | 6 | 4.4 | CCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL475706 | 180839 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 379 | 7 | 0 | 6 | 4.4 | CCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618195 | 184286 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(C)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL483993 | 184286 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(C)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 21984762 | 77542 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 409 | 8 | 0 | 4 | 5.9 | CCc1nn2c(-c3ccc(OC)cc3Cl)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087550 | 77542 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 409 | 8 | 0 | 4 | 5.9 | CCc1nn2c(-c3ccc(OC)cc3Cl)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| 44596702 | 197947 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 339 | 5 | 1 | 7 | 2.9 | COc1nc(C)c(Nc2nc(C#N)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900716v | |||
| CHEMBL573284 | 197947 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 339 | 5 | 1 | 7 | 2.9 | COc1nc(C)c(Nc2nc(C#N)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900716v | |||
| 46891188 | 6644 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 397 | 4 | 1 | 6 | 4.5 | Cc1nc(Nc2c(Cl)cc(C#N)c(Cl)c2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083343 | 6644 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 397 | 4 | 1 | 6 | 4.5 | Cc1nc(Nc2c(Cl)cc(C#N)c(Cl)c2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 44629310 | 139898 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 484 | 8 | 2 | 9 | 4.3 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cccnc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799417 | 139898 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 484 | 8 | 2 | 9 | 4.3 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)Nc3cccnc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 58280026 | 140082 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 449 | 9 | 2 | 8 | 3.7 | CCCNC(=O)OC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3800523 | 140082 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 449 | 9 | 2 | 8 | 3.7 | CCCNC(=O)OC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| 44190147 | 196744 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 363 | 6 | 2 | 6 | 3.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@@H](CO)C3CC3)c2=O)cc1C | 10.1021/jm900301y | |||
| CHEMBL565169 | 196744 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 363 | 6 | 2 | 6 | 3.2 | COc1cc(C)c(Nc2nc(Cl)cn([C@@H](CO)C3CC3)c2=O)cc1C | 10.1021/jm900301y | |||
| 24768326 | 97776 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 328 | 6 | 0 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)nc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271762 | 97776 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 328 | 6 | 0 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)nc2C)c1C | 10.1021/jm070578k | |||
| 10295702 | 122900 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 420 | 6 | 0 | 4 | 5.7 | CCCC(C1CC1)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL360589 | 122900 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 420 | 6 | 0 | 4 | 5.7 | CCCC(C1CC1)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 11306819 | 12408 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 397 | 6 | 1 | 5 | 4.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1C#N | 10.1021/jm049737f | |||
| CHEMBL1185802 | 12408 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 397 | 6 | 1 | 5 | 4.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1C#N | 10.1021/jm049737f | |||
| CHEMBL433592 | 12408 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 397 | 6 | 1 | 5 | 4.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1C#N | 10.1021/jm049737f | |||
| 24768326 | 97776 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 328 | 6 | 0 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)nc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271762 | 97776 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 328 | 6 | 0 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)nc2C)c1C | 10.1021/jm070578k | |||
| 9927970 | 97736 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL271558 | 97736 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 9819482 | 157547 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.2 | CCC(COC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL408028 | 157547 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.2 | CCC(COC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 70692631 | 75900 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.ejmech.2021.114085 | |||
| CHEMBL2049190 | 75900 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.ejmech.2021.114085 | |||
| 70692631 | 75900 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049190 | 75900 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.bmcl.2012.05.066 | |||
| 17961227 | 94407 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 483 | 6 | 0 | 3 | 8.2 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL250982 | 94407 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 483 | 6 | 0 | 3 | 8.2 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 44589204 | 189501 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 384 | 3 | 0 | 7 | 4.3 | Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL513967 | 189501 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 384 | 3 | 0 | 7 | 4.3 | Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 21912321 | 97779 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 327 | 4 | 0 | 4 | 4.6 | Cc1cc(C)c(Oc2nc(C)cc(OC3CCOC3)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL271770 | 97779 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 327 | 4 | 0 | 4 | 4.6 | Cc1cc(C)c(Oc2nc(C)cc(OC3CCOC3)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 57785838 | 165105 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 503 | 6 | 0 | 6 | 6.3 | CCc1nc(C)nc(CC)c1N1CCCn2c1nc1c(Cl)ccc(C(OC(F)F)C(F)(F)F)c12 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4227282 | 165105 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 503 | 6 | 0 | 6 | 6.3 | CCc1nc(C)nc(CC)c1N1CCCn2c1nc1c(Cl)ccc(C(OC(F)F)C(F)(F)F)c12 | 10.1016/j.bmc.2018.01.020 | |||
| 11122528 | 65228 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 413 | 10 | 0 | 7 | 4.0 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(OC)cc(OC)cc2OC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182643 | 65228 | 0 | None | - | 1 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 413 | 10 | 0 | 7 | 4.0 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(OC)cc(OC)cc2OC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 58223462 | 128810 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 473 | 10 | 0 | 9 | 4.7 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(C=O)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3669429 | 128810 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 473 | 10 | 0 | 9 | 4.7 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(C=O)cc3OC)csc12)C1CCOCC1 | nan | |||
| 57912458 | 82606 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 487 | 10 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179184 | 82606 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 487 | 10 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 71458703 | 81515 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 419 | 8 | 0 | 6 | 5.1 | CCN(CC)c1ccc(C#N)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160164 | 81515 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 419 | 8 | 0 | 6 | 5.1 | CCN(CC)c1ccc(C#N)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 24768342 | 85578 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 364 | 6 | 1 | 6 | 4.2 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| CHEMBL228130 | 85578 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 364 | 6 | 1 | 6 | 4.2 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| 21912321 | 97779 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 327 | 4 | 0 | 4 | 4.6 | Cc1cc(C)c(Oc2nc(C)cc(OC3CCOC3)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL271770 | 97779 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 327 | 4 | 0 | 4 | 4.6 | Cc1cc(C)c(Oc2nc(C)cc(OC3CCOC3)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 71462234 | 81522 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 452 | 11 | 0 | 6 | 6.0 | CCCN(CCC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160171 | 81522 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 452 | 11 | 0 | 6 | 6.0 | CCCN(CCC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 60155794 | 77562 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 449 | 9 | 0 | 6 | 5.2 | CCc1nn2c(-c3c(OC)cccc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087570 | 77562 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 449 | 9 | 0 | 6 | 5.2 | CCc1nn2c(-c3c(OC)cccc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 71458705 | 81521 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 438 | 10 | 0 | 6 | 5.5 | CCc1cc2c(N(CC)CC)ccc(OC)c2nc1-c1c(OC)cc(COC)cc1OC | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160170 | 81521 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 438 | 10 | 0 | 6 | 5.5 | CCc1cc2c(N(CC)CC)ccc(OC)c2nc1-c1c(OC)cc(COC)cc1OC | 10.1016/j.bmc.2012.09.028 | |||
| 44392550 | 64568 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 489 | 9 | 0 | 8 | 5.0 | CCCC(CCC)n1c(CC)nc2c1c(=O)n(C)c(=O)n2-c1cc(-c2cccnc2)c(OC)cc1C | 10.1021/jm049787k | |||
| CHEMBL181546 | 64568 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 489 | 9 | 0 | 8 | 5.0 | CCCC(CCC)n1c(CC)nc2c1c(=O)n(C)c(=O)n2-c1cc(-c2cccnc2)c(OC)cc1C | 10.1021/jm049787k | |||
| 70690704 | 76614 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063375 | 76614 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 70690704 | 76614 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2063375 | 76614 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 438 | 10 | 0 | 6 | 5.2 | CCN(CCOC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 21912293 | 97815 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cccc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271974 | 97815 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cccc2C)c1C | 10.1021/jm070578k | |||
| 21912397 | 98036 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 371 | 8 | 0 | 4 | 6.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC(C)C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL273033 | 98036 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 371 | 8 | 0 | 4 | 6.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC(C)C)cc2C)c1C | 10.1021/jm070578k | |||
| 58896510 | 139508 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 430 | 6 | 1 | 5 | 5.6 | CCN(c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12)C(C)C | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793568 | 139508 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 430 | 6 | 1 | 5 | 5.6 | CCN(c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12)C(C)C | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794598 | 139508 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 430 | 6 | 1 | 5 | 5.6 | CCN(c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12)C(C)C | 10.1021/acs.jmedchem.5b01715 | |||
| 46891088 | 7070 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 452 | 7 | 1 | 7 | 4.5 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084997 | 7070 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 452 | 7 | 1 | 7 | 4.5 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891035 | 7403 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 436 | 6 | 1 | 6 | 4.6 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086510 | 7403 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 436 | 6 | 1 | 6 | 4.6 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46845695 | 6922 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 334 | 5 | 1 | 6 | 3.3 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1084413 | 6922 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 334 | 5 | 1 | 6 | 3.3 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| 44190917 | 196225 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 429 | 5 | 1 | 5 | 5.2 | COC[C@@H](C)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL561615 | 196225 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 429 | 5 | 1 | 5 | 5.2 | COC[C@@H](C)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 9927970 | 97736 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL271558 | 97736 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 9819482 | 157547 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.2 | CCC(COC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL408028 | 157547 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.2 | CCC(COC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 57785862 | 164941 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 388 | 4 | 0 | 4 | 5.7 | CCN(CC)c1cccc2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4224887 | 164941 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 388 | 4 | 0 | 4 | 5.7 | CCN(CC)c1cccc2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2011.02.086 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2011.02.086 | |||
| 42618206 | 180171 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 367 | 6 | 1 | 6 | 4.6 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(OC)c(C)c3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474907 | 180171 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 367 | 6 | 1 | 6 | 4.6 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(OC)c(C)c3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618165 | 174535 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 385 | 9 | 0 | 8 | 2.5 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL455588 | 174535 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 385 | 9 | 0 | 8 | 2.5 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1021/jm9000242 | |||
| 24758072 | 69977 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 320 | 4 | 0 | 2 | 6.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939572 | 69977 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 320 | 4 | 0 | 2 | 6.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| 24768331 | 85474 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 369 | 7 | 1 | 6 | 4.3 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL226761 | 85474 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 369 | 7 | 1 | 6 | 4.3 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| 44362115 | 1169 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0202122 | |||||
| 6967 | 1169 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0202122 | |||||
| CHEMBL1201609 | 1169 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0202122 | |||||
| CHEMBL440057 | 1169 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0202122 | |||||
| 71456850 | 81516 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 424 | 9 | 0 | 6 | 5.2 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160166 | 81516 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 424 | 9 | 0 | 6 | 5.2 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 21912293 | 97815 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cccc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271974 | 97815 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cccc2C)c1C | 10.1021/jm070578k | |||
| 21912397 | 98036 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 371 | 8 | 0 | 4 | 6.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC(C)C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL273033 | 98036 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 371 | 8 | 0 | 4 | 6.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC(C)C)cc2C)c1C | 10.1021/jm070578k | |||
| 70909662 | 156228 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 448 | 6 | 1 | 5 | 6.1 | CCC(=O)N(c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12)C(C)C | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4064670 | 156228 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 448 | 6 | 1 | 5 | 6.1 | CCC(=O)N(c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12)C(C)C | 10.1016/j.bmc.2016.11.011 | |||
| 137654892 | 158625 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 420 | 7 | 2 | 5 | 6.5 | CCC(CC)Nc1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4092351 | 158625 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 420 | 7 | 2 | 5 | 6.5 | CCC(CC)Nc1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 44129684 | 165030 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4226158 | 165030 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| 9951076 | 67411 | 2 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL188844 | 67411 | 2 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL2165204 | 67411 | 2 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| 10616876 | 101358 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 336 | 5 | 1 | 4 | 5.2 | CCCCNc1nc(C)nc2c1c(C)cn2-c1c(C)cc(C)cc1C | 10.1021/jm960861b | |||
| CHEMBL296977 | 101358 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 336 | 5 | 1 | 4 | 5.2 | CCCCNc1nc(C)nc2c1c(C)cn2-c1c(C)cc(C)cc1C | 10.1021/jm960861b | |||
| 46891338 | 7379 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 346 | 6 | 1 | 9 | 1.8 | COc1nc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086374 | 7379 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 346 | 6 | 1 | 9 | 1.8 | COc1nc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 70888282 | 175137 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 556 | 7 | 1 | 7 | 6.3 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3ccc(S(C)(=O)=O)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4569860 | 175137 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 556 | 7 | 1 | 7 | 6.3 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3ccc(S(C)(=O)=O)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 54585865 | 60653 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 394 | 6 | 0 | 5 | 4.8 | CCCN(CCC)c1nc2c(c(-c3c(C)cc(C)cc3C)c(C)n2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760257 | 60653 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 394 | 6 | 0 | 5 | 4.8 | CCCN(CCC)c1nc2c(c(-c3c(C)cc(C)cc3C)c(C)n2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 57390211 | 69994 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 395 | 7 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939589 | 69994 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 395 | 7 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 9800812 | 123636 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 394 | 5 | 0 | 4 | 5.3 | CCc1nc2c(n1C(CC)CC)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL361912 | 123636 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 394 | 5 | 0 | 4 | 5.3 | CCc1nc2c(n1C(CC)CC)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 56659877 | 65306 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 415 | 9 | 1 | 6 | 5.9 | CCCN(CCC)c1c(C(C)C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828892 | 65306 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 415 | 9 | 1 | 6 | 5.9 | CCCN(CCC)c1c(C(C)C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 60155990 | 77578 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 513 | 11 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2cccc3c(N(CC4CC4)CC4OCCCO4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087800 | 77578 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 513 | 11 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2cccc3c(N(CC4CC4)CC4OCCCO4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 10111759 | 64356 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 402 | 6 | 0 | 5 | 4.7 | CCc1nc2c(n1C(CC)C1CC1)C(=O)N(C)CN2c1ccc(OC)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL181259 | 64356 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 402 | 6 | 0 | 5 | 4.7 | CCc1nc2c(n1C(CC)C1CC1)C(=O)N(C)CN2c1ccc(OC)cc1Cl | 10.1021/jm049787k | |||
| 44589350 | 189602 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 387 | 3 | 0 | 7 | 3.7 | N#Cc1ccc(N2CCc3c(-n4ccc(-n5cccn5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| CHEMBL514761 | 189602 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 387 | 3 | 0 | 7 | 3.7 | N#Cc1ccc(N2CCc3c(-n4ccc(-n5cccn5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| 70696935 | 76609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 450 | 11 | 0 | 5 | 6.6 | CCCN(CCC)c1ccc(CC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063370 | 76609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 450 | 11 | 0 | 5 | 6.6 | CCCN(CCC)c1ccc(CC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 58223504 | 127834 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 503 | 11 | 0 | 9 | 5.2 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)c(CC)sc12)C1CCOCC1 | nan | |||
| CHEMBL3664547 | 127834 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 503 | 11 | 0 | 9 | 5.2 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)c(CC)sc12)C1CCOCC1 | nan | |||
| 71455052 | 81518 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 428 | 9 | 0 | 6 | 5.1 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160168 | 81518 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 428 | 9 | 0 | 6 | 5.1 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 58896594 | 139504 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 444 | 8 | 1 | 5 | 6.0 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793367 | 139504 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 444 | 8 | 1 | 5 | 6.0 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794594 | 139504 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 444 | 8 | 1 | 5 | 6.0 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 56683763 | 65501 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830519 | 65501 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | |||
| 21984648 | 77544 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087552 | 77544 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| 44596700 | 198619 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 369 | 7 | 1 | 8 | 2.5 | COC[C@H](C1CC1)n1cc(C#N)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL578838 | 198619 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 369 | 7 | 1 | 8 | 2.5 | COC[C@H](C1CC1)n1cc(C#N)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| 46891490 | 6468 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 369 | 5 | 1 | 7 | 3.1 | COc1ccc(Nc2nc(C)nn([C@@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082625 | 6468 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 369 | 5 | 1 | 7 | 3.1 | COc1ccc(Nc2nc(C)nn([C@@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 46891233 | 6698 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCOc1ccc(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083592 | 6698 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCOc1ccc(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 46845696 | 6389 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 348 | 5 | 1 | 6 | 3.6 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1082241 | 6389 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 348 | 5 | 1 | 6 | 3.6 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| 44190054 | 196013 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 335 | 5 | 1 | 5 | 3.8 | COC[C@@H](C)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL560098 | 196013 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 335 | 5 | 1 | 5 | 3.8 | COC[C@@H](C)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 42618225 | 179303 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 340 | 5 | 0 | 7 | 3.0 | CCN(CC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL473276 | 179303 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 340 | 5 | 0 | 7 | 3.0 | CCN(CC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 21912223 | 97585 | 1 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 328 | 6 | 1 | 4 | 5.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N | 10.1021/jm070578k | |||
| CHEMBL270780 | 97585 | 1 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 328 | 6 | 1 | 4 | 5.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N | 10.1021/jm070578k | |||
| 21912419 | 98014 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 439 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(I)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272912 | 98014 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 439 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(I)cc2C)c1C | 10.1021/jm070578k | |||
| 21912223 | 97585 | 1 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 328 | 6 | 1 | 4 | 5.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N | 10.1021/jm070578k | |||
| CHEMBL270780 | 97585 | 1 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 328 | 6 | 1 | 4 | 5.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N | 10.1021/jm070578k | |||
| 21912419 | 98014 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 439 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(I)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272912 | 98014 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 439 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(I)cc2C)c1C | 10.1021/jm070578k | |||
| 44444317 | 94061 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 0 | 4 | 5.7 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL248962 | 94061 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 363 | 5 | 0 | 4 | 5.7 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 44444316 | 161674 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 358 | 4 | 0 | 4 | 5.6 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL413134 | 161674 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 358 | 4 | 0 | 4 | 5.6 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 42618213 | 184093 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 409 | 8 | 0 | 7 | 4.5 | CCCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL482543 | 184093 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 409 | 8 | 0 | 7 | 4.5 | CCCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 58801644 | 77560 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(COC)cc(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087568 | 77560 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(COC)cc(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 58801647 | 77567 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 479 | 10 | 0 | 7 | 5.1 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087575 | 77567 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 479 | 10 | 0 | 7 | 5.1 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 45268739 | 195955 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 365 | 4 | 1 | 5 | 4.3 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2cc3c(cc2Cl)COC3)c1=O | 10.1021/jm900302q | |||
| CHEMBL559566 | 195955 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 365 | 4 | 1 | 5 | 4.3 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2cc3c(cc2Cl)COC3)c1=O | 10.1021/jm900302q | |||
| 155543377 | 173303 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 563 | 8 | 2 | 6 | 6.7 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C(C)(C)C(N)=O)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4526083 | 173303 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 563 | 8 | 2 | 6 | 6.7 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C(C)(C)C(N)=O)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 155568703 | 176113 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 521 | 7 | 2 | 6 | 6.0 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C(N)=O)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4591720 | 176113 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 521 | 7 | 2 | 6 | 6.0 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C(N)=O)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 11639510 | 60649 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 380 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1nc2c(c(-c3c(C)cc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760253 | 60649 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 380 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1nc2c(c(-c3c(C)cc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL5280146 | 194053 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 382 | 4 | 0 | 5 | 5.5 | CCN(CC)c1cc(C)nn2c(-c3sc4ccc(F)cc4c3C)c(C)nc12 | 10.1016/j.ejmech.2021.113867 | |||
| 11282792 | 189495 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 469 | 4 | 1 | 7 | 3.6 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(C#N)cc1OC(F)(F)F)CC2 | 10.1021/jm800744m | |||
| CHEMBL513937 | 189495 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 469 | 4 | 1 | 7 | 3.6 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(C#N)cc1OC(F)(F)F)CC2 | 10.1021/jm800744m | |||
| 11338604 | 189687 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 402 | 4 | 1 | 7 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(-n5cc[nH]c5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL515363 | 189687 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 402 | 4 | 1 | 7 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(-n5cc[nH]c5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 45272175 | 195090 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 380 | 6 | 1 | 6 | 4.0 | C=Cc1cn([C@H](C)C2CC2)c(=O)c(Nc2ccc(OC)nc2C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL549747 | 195090 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 380 | 6 | 1 | 6 | 4.0 | C=Cc1cn([C@H](C)C2CC2)c(=O)c(Nc2ccc(OC)nc2C(F)(F)F)n1 | 10.1021/jm900301y | |||
| 10474043 | 64577 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 365 | 7 | 0 | 4 | 4.9 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL181593 | 64577 | 0 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 365 | 7 | 0 | 4 | 4.9 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 57393712 | 69984 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 337 | 5 | 0 | 4 | 5.2 | CCC(CC)c1nc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939579 | 69984 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 337 | 5 | 0 | 4 | 5.2 | CCC(CC)c1nc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| 9865886 | 175866 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 403 | 4 | 0 | 6 | 3.7 | COc1ccc(N2CCc3c(-n4ccc(N5CCCC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL458599 | 175866 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 403 | 4 | 0 | 6 | 3.7 | COc1ccc(N2CCc3c(-n4ccc(N5CCCC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 11189676 | 175589 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 3.9 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(OC(C)C)cc1C)CC2 | 10.1021/jm800744m | |||
| CHEMBL457975 | 175589 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 432 | 5 | 1 | 6 | 3.9 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(OC(C)C)cc1C)CC2 | 10.1021/jm800744m | |||
| 44444331 | 94374 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 455 | 4 | 0 | 3 | 7.4 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL250803 | 94374 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 455 | 4 | 0 | 3 | 7.4 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 44444312 | 167775 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 391 | 7 | 0 | 4 | 6.5 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL430396 | 167775 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 391 | 7 | 0 | 4 | 6.5 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 44589224 | 176027 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 398 | 4 | 0 | 7 | 4.5 | CCc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL459007 | 176027 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 398 | 4 | 0 | 7 | 4.5 | CCc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 71459110 | 82614 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 456 | 8 | 0 | 9 | 4.4 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179192 | 82614 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 456 | 8 | 0 | 9 | 4.4 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 53357535 | 130607 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 429 | 5 | 1 | 4 | 4.9 | COc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | |||
| CHEMBL3681390 | 130607 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 429 | 5 | 1 | 4 | 4.9 | COc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | |||
| 11166718 | 67265 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 444 | 3 | 1 | 5 | 4.2 | Cc1cc(N2CCOCC2)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2 | 10.1021/jm049737f | |||
| CHEMBL188112 | 67265 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 444 | 3 | 1 | 5 | 4.2 | Cc1cc(N2CCOCC2)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2 | 10.1021/jm049737f | |||
| 44589205 | 175958 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 425 | 4 | 0 | 8 | 4.6 | Cc1cc(-n2cccn2)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL458826 | 175958 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 425 | 4 | 0 | 8 | 4.6 | Cc1cc(-n2cccn2)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 127030924 | 139368 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 397 | 6 | 1 | 6 | 5.0 | CCN(CC)c1ccc(C#N)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793070 | 139368 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 397 | 6 | 1 | 6 | 5.0 | CCN(CC)c1ccc(C#N)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 127030927 | 139494 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 402 | 7 | 1 | 6 | 5.1 | CCN(CC)c1ccc(OC)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794479 | 139494 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 402 | 7 | 1 | 6 | 5.1 | CCN(CC)c1ccc(OC)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 58896493 | 139506 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 1 | 5 | 5.2 | CCN(CC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793322 | 139506 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 1 | 5 | 5.2 | CCN(CC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794596 | 139506 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 416 | 6 | 1 | 5 | 5.2 | CCN(CC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 56673725 | 65309 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 403 | 9 | 1 | 7 | 4.8 | CCCN(CCC)c1c(OC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828895 | 65309 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 403 | 9 | 1 | 7 | 4.8 | CCCN(CCC)c1c(OC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 21984718 | 77546 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087554 | 77546 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| 46891386 | 6411 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.6 | Cc1nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c(=O)n([C@H](C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082355 | 6411 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.6 | Cc1nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c(=O)n([C@H](C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 46891191 | 6427 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 353 | 6 | 1 | 7 | 3.2 | CCC(C1CC1)n1nc(C)nc(Nc2cc(OC)c(C#N)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082402 | 6427 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 353 | 6 | 1 | 7 | 3.2 | CCC(C1CC1)n1nc(C)nc(Nc2cc(OC)c(C#N)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 155561680 | 175689 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 434 | 6 | 1 | 5 | 6.8 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccccc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4581950 | 175689 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 434 | 6 | 1 | 5 | 6.8 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccccc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 53357921 | 130612 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 427 | 5 | 1 | 3 | 5.4 | CCc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | |||
| CHEMBL3681395 | 130612 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 427 | 5 | 1 | 3 | 5.4 | CCc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | |||
| 57398972 | 70008 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 339 | 3 | 0 | 5 | 3.8 | COc1cc(C)c(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(C)c1 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939602 | 70008 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 339 | 3 | 0 | 5 | 3.8 | COc1cc(C)c(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(C)c1 | 10.1016/j.bmc.2011.11.015 | |||
| 24758073 | 69979 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 364 | 7 | 0 | 3 | 6.5 | CCOc1ccc(-c2nn3c(C)cc(C(CC)CC)c3cc2C)c(CC)c1 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939574 | 69979 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 364 | 7 | 0 | 3 | 6.5 | CCOc1ccc(-c2nn3c(C)cc(C(CC)CC)c3cc2C)c(CC)c1 | 10.1016/j.bmc.2011.11.015 | |||
| 42618204 | 179280 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 429 | 10 | 0 | 9 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL473077 | 179280 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 429 | 10 | 0 | 9 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618214 | 192528 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 353 | 5 | 0 | 7 | 3.0 | CCN(CC)c1nc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL520955 | 192528 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 353 | 5 | 0 | 7 | 3.0 | CCN(CC)c1nc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 58223500 | 127851 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 489 | 10 | 0 | 9 | 5.0 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCOCC1 | nan | |||
| CHEMBL3664564 | 127851 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 489 | 10 | 0 | 9 | 5.0 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCOCC1 | nan | |||
| 60155793 | 77557 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 479 | 10 | 0 | 7 | 5.2 | CCc1nn2c(-c3cc(OC)c(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087565 | 77557 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 479 | 10 | 0 | 7 | 5.2 | CCc1nn2c(-c3cc(OC)c(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 57785779 | 164931 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 459 | 4 | 0 | 5 | 6.7 | CCC(c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl)n1ccnc1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4224722 | 164931 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 459 | 4 | 0 | 5 | 6.7 | CCC(c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl)n1ccnc1 | 10.1016/j.bmc.2018.01.020 | |||
| 57393715 | 70004 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 339 | 3 | 0 | 6 | 2.9 | Cc1nc(N(C)C)ccc1-c1nn2c(C)cc(C(C)C)c2c(=O)n1C | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939599 | 70004 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 339 | 3 | 0 | 6 | 2.9 | Cc1nc(N(C)C)ccc1-c1nn2c(C)cc(C(C)C)c2c(=O)n1C | 10.1016/j.bmc.2011.11.015 | |||
| 53358605 | 130594 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 422 | 5 | 1 | 4 | 5.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@@H](Cn2nc(-c3ccccc3)cc2C)CC1 | nan | |||
| CHEMBL3681377 | 130594 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 422 | 5 | 1 | 4 | 5.2 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@@H](Cn2nc(-c3ccccc3)cc2C)CC1 | nan | |||
| 58223436 | 127839 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 445 | 9 | 0 | 9 | 3.8 | CCCN(CC1CCOC1)c1c(OC)nn2c(-c3cnc(N(C)C)cc3OC)csc12 | nan | |||
| CHEMBL3664552 | 127839 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 445 | 9 | 0 | 9 | 3.8 | CCCN(CC1CCOC1)c1c(OC)nn2c(-c3cnc(N(C)C)cc3OC)csc12 | nan | |||
| 71451515 | 81509 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 405 | 7 | 0 | 6 | 5.0 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C#N)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160158 | 81509 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 405 | 7 | 0 | 6 | 5.0 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C#N)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 53357793 | 130609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 399 | 4 | 1 | 3 | 4.9 | Cc1cnn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | |||
| CHEMBL3681392 | 130609 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 399 | 4 | 1 | 3 | 4.9 | Cc1cnn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1 | nan | |||
| 42618209 | 179809 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 427 | 9 | 0 | 9 | 2.6 | COCCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL474492 | 179809 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 427 | 9 | 0 | 9 | 2.6 | COCCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 53358858 | 130589 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 389 | 6 | 3 | 4 | 4.0 | CCc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)c1C | nan | |||
| CHEMBL3681372 | 130589 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 389 | 6 | 3 | 4 | 4.0 | CCc1[nH]nc(NC[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)c1C | nan | |||
| 21912226 | 97735 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 329 | 6 | 1 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271557 | 97735 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 329 | 6 | 1 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(O)cc2C)c1C | 10.1021/jm070578k | |||
| 71453735 | 82611 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 475 | 9 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(C(C)C)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179189 | 82611 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 475 | 9 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(C(C)C)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 70696576 | 75583 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2046526 | 75583 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 70696576 | 75583 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2046526 | 75583 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 438 | 11 | 0 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 58896474 | 139444 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 400 | 8 | 1 | 5 | 5.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793985 | 139444 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 400 | 8 | 1 | 5 | 5.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 127031514 | 139452 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 425 | 8 | 1 | 6 | 5.8 | CCCN(CCC)c1ccc(C#N)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794030 | 139452 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 425 | 8 | 1 | 6 | 5.8 | CCCN(CCC)c1ccc(C#N)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 58896536 | 139507 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 472 | 10 | 1 | 5 | 6.8 | CCCCN(CCCC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3792935 | 139507 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 472 | 10 | 1 | 5 | 6.8 | CCCCN(CCCC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794597 | 139507 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 472 | 10 | 1 | 5 | 6.8 | CCCCN(CCCC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 56677028 | 65299 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 359 | 7 | 2 | 6 | 4.7 | CCC(CC)Nc1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828886 | 65299 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 359 | 7 | 2 | 6 | 4.7 | CCC(CC)Nc1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 71580312 | 88437 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 475 | 9 | 1 | 8 | 3.4 | COc1nc(Cl)nc(C)c1Nc1nc(Br)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349563 | 88437 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 475 | 9 | 1 | 8 | 3.4 | COc1nc(Cl)nc(C)c1Nc1nc(Br)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| 44596811 | 198243 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 352 | 6 | 1 | 7 | 2.9 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| CHEMBL575510 | 198243 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 352 | 6 | 1 | 7 | 2.9 | COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1021/jm900716v | |||
| 46891033 | 7401 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 406 | 4 | 1 | 5 | 5.0 | Cc1nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086508 | 7401 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 406 | 4 | 1 | 5 | 5.0 | Cc1nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 58280027 | 140004 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 435 | 8 | 2 | 8 | 3.4 | CCNC(=O)OC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3800035 | 140004 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 435 | 8 | 2 | 8 | 3.4 | CCNC(=O)OC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| 10179550 | 64879 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 406 | 5 | 0 | 4 | 5.3 | CCc1nc2c(n1C(CC)C1CC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL182169 | 64879 | 0 | None | - | 0 | Rat | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 406 | 5 | 0 | 4 | 5.3 | CCc1nc2c(n1C(CC)C1CC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 136042278 | 69986 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 359 | 5 | 1 | 4 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939581 | 69986 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 359 | 5 | 1 | 4 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 42618218 | 184133 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 340 | 5 | 0 | 7 | 3.0 | CCN(CC)c1nc(C)nc2c(-c3cnc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL482751 | 184133 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 340 | 5 | 0 | 7 | 3.0 | CCN(CC)c1nc(C)nc2c(-c3cnc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 42618211 | 179302 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 4.1 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL473275 | 179302 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 4.1 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 58896427 | 139503 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 350 | 7 | 1 | 4 | 5.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cccc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793329 | 139503 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 350 | 7 | 1 | 4 | 5.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cccc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794593 | 139503 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 350 | 7 | 1 | 4 | 5.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cccc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 46881864 | 8010 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 360 | 5 | 1 | 8 | 2.6 | COc1nc(C)nc(C#N)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1090738 | 8010 | 0 | None | - | 0 | Rat | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 360 | 5 | 1 | 8 | 2.6 | COc1nc(C)nc(C#N)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 137646761 | 157840 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 479 | 7 | 2 | 6 | 4.4 | CCN(CC(N)=O)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4083664 | 157840 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 479 | 7 | 2 | 6 | 4.4 | CCN(CC(N)=O)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 54586828 | 60651 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 404 | 6 | 0 | 5 | 4.5 | Cc1cc(C)c(-c2cn(C)c3nc(N(CC4CC4)CC4CC4)n(C)c(=O)c23)c(C)c1 | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760255 | 60651 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 404 | 6 | 0 | 5 | 4.5 | Cc1cc(C)c(-c2cn(C)c3nc(N(CC4CC4)CC4CC4)n(C)c(=O)c23)c(C)c1 | 10.1016/j.bmcl.2011.02.086 | |||
| 21912226 | 97735 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 329 | 6 | 1 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271557 | 97735 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 329 | 6 | 1 | 4 | 5.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(O)cc2C)c1C | 10.1021/jm070578k | |||
| 53357269 | 130600 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 423 | 5 | 1 | 5 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(-c3cccnc3)cc2C)CC1 | nan | |||
| CHEMBL3681383 | 130600 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 423 | 5 | 1 | 5 | 4.6 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(-c3cccnc3)cc2C)CC1 | nan | |||
| 70686533 | 76618 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063381 | 76618 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 70686533 | 76618 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2063381 | 76618 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(F)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 71453344 | 81519 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 444 | 9 | 0 | 6 | 5.6 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160169 | 81519 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 444 | 9 | 0 | 6 | 5.6 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 11983528 | 174905 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 418 | 4 | 1 | 6 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(N5CCCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL456448 | 174905 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 418 | 4 | 1 | 6 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(N5CCCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 44589351 | 177828 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 421 | 3 | 0 | 7 | 4.0 | N#Cc1ccc(N2CCc3c(-n4ccc(-n5cccn5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| CHEMBL464390 | 177828 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 421 | 3 | 0 | 7 | 4.0 | N#Cc1ccc(N2CCc3c(-n4ccc(-n5cccn5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| 71451920 | 82607 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 461 | 9 | 0 | 9 | 4.2 | CCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179185 | 82607 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 461 | 9 | 0 | 9 | 4.2 | CCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 67380345 | 130598 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 4 | 1 | 3 | 5.0 | O=C(N[C@H]1CC[C@H](Cn2cc3c(n2)CCC3)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | |||
| CHEMBL3681381 | 130598 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 4 | 1 | 3 | 5.0 | O=C(N[C@H]1CC[C@H](Cn2cc3c(n2)CCC3)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | |||
| 21912127 | 97659 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1 | 10.1021/jm070578k | |||
| CHEMBL271117 | 97659 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1 | 10.1021/jm070578k | |||
| 136042277 | 69985 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 339 | 5 | 1 | 4 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939580 | 69985 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 339 | 5 | 1 | 4 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)[nH]c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 11210737 | 139454 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 364 | 7 | 1 | 4 | 5.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794051 | 139454 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 364 | 7 | 1 | 4 | 5.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 54754517 | 65496 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 417 | 10 | 0 | 7 | 4.8 | CCCN(CCC)c1cc(N(COC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830514 | 65496 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 417 | 10 | 0 | 7 | 4.8 | CCCN(CCC)c1cc(N(COC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 10200135 | 77547 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 385 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3Cl)cccc12 | 10.1021/jm300259r | |||
| CHEMBL2087555 | 77547 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 385 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3Cl)cccc12 | 10.1021/jm300259r | |||
| 22177744 | 64756 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 452 | 6 | 1 | 5 | 6.3 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC(F)(F)F)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819081 | 64756 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 452 | 6 | 1 | 5 | 6.3 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC(F)(F)F)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 46890982 | 6524 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 4.0 | COc1cc(Cl)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082792 | 6524 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 4.0 | COc1cc(Cl)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| 46891494 | 6639 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 399 | 7 | 1 | 8 | 2.7 | COC[C@H](C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083325 | 6639 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 399 | 7 | 1 | 8 | 2.7 | COC[C@H](C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 44191109 | 195529 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 363 | 6 | 1 | 6 | 3.9 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1OC | 10.1021/jm900302q | |||
| CHEMBL554086 | 195529 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 363 | 6 | 1 | 6 | 3.9 | COc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1OC | 10.1021/jm900302q | |||
| 21912175 | 155719 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 358 | 7 | 0 | 5 | 5.6 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1[N+](=O)[O-] | 10.1021/jm070578k | |||
| CHEMBL405347 | 155719 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 358 | 7 | 0 | 5 | 5.6 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1[N+](=O)[O-] | 10.1021/jm070578k | |||
| 58012333 | 159481 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 405 | 6 | 1 | 4 | 6.8 | CCC(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4101653 | 159481 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 405 | 6 | 1 | 4 | 6.8 | CCC(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 21912175 | 155719 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 358 | 7 | 0 | 5 | 5.6 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1[N+](=O)[O-] | 10.1021/jm070578k | |||
| CHEMBL405347 | 155719 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 358 | 7 | 0 | 5 | 5.6 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1[N+](=O)[O-] | 10.1021/jm070578k | |||
| 42618195 | 184286 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(C)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL483993 | 184286 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(C)c(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2007.06.077 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2007.06.077 | |||
| 10277733 | 63142 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 484 | 6 | 0 | 4 | 7.6 | CCCC(CCC)n1cc2c3c(nc(C)nc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL178949 | 63142 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 484 | 6 | 0 | 4 | 7.6 | CCCC(CCC)n1cc2c3c(nc(C)nc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 45268771 | 196633 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 354 | 5 | 1 | 6 | 3.4 | COc1ccc(Nc2nccn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL564291 | 196633 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 354 | 5 | 1 | 6 | 3.4 | COc1ccc(Nc2nccn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| 21912127 | 97659 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1 | 10.1021/jm070578k | |||
| CHEMBL271117 | 97659 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 313 | 6 | 0 | 3 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1 | 10.1021/jm070578k | |||
| 137642541 | 158296 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 493 | 7 | 2 | 6 | 4.6 | CCN(CC(=O)NC)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4089028 | 158296 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 493 | 7 | 2 | 6 | 4.6 | CCN(CC(=O)NC)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 11164902 | 66302 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL184850 | 66302 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 70692630 | 75898 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.ejmech.2021.114085 | |||
| CHEMBL2049188 | 75898 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.ejmech.2021.114085 | |||
| 70692630 | 75898 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049188 | 75898 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 71455053 | 81524 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 482 | 12 | 0 | 7 | 5.5 | COCCN(CC(C)C)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160173 | 81524 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 482 | 12 | 0 | 7 | 5.5 | COCCN(CC(C)C)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 70681900 | 75586 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 492 | 10 | 0 | 7 | 5.9 | COCc1cc(OC)c(Oc2nc3cccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2046529 | 75586 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 492 | 10 | 0 | 7 | 5.9 | COCc1cc(OC)c(Oc2nc3cccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| 44444337 | 94133 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 379 | 6 | 0 | 5 | 5.0 | CCC(COC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL249333 | 94133 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 379 | 6 | 0 | 5 | 5.0 | CCC(COC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 44589317 | 177683 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 426 | 3 | 1 | 6 | 4.1 | Cc1cc(-n2ccc(-n3cc[nH]c3=O)n2)c2c(n1)N(c1ccc(Cl)cc1Cl)CC2 | 10.1021/jm800744m | |||
| CHEMBL464184 | 177683 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 426 | 3 | 1 | 6 | 4.1 | Cc1cc(-n2ccc(-n3cc[nH]c3=O)n2)c2c(n1)N(c1ccc(Cl)cc1Cl)CC2 | 10.1021/jm800744m | |||
| 44589237 | 177011 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 454 | 4 | 0 | 8 | 4.9 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(OC(F)(F)F)c1 | 10.1021/jm800743q | |||
| CHEMBL462788 | 177011 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 454 | 4 | 0 | 8 | 4.9 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(OC(F)(F)F)c1 | 10.1021/jm800743q | |||
| 56670270 | 65497 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 374 | 7 | 2 | 7 | 4.4 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830515 | 65497 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 374 | 7 | 2 | 7 | 4.4 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 21984613 | 77543 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087551 | 77543 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 389 | 8 | 0 | 4 | 5.5 | CCc1nn2c(-c3ccc(OC)cc3C)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| 15485774 | 196375 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 365 | 7 | 1 | 6 | 3.4 | COCC(COC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL562619 | 196375 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 365 | 7 | 1 | 6 | 3.4 | COCC(COC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 18392782 | 97968 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 325 | 5 | 0 | 3 | 6.1 | C/C=C(\CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272674 | 97968 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 325 | 5 | 0 | 3 | 6.1 | C/C=C(\CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 44347046 | 114545 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 377 | 6 | 0 | 3 | 6.5 | CCCCN(CC)c1cc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL333713 | 114545 | 0 | None | - | 1 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 377 | 6 | 0 | 3 | 6.5 | CCCCN(CC)c1cc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2004.05.056 | |||
| 18392782 | 97968 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 325 | 5 | 0 | 3 | 6.1 | C/C=C(\CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272674 | 97968 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 325 | 5 | 0 | 3 | 6.1 | C/C=C(\CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL5269179 | 193594 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 381 | 4 | 0 | 4 | 6.6 | CCC(CC)c1cc(C)nn2c(-c3sc4ccc(F)cc4c3C)c(C)nc12 | 10.1016/j.ejmech.2021.113867 | |||
| 16126888 | 69974 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 336 | 5 | 0 | 3 | 5.8 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939569 | 69974 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 336 | 5 | 0 | 3 | 5.8 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| 24758071 | 69978 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 334 | 4 | 0 | 2 | 6.4 | CCC(CC)c1cc(C)n2nc(-c3cc(C)c(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939573 | 69978 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 334 | 4 | 0 | 2 | 6.4 | CCC(CC)c1cc(C)n2nc(-c3cc(C)c(C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| 58896526 | 176628 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 468 | 5 | 1 | 5 | 6.6 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(C(C)=O)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4592625 | 176628 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 468 | 5 | 1 | 5 | 6.6 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(C(C)=O)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4597886 | 176628 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 468 | 5 | 1 | 5 | 6.6 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(C(C)=O)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 53358603 | 130592 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 388 | 6 | 1 | 4 | 4.4 | CCc1cc(CC)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| CHEMBL3681375 | 130592 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 388 | 6 | 1 | 4 | 4.4 | CCc1cc(CC)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| 11164902 | 66302 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL184850 | 66302 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 54580962 | 60655 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 366 | 6 | 0 | 5 | 4.2 | CCCN(CCC)c1nc2c(c(-c3ccc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760259 | 60655 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 366 | 6 | 0 | 5 | 4.2 | CCCN(CCC)c1nc2c(c(-c3ccc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 44392573 | 64290 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 475 | 10 | 0 | 6 | 5.8 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(OC)cc1Cc1cccnc1 | 10.1021/jm049787k | |||
| CHEMBL181007 | 64290 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 475 | 10 | 0 | 6 | 5.8 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(OC)cc1Cc1cccnc1 | 10.1021/jm049787k | |||
| 44589206 | 176115 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 377 | 3 | 0 | 6 | 4.5 | Cc1cc(F)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL459174 | 176115 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 377 | 3 | 0 | 6 | 4.5 | Cc1cc(F)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 53358855 | 130595 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 413 | 4 | 1 | 3 | 5.2 | Cc1cn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1C | nan | |||
| CHEMBL3681378 | 130595 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 413 | 4 | 1 | 3 | 5.2 | Cc1cn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)nc1C | nan | |||
| 145958142 | 162058 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 383 | 6 | 1 | 6 | 4.8 | CCCCN(CC)c1nc(C)nc2c1sc(=N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | |||
| CHEMBL4160471 | 162058 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 383 | 6 | 1 | 6 | 4.8 | CCCCN(CC)c1nc(C)nc2c1sc(=N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | |||
| 46881695 | 6923 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 350 | 6 | 1 | 7 | 3.0 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1084414 | 6923 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 350 | 6 | 1 | 7 | 3.0 | COc1ccc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmc.2016.11.011 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmc.2016.11.011 | |||
| 42618180 | 184357 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 367 | 5 | 1 | 7 | 3.7 | COc1cc(C)c(-c2c(C)nn3c(NC4CCC4)nc(C)nc23)c(OC)c1 | 10.1021/jm9000242 | |||
| CHEMBL484419 | 184357 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 367 | 5 | 1 | 7 | 3.7 | COc1cc(C)c(-c2c(C)nn3c(NC4CCC4)nc(C)nc23)c(OC)c1 | 10.1021/jm9000242 | |||
| 42618232 | 184214 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 340 | 5 | 0 | 7 | 3.0 | CCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL483349 | 184214 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 340 | 5 | 0 | 7 | 3.0 | CCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 70909803 | 139453 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 468 | 8 | 1 | 5 | 7.2 | CCCN(CCC)c1c(Cl)cc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794050 | 139453 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 468 | 8 | 1 | 5 | 7.2 | CCCN(CCC)c1c(Cl)cc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 10110271 | 64739 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 379 | 6 | 2 | 6 | 4.6 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCN2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819063 | 64739 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 379 | 6 | 2 | 6 | 4.6 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCN2 | 10.1016/j.bmc.2011.07.055 | |||
| 53358857 | 130597 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 4 | 1 | 3 | 5.0 | O=C(N[C@H]1CC[C@H](Cn2ncc3c2CCC3)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | |||
| CHEMBL3681380 | 130597 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 425 | 4 | 1 | 3 | 5.0 | O=C(N[C@H]1CC[C@H](Cn2ncc3c2CCC3)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | |||
| 24768346 | 85552 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 381 | 7 | 1 | 6 | 4.5 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| CHEMBL227834 | 85552 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 381 | 7 | 1 | 6 | 4.5 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| 11188421 | 63889 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 388 | 7 | 0 | 4 | 5.4 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1 | 10.1021/jm049787k | |||
| CHEMBL180449 | 63889 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 388 | 7 | 0 | 4 | 5.4 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1 | 10.1021/jm049787k | |||
| 44589236 | 178357 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 405 | 5 | 0 | 8 | 4.1 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(OC)c1 | 10.1021/jm800743q | |||
| CHEMBL465216 | 178357 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 405 | 5 | 0 | 8 | 4.1 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(OC)c1 | 10.1021/jm800743q | |||
| 58223375 | 127867 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 475 | 11 | 0 | 9 | 4.6 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| CHEMBL3664580 | 127867 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 475 | 11 | 0 | 9 | 4.6 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| 44190912 | 196369 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(Cl)cc2C#N)c1=O | 10.1021/jm900302q | |||
| CHEMBL562550 | 196369 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(Cl)cc2C#N)c1=O | 10.1021/jm900302q | |||
| 44190824 | 196559 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 386 | 5 | 1 | 6 | 4.0 | COC[C@@H](C)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL563819 | 196559 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 386 | 5 | 1 | 6 | 4.0 | COC[C@@H](C)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 10108936 | 98013 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 356 | 7 | 1 | 4 | 4.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(N)=O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272910 | 98013 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 356 | 7 | 1 | 4 | 4.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(N)=O)cc2C)c1C | 10.1021/jm070578k | |||
| 137640280 | 156741 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 518 | 7 | 1 | 5 | 6.8 | CCN(CCC(F)(F)F)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4070523 | 156741 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 518 | 7 | 1 | 5 | 6.8 | CCN(CCC(F)(F)F)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 145968300 | 164981 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 376 | 5 | 1 | 4 | 5.8 | CCN(CC)c1cccc2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225516 | 164981 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 376 | 5 | 1 | 4 | 5.8 | CCN(CC)c1cccc2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2018.01.020 | |||
| 10224109 | 124033 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 422 | 7 | 0 | 4 | 6.1 | CCCCC(CC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL363023 | 124033 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 422 | 7 | 0 | 4 | 6.1 | CCCCC(CC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 11489867 | 12392 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 446 | 9 | 1 | 6 | 4.4 | COCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL1185656 | 12392 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 446 | 9 | 1 | 6 | 4.4 | COCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL425542 | 12392 | 0 | None | - | 0 | Rat | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 446 | 9 | 1 | 6 | 4.4 | COCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| 10108936 | 98013 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 356 | 7 | 1 | 4 | 4.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(N)=O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272910 | 98013 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 356 | 7 | 1 | 4 | 4.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(N)=O)cc2C)c1C | 10.1021/jm070578k | |||
| 24758074 | 69980 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 350 | 4 | 0 | 4 | 5.6 | CCC(CC)c1cc(C)n2nc(-c3cc4c(cc3C)OCO4)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939575 | 69980 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 350 | 4 | 0 | 4 | 5.6 | CCC(CC)c1cc(C)n2nc(-c3cc4c(cc3C)OCO4)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| 177990 | 426 | 23 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.ejmech.2017.07.016 | |||
| 3489 | 426 | 23 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.ejmech.2017.07.016 | |||
| CHEMBL296641 | 426 | 23 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.ejmech.2017.07.016 | |||
| 177990 | 426 | 23 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.ejmech.2014.03.040 | |||
| 3489 | 426 | 23 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.ejmech.2014.03.040 | |||
| CHEMBL296641 | 426 | 23 | None | -1 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/j.ejmech.2014.03.040 | |||
| 44190560 | 196155 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 6 | 1 | 6 | 3.9 | CCc1cn([C@H](C)C2CC2)c(=O)c(Nc2ccc(OC)nc2C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL561226 | 196155 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 6 | 1 | 6 | 3.9 | CCc1cn([C@H](C)C2CC2)c(=O)c(Nc2ccc(OC)nc2C(F)(F)F)n1 | 10.1021/jm900301y | |||
| 44190244 | 196720 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 337 | 5 | 1 | 4 | 4.7 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2ccc(Cl)cc2)c1=O | 10.1021/jm900301y | |||
| CHEMBL564968 | 196720 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 337 | 5 | 1 | 4 | 4.7 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2ccc(Cl)cc2)c1=O | 10.1021/jm900301y | |||
| 21912198 | 97700 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 341 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1c(C)c(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271332 | 97700 | 0 | None | - | 0 | Rat | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 341 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1c(C)c(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 53357142 | 130599 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 440 | 5 | 1 | 4 | 5.3 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@@H](Cn2nc(-c3ccc(F)cc3)cc2C)CC1 | nan | |||
| CHEMBL3681382 | 130599 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 440 | 5 | 1 | 4 | 5.3 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@@H](Cn2nc(-c3ccc(F)cc3)cc2C)CC1 | nan | |||
| 11773483 | 65573 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL183148 | 65573 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 11773483 | 65573 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL183148 | 65573 | 0 | None | - | 1 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 155567202 | 175965 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 492 | 8 | 1 | 6 | 7.6 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccc(OC(C)C)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4588387 | 175965 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 492 | 8 | 1 | 6 | 7.6 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccc(OC(C)C)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 21912198 | 97700 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 341 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1c(C)c(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271332 | 97700 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 341 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1c(C)c(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 70682294 | 76617 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063380 | 76617 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 70682294 | 76617 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2063380 | 76617 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 394 | 8 | 0 | 5 | 5.2 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | |||
| 58223471 | 127869 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 463 | 12 | 0 | 9 | 4.3 | COCCN(CC(C)C)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664582 | 127869 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 463 | 12 | 0 | 9 | 4.3 | COCCN(CC(C)C)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 71580311 | 88436 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 431 | 9 | 1 | 8 | 3.3 | COc1nc(Cl)nc(C)c1Nc1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349562 | 88436 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 431 | 9 | 1 | 8 | 3.3 | COc1nc(Cl)nc(C)c1Nc1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| 46890978 | 6733 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 312 | 4 | 1 | 5 | 3.6 | Cc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083724 | 6733 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 312 | 4 | 1 | 5 | 3.6 | Cc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| 44190448 | 195133 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 439 | 4 | 0 | 6 | 4.2 | COc1cc(Br)c2c(c1)OCCN2c1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| CHEMBL550140 | 195133 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 439 | 4 | 0 | 6 | 4.2 | COc1cc(Br)c2c(c1)OCCN2c1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| 44191111 | 196479 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 362 | 4 | 1 | 5 | 4.4 | Cc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C#N | 10.1021/jm900302q | |||
| CHEMBL563313 | 196479 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 362 | 4 | 1 | 5 | 4.4 | Cc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C#N | 10.1021/jm900302q | |||
| 57397277 | 69991 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 381 | 6 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939586 | 69991 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 381 | 6 | 0 | 5 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C(C)C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 42618175 | 184784 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 413 | 10 | 1 | 8 | 3.6 | CCOCC(COCC)Nc1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL485140 | 184784 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 413 | 10 | 1 | 8 | 3.6 | CCOCC(COCC)Nc1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 9885105 | 97999 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 6.1 | CCOc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL272826 | 97999 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 6.1 | CCOc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 11291949 | 127509 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL366155 | 127509 | 0 | None | - | 1 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10216313 | 64355 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 7 | 0 | 6 | 4.5 | CCCC(CCC)n1c(CC)nc2c1c(=O)n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1021/jm049787k | |||
| CHEMBL181258 | 64355 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 7 | 0 | 6 | 4.5 | CCCC(CCC)n1c(CC)nc2c1c(=O)n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1021/jm049787k | |||
| 60156090 | 77576 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 536 | 11 | 0 | 9 | 5.4 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4(C#N)CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087798 | 77576 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 536 | 11 | 0 | 9 | 5.4 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4(C#N)CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 11441103 | 175868 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 405 | 4 | 0 | 7 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(N5CCOC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL458600 | 175868 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 405 | 4 | 0 | 7 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(N5CCOC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 70682070 | 75899 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 390 | 8 | 2 | 4 | 7.0 | CCCC(CCC)Nc1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049189 | 75899 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 390 | 8 | 2 | 4 | 7.0 | CCCC(CCC)Nc1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 11260682 | 11755 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 392 | 5 | 2 | 4 | 5.4 | CCC(CC)Nc1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL1181621 | 11755 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 392 | 5 | 2 | 4 | 5.4 | CCC(CC)Nc1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL185736 | 11755 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 392 | 5 | 2 | 4 | 5.4 | CCC(CC)Nc1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL526149 | 215675 | 10 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(N)=O | 10.1021/jm9000242 | |||||
| 57390212 | 70007 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 367 | 5 | 0 | 5 | 4.5 | CCC(CC)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939601 | 70007 | 0 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 367 | 5 | 0 | 5 | 4.5 | CCC(CC)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL526149 | 215675 | 10 | None | - | 0 | Human | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | None | None | None | CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(N)=O | 10.1021/jm900025h | |||||
| 9949999 | 97583 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL270764 | 97583 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC)cc2C)c1C | 10.1021/jm070578k | |||
| 9949999 | 97583 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL270764 | 97583 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 343 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(OC)cc2C)c1C | 10.1021/jm070578k | |||
| 46891090 | 6821 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 418 | 7 | 1 | 6 | 5.0 | CCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083947 | 6821 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 418 | 7 | 1 | 6 | 5.0 | CCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46881794 | 7337 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 384 | 6 | 1 | 6 | 4.2 | Cc1cc(OC(F)F)nc(C)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1086181 | 7337 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 384 | 6 | 1 | 6 | 4.2 | Cc1cc(OC(F)F)nc(C)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 44190146 | 197835 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 381 | 8 | 1 | 7 | 3.1 | COCC(COC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL572347 | 197835 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 381 | 8 | 1 | 7 | 3.1 | COCC(COC)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 42618179 | 184534 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 383 | 7 | 1 | 7 | 4.3 | CCCC(C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL484781 | 184534 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 383 | 7 | 1 | 7 | 4.3 | CCCC(C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618171 | 179997 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 378 | 7 | 0 | 7 | 3.9 | CCCN(CCC#N)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474700 | 179997 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 378 | 7 | 0 | 7 | 3.9 | CCCN(CCC#N)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 24768332 | 85583 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 385 | 8 | 1 | 7 | 4.0 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| CHEMBL228168 | 85583 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 385 | 8 | 1 | 7 | 4.0 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| 11176967 | 67242 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 397 | 6 | 1 | 5 | 4.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL187987 | 67242 | 0 | None | - | 0 | Rat | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 397 | 6 | 1 | 5 | 4.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1Cl | 10.1021/jm049737f | |||
| 46891437 | 6412 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 399 | 7 | 1 | 8 | 2.7 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082358 | 6412 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 399 | 7 | 1 | 8 | 2.7 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 42618169 | 180837 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL475705 | 180837 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 44190916 | 196746 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 5.6 | CC[C@H](COC)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL565182 | 196746 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 443 | 6 | 1 | 5 | 5.6 | CC[C@H](COC)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 11588927 | 65507 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 5.4 | CCc1cc(OC)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830524 | 65507 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 377 | 7 | 1 | 6 | 5.4 | CCc1cc(OC)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | |||
| 71456930 | 81990 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 409 | 9 | 1 | 6 | 4.2 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OCCF)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165196 | 81990 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 409 | 9 | 1 | 6 | 4.2 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OCCF)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 46891438 | 6413 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 413 | 8 | 1 | 8 | 3.1 | CCOc1ccc(Nc2nc(C)nn([C@@H](COC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082359 | 6413 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 413 | 8 | 1 | 8 | 3.1 | CCOc1ccc(Nc2nc(C)nn([C@@H](COC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 44190336 | 194931 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 345 | 5 | 1 | 4 | 4.9 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL541756 | 194931 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 345 | 5 | 1 | 4 | 4.9 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 44189949 | 195961 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 361 | 7 | 1 | 4 | 5.7 | CCCC(CCC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL559633 | 195961 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 361 | 7 | 1 | 4 | 5.7 | CCCC(CCC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 44190239 | 196637 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| CHEMBL564303 | 196637 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| 42618235 | 184192 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 382 | 8 | 0 | 7 | 4.1 | CCCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL483162 | 184192 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 382 | 8 | 0 | 7 | 4.1 | CCCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 44190239 | 196637 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL564303 | 196637 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 42618191 | 184359 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 394 | 7 | 0 | 8 | 3.5 | CCN(CCC#N)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL484421 | 184359 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 394 | 7 | 0 | 8 | 3.5 | CCN(CCC#N)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618168 | 180656 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL475506 | 180656 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 57393711 | 69975 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 353 | 5 | 0 | 5 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939570 | 69975 | 0 | None | - | 0 | Human | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 353 | 5 | 0 | 5 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 9952426 | 97703 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271344 | 97703 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070578k | |||
| 11249766 | 11759 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 430 | 8 | 1 | 5 | 5.1 | CCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL1181636 | 11759 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 430 | 8 | 1 | 5 | 5.1 | CCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL186517 | 11759 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 430 | 8 | 1 | 5 | 5.1 | CCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049737f | |||
| 9952426 | 97703 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271344 | 97703 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070578k | |||
| 46891287 | 6881 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 397 | 6 | 1 | 7 | 3.8 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084203 | 6881 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 397 | 6 | 1 | 7 | 3.8 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46881747 | 5596 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 362 | 6 | 1 | 6 | 4.0 | CCOc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1077249 | 5596 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 362 | 6 | 1 | 6 | 4.0 | CCOc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.01.129 | |||
| 42618193 | 184158 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL482976 | 184158 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 413 | 9 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 44190149 | 195060 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 5.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| CHEMBL549538 | 195060 | 0 | None | - | 0 | Rat | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 5.2 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| 136164073 | 8156 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 411 | 7 | 2 | 7 | 3.5 | COCC(COC)NC1NC(C)=Nc2c(-c3ccc(Cl)cc3Cl)c(C)nn21 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1091818 | 8156 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 411 | 7 | 2 | 7 | 3.5 | COCC(COC)NC1NC(C)=Nc2c(-c3ccc(Cl)cc3Cl)c(C)nn21 | 10.1016/j.bmcl.2010.01.129 | |||
| 15485770 | 197594 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 333 | 5 | 1 | 4 | 4.9 | CCC(CC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL570546 | 197594 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 333 | 5 | 1 | 4 | 4.9 | CCC(CC)n1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 42618178 | 191689 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL519677 | 191689 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 44190827 | 196157 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 362 | 4 | 1 | 5 | 4.4 | Cc1cc(C#N)cc(Cl)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900302q | |||
| CHEMBL561230 | 196157 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 362 | 4 | 1 | 5 | 4.4 | Cc1cc(C#N)cc(Cl)c1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900302q | |||
| 58223380 | 127868 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.0 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCCC1 | nan | |||
| CHEMBL3664581 | 127868 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.0 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCCC1 | nan | |||
| 56663336 | 65310 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 8 | 0 | 6 | 4.8 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828896 | 65310 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 8 | 0 | 6 | 4.8 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 56683765 | 65505 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1nc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830522 | 65505 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1nc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 21984697 | 77550 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 409 | 9 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CCCF)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087558 | 77550 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 409 | 9 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CCCF)CC1CC1 | 10.1021/jm300259r | |||
| 46891336 | 6407 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 359 | 7 | 1 | 8 | 2.3 | COCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082340 | 6407 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 359 | 7 | 1 | 8 | 2.3 | COCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891092 | 7232 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 416 | 5 | 1 | 7 | 3.4 | Cc1nc(Nc2c(Cl)cc(S(C)(=O)=O)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1085734 | 7232 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 416 | 5 | 1 | 7 | 3.4 | Cc1nc(Nc2c(Cl)cc(S(C)(=O)=O)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 9885105 | 97999 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 6.1 | CCOc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL272826 | 97999 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 6.1 | CCOc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 57786312 | 164966 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 423 | 4 | 0 | 4 | 6.6 | CCC(OC)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225316 | 164966 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 423 | 4 | 0 | 4 | 6.6 | CCC(OC)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 21084107 | 77558 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 479 | 10 | 1 | 7 | 4.7 | CCc1nn2c(-c3c(OC)cc(CO)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087566 | 77558 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 479 | 10 | 1 | 7 | 4.7 | CCc1nn2c(-c3c(OC)cc(CO)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 11177197 | 167641 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 404 | 7 | 1 | 4 | 6.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4226111 | 167641 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 404 | 7 | 1 | 4 | 6.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4301639 | 167641 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 404 | 7 | 1 | 4 | 6.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2018.01.020 | |||
| 71458704 | 81517 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 9 | 0 | 6 | 4.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160167 | 81517 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 410 | 9 | 0 | 6 | 4.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)ccc12 | 10.1016/j.bmc.2012.09.028 | |||
| 44589304 | 176020 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 388 | 3 | 0 | 7 | 4.1 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(F)c1 | 10.1021/jm800743q | |||
| CHEMBL458981 | 176020 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 388 | 3 | 0 | 7 | 4.1 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(F)c1 | 10.1021/jm800743q | |||
| 53328045 | 130606 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 441 | 6 | 1 | 3 | 5.7 | CCc1cc(CC)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | |||
| CHEMBL3681389 | 130606 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 441 | 6 | 1 | 3 | 5.7 | CCc1cc(CC)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)n1 | nan | |||
| 71449777 | 81993 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 453 | 10 | 1 | 7 | 4.1 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(OCCF)cc2Cl)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165199 | 81993 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 453 | 10 | 1 | 7 | 4.1 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(OCCF)cc2Cl)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 24768338 | 85540 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 415 | 9 | 1 | 8 | 3.5 | CCCN(CCOC)c1nc(C)nc2c1NCCN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL227724 | 85540 | 0 | None | - | 0 | Rat | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 415 | 9 | 1 | 8 | 3.5 | CCCN(CCOC)c1nc(C)nc2c1NCCN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| 57786300 | 164948 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 407 | 3 | 0 | 4 | 6.1 | CCC(=O)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4224989 | 164948 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 407 | 3 | 0 | 4 | 6.1 | CCC(=O)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 57785808 | 164949 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 489 | 5 | 0 | 6 | 6.0 | CCc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225039 | 164949 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 489 | 5 | 0 | 6 | 6.0 | CCc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| 70690703 | 76610 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 380 | 6 | 0 | 5 | 4.7 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(C)C)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063371 | 76610 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 380 | 6 | 0 | 5 | 4.7 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(C)C)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| 56683689 | 65315 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 10 | 0 | 6 | 5.6 | CCCN(CCC)c1cc(N(CC2CC2)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828901 | 65315 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 427 | 10 | 0 | 6 | 5.6 | CCCN(CCC)c1cc(N(CC2CC2)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 44589306 | 174988 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 406 | 5 | 0 | 9 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(OC)n1 | 10.1021/jm800743q | |||
| CHEMBL456651 | 174988 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 406 | 5 | 0 | 9 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(OC)n1 | 10.1021/jm800743q | |||
| 53358856 | 130596 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 413 | 4 | 1 | 3 | 5.2 | Cc1cnn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1C | nan | |||
| CHEMBL3681379 | 130596 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 413 | 4 | 1 | 3 | 5.2 | Cc1cnn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c1C | nan | |||
| 58896446 | 139505 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 8 | 1 | 4 | 7.0 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3C(C)C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3792636 | 139505 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 8 | 1 | 4 | 7.0 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3C(C)C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794595 | 139505 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 412 | 8 | 1 | 4 | 7.0 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3C(C)C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 60155708 | 77553 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 447 | 8 | 0 | 5 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087561 | 77553 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 447 | 8 | 0 | 5 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 60155709 | 77554 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 463 | 9 | 0 | 6 | 5.5 | CCc1nn2c(-c3c(OC)cc(C)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087562 | 77554 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 463 | 9 | 0 | 6 | 5.5 | CCc1nn2c(-c3c(OC)cc(C)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 10135150 | 64751 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4cc(C)c(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819075 | 64751 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4cc(C)c(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 22177742 | 64762 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 5.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819087 | 64762 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 5.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | |||
| 24964084 | 156544 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 419 | 6 | 1 | 4 | 6.0 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(C(N)=O)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4068170 | 156544 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 419 | 6 | 1 | 4 | 6.0 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(C(N)=O)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 11948286 | 156669 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4069551 | 156669 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 53357920 | 130611 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 427 | 5 | 1 | 3 | 5.4 | CCc1cc(C)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | |||
| CHEMBL3681394 | 130611 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 427 | 5 | 1 | 3 | 5.4 | CCc1cc(C)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | |||
| 10294192 | 65206 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 5.7 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1c(C)cc(C)cc1C | 10.1021/jm049787k | |||
| CHEMBL182550 | 65206 | 0 | None | - | 0 | Rat | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 5.7 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1c(C)cc(C)cc1C | 10.1021/jm049787k | |||
| 58896429 | 173325 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 7 | 1 | 6 | 7.1 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(CC3CCOC3)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4526475 | 173325 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 510 | 7 | 1 | 6 | 7.1 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(CC3CCOC3)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 58896417 | 139501 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 426 | 8 | 1 | 4 | 7.3 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)n(-c3ccccc3)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793751 | 139501 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 426 | 8 | 1 | 4 | 7.3 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)n(-c3ccccc3)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794591 | 139501 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 426 | 8 | 1 | 4 | 7.3 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)n(-c3ccccc3)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 58223481 | 82599 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 517 | 11 | 1 | 10 | 4.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4(O)CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179177 | 82599 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 517 | 11 | 1 | 10 | 4.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4(O)CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 44589331 | 175480 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 378 | 3 | 0 | 6 | 4.2 | Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4ccccn4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL457741 | 175480 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 378 | 3 | 0 | 6 | 4.2 | Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4ccccn4)n3)ccnc21 | 10.1021/jm800743q | |||
| 71453343 | 81511 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160160 | 81511 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 412 | 8 | 0 | 5 | 5.4 | CCN(CC)c1ccc(F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 44589239 | 190490 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 404 | 3 | 0 | 7 | 4.6 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| CHEMBL517910 | 190490 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 404 | 3 | 0 | 7 | 4.6 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| 46891491 | 6946 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCOc1ccc(Nc2nc(C)nn([C@@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084500 | 6946 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCOc1ccc(Nc2nc(C)nn([C@@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 46891390 | 7122 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 434 | 8 | 1 | 7 | 4.2 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1085244 | 7122 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 434 | 8 | 1 | 7 | 4.2 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 42618217 | 184623 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 400 | 9 | 0 | 9 | 2.2 | COCCN(CCOC)c1nc(C)nc2c(-c3cnc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL484930 | 184623 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 400 | 9 | 0 | 9 | 2.2 | COCCN(CCOC)c1nc(C)nc2c(-c3cnc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 44589256 | 189642 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 457 | 4 | 0 | 8 | 4.1 | CS(=O)(=O)c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| CHEMBL515070 | 189642 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 457 | 4 | 0 | 8 | 4.1 | CS(=O)(=O)c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| 58223424 | 127871 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 431 | 9 | 0 | 8 | 4.6 | CCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCC1 | nan | |||
| CHEMBL3664584 | 127871 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 431 | 9 | 0 | 8 | 4.6 | CCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCC1 | nan | |||
| 127030314 | 139389 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 6 | 1 | 5 | 5.8 | CCN(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793277 | 139389 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 6 | 1 | 5 | 5.8 | CCN(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 21984771 | 77545 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087553 | 77545 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 403 | 8 | 0 | 4 | 5.8 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CC1 | 10.1021/jm300259r | |||
| 127030314 | 139389 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 6 | 1 | 5 | 5.8 | CCN(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL3793277 | 139389 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 6 | 1 | 5 | 5.8 | CCN(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 42618176 | 184354 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 337 | 4 | 1 | 6 | 3.7 | COc1ccc(-c2c(C)nn3c(NC4CCC4)nc(C)nc23)c(C)c1 | 10.1021/jm9000242 | |||
| CHEMBL484407 | 184354 | 1 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 337 | 4 | 1 | 6 | 3.7 | COc1ccc(-c2c(C)nn3c(NC4CCC4)nc(C)nc23)c(C)c1 | 10.1021/jm9000242 | |||
| 42618216 | 192119 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 367 | 6 | 1 | 7 | 3.8 | CCC(CC)Nc1nc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL520344 | 192119 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 367 | 6 | 1 | 7 | 3.8 | CCC(CC)Nc1nc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 22177988 | 64742 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 364 | 6 | 1 | 5 | 4.8 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)cnn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819066 | 64742 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 364 | 6 | 1 | 5 | 4.8 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)cnn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 46881863 | 5602 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 365 | 6 | 1 | 8 | 2.7 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1077299 | 5602 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 365 | 6 | 1 | 8 | 2.7 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| 90654669 | 110074 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 9 | 1 | 5 | 6.2 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)c1SCC | 10.1016/j.ejmech.2014.03.040 | |||
| CHEMBL3235706 | 110074 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 398 | 9 | 1 | 5 | 6.2 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)c1SCC | 10.1016/j.ejmech.2014.03.040 | |||
| 70688637 | 76616 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 490 | 9 | 0 | 6 | 6.1 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063377 | 76616 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 490 | 9 | 0 | 6 | 6.1 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| 58223432 | 127856 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 477 | 14 | 0 | 9 | 4.9 | CCCCN(CCOC)c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12 | nan | |||
| CHEMBL3664569 | 127856 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 477 | 14 | 0 | 9 | 4.9 | CCCCN(CCOC)c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12 | nan | |||
| 58223378 | 127863 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 475 | 12 | 0 | 9 | 4.5 | COCCN(CC1CCC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664576 | 127863 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 475 | 12 | 0 | 9 | 4.5 | COCCN(CC1CCC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 60155887 | 77573 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 465 | 9 | 0 | 7 | 5.0 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(OC)nn12 | 10.1021/jm300259r | |||
| CHEMBL2087795 | 77573 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 465 | 9 | 0 | 7 | 5.0 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(OC)nn12 | 10.1021/jm300259r | |||
| 21912058 | 97699 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 356 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N(C)C | 10.1021/jm070578k | |||
| CHEMBL271329 | 97699 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 356 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N(C)C | 10.1021/jm070578k | |||
| 155552287 | 174072 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 465 | 7 | 1 | 7 | 6.2 | COc1ccc(N(c2cccc3nc(Nc4c(C)cc(Cl)cc4OC)n(C)c23)C(C)C)cn1 | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4544244 | 174072 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 465 | 7 | 1 | 7 | 6.2 | COc1ccc(N(c2cccc3nc(Nc4c(C)cc(Cl)cc4OC)n(C)c23)C(C)C)cn1 | 10.1016/j.bmc.2016.08.005 | |||
| 58896465 | 176096 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 7.5 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccc(Cl)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4591335 | 176096 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 468 | 6 | 1 | 5 | 7.5 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccc(Cl)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 10204603 | 63345 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 4 | 0 | 4 | 6.8 | CCC(CC)n1cc2c3c(nc(C)nc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL179435 | 63345 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 456 | 4 | 0 | 4 | 6.8 | CCC(CC)n1cc2c3c(nc(C)nc31)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 21912058 | 97699 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 356 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N(C)C | 10.1021/jm070578k | |||
| CHEMBL271329 | 97699 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 356 | 7 | 0 | 4 | 5.7 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1N(C)C | 10.1021/jm070578k | |||
| 42618207 | 179806 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 381 | 6 | 1 | 7 | 4.1 | CCC(CC)Nc1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL474491 | 179806 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 381 | 6 | 1 | 7 | 4.1 | CCC(CC)Nc1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 58896492 | 139500 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 350 | 7 | 2 | 3 | 5.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)[nH]c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793362 | 139500 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 350 | 7 | 2 | 3 | 5.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)[nH]c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794590 | 139500 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 350 | 7 | 2 | 3 | 5.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)[nH]c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 71457263 | 82616 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 445 | 9 | 0 | 8 | 4.6 | CCCN(c1c(OC)nn2c(-c3ccc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179194 | 82616 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 445 | 9 | 0 | 8 | 4.6 | CCCN(c1c(OC)nn2c(-c3ccc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 58317279 | 126537 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 4.5 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C)c(Cl)c2C)CC1 | nan | |||
| CHEMBL3652115 | 126537 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 4.5 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(C)c(Cl)c2C)CC1 | nan | |||
| 44589329 | 175642 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 403 | 4 | 0 | 8 | 3.9 | Cc1nc(N(C)C)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL458101 | 175642 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 403 | 4 | 0 | 8 | 3.9 | Cc1nc(N(C)C)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 44589223 | 189525 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 443 | 4 | 0 | 7 | 5.3 | Cc1cc(OC(F)(F)F)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL514126 | 189525 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 443 | 4 | 0 | 7 | 5.3 | Cc1cc(OC(F)(F)F)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 58223390 | 127844 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 433 | 11 | 0 | 8 | 4.9 | CCCN(CCC)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664557 | 127844 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 433 | 11 | 0 | 8 | 4.9 | CCCN(CCC)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58223381 | 127861 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 475 | 11 | 0 | 9 | 4.6 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOC1 | nan | |||
| CHEMBL3664574 | 127861 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 475 | 11 | 0 | 9 | 4.6 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOC1 | nan | |||
| 58223490 | 127878 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 445 | 9 | 0 | 8 | 5.0 | CCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| CHEMBL3664590 | 127878 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 445 | 9 | 0 | 8 | 5.0 | CCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| 46891288 | 6882 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 329 | 5 | 1 | 7 | 2.7 | COc1nc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084204 | 6882 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 329 | 5 | 1 | 7 | 2.7 | COc1nc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.04.121 | |||
| 11304337 | 64847 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 4 | 0 | 4 | 5.3 | CCc1nc2c(n1C(C)C1CCC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL182068 | 64847 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 406 | 4 | 0 | 4 | 5.3 | CCc1nc2c(n1C(C)C1CCC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 46891229 | 6548 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 407 | 4 | 1 | 6 | 4.4 | Cc1nc(Nc2c(Cl)cc(C(F)(F)F)nc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082956 | 6548 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 407 | 4 | 1 | 6 | 4.4 | Cc1nc(Nc2c(Cl)cc(C(F)(F)F)nc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 53357410 | 126538 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 360 | 4 | 1 | 4 | 3.8 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| CHEMBL3652116 | 126538 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 360 | 4 | 1 | 4 | 3.8 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| 60155989 | 77577 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 513 | 11 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CC4)CC4COCCO4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087799 | 77577 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 513 | 11 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CC4)CC4COCCO4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 46891552 | 7342 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 413 | 8 | 1 | 8 | 3.1 | CCOc1ccc(Nc2nc(C)nn([C@H](COC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086239 | 7342 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 413 | 8 | 1 | 8 | 3.1 | CCOc1ccc(Nc2nc(C)nn([C@H](COC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 58896411 | 176205 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 464 | 7 | 1 | 6 | 6.8 | COc1ccc(N(c2cccc3nc(Nc4c(C)cc(Cl)cc4OC)n(C)c23)C(C)C)cc1 | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4593848 | 176205 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 464 | 7 | 1 | 6 | 6.8 | COc1ccc(N(c2cccc3nc(Nc4c(C)cc(Cl)cc4OC)n(C)c23)C(C)C)cc1 | 10.1016/j.bmc.2016.08.005 | |||
| 10136833 | 122343 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 418 | 8 | 0 | 5 | 5.4 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(OC)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL359923 | 122343 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 418 | 8 | 0 | 5 | 5.4 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(OC)cc1Cl | 10.1021/jm049787k | |||
| 44589092 | 176015 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 481 | 3 | 0 | 6 | 6.1 | FC(F)(F)c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| CHEMBL458968 | 176015 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 481 | 3 | 0 | 6 | 6.1 | FC(F)(F)c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| 46891187 | 6643 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 363 | 4 | 1 | 6 | 3.8 | Cc1nc(Nc2cc(Cl)c(C#N)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083342 | 6643 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 363 | 4 | 1 | 6 | 3.8 | Cc1nc(Nc2cc(Cl)c(C#N)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 137635894 | 155911 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 507 | 7 | 1 | 6 | 5.0 | CCN(CC(=O)N(C)C)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4060825 | 155911 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 507 | 7 | 1 | 6 | 5.0 | CCN(CC(=O)N(C)C)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 57786068 | 165047 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 389 | 4 | 0 | 4 | 5.3 | CCN(CC)c1cccc2nc3n(c12)CCOC3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4226353 | 165047 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 389 | 4 | 0 | 4 | 5.3 | CCN(CC)c1cccc2nc3n(c12)CCOC3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 90654666 | 110071 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 404 | 10 | 1 | 7 | 4.3 | COCCN(CCOC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)c1SC | 10.1016/j.ejmech.2014.03.040 | |||
| CHEMBL3235700 | 110071 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 404 | 10 | 1 | 7 | 4.3 | COCCN(CCOC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)c1SC | 10.1016/j.ejmech.2014.03.040 | |||
| 25149257 | 189543 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 397 | 3 | 0 | 8 | 4.2 | Cc1cc(-n2ccc(-c3nccs3)n2)c2cnn(-c3ccc(C#N)cc3C)c2n1 | 10.1021/jm800743q | |||
| CHEMBL514272 | 189543 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 397 | 3 | 0 | 8 | 4.2 | Cc1cc(-n2ccc(-c3nccs3)n2)c2cnn(-c3ccc(C#N)cc3C)c2n1 | 10.1021/jm800743q | |||
| 70692845 | 76607 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 422 | 10 | 0 | 5 | 6.0 | CCCN(CCC)c1cccc2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063368 | 76607 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 422 | 10 | 0 | 5 | 6.0 | CCCN(CCC)c1cccc2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 46891156 | 7237 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 342 | 6 | 1 | 6 | 3.7 | CCOc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1085754 | 7237 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 342 | 6 | 1 | 6 | 3.7 | CCOc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.04.121 | |||
| 21912152 | 95962 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 5.6 | CCC(C)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL259467 | 95962 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 5.6 | CCC(C)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm800744m | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm800744m | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm800744m | |||
| 21912152 | 95962 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 5.6 | CCC(C)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL259467 | 95962 | 0 | None | - | 0 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 313 | 5 | 0 | 3 | 5.6 | CCC(C)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 44190339 | 196120 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 363 | 6 | 2 | 6 | 3.6 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(O)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL561024 | 196120 | 0 | None | - | 0 | Rat | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 363 | 6 | 2 | 6 | 3.6 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(O)cc2C)c1=O | 10.1021/jm900301y | |||
| 70692847 | 76615 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 504 | 10 | 0 | 6 | 6.3 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CCOCC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063376 | 76615 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 504 | 10 | 0 | 6 | 6.3 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CCOCC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| 71458702 | 81514 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 8 | 0 | 5 | 6.2 | CCN(CC)c1ccc(C(F)(F)F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160163 | 81514 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 462 | 8 | 0 | 5 | 6.2 | CCN(CC)c1ccc(C(F)(F)F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 11774042 | 203352 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL65078 | 203352 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm040058e | |||
| 58223393 | 127832 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 465 | 10 | 1 | 8 | 4.6 | CCCN(CCC)c1c(C)nn2c(-c3c(O)cc(COC)cc3OC)c([S+](C)[O-])sc12 | nan | |||
| CHEMBL3664545 | 127832 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 465 | 10 | 1 | 8 | 4.6 | CCCN(CCC)c1c(C)nn2c(-c3c(O)cc(COC)cc3OC)c([S+](C)[O-])sc12 | nan | |||
| 10309819 | 65216 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 408 | 5 | 0 | 6 | 4.1 | CCc1nc2c(c(=O)n(C)c(=O)n2-c2ccc(Cl)cc2Cl)n1C(CC)CC | 10.1021/jm049787k | |||
| CHEMBL182591 | 65216 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 408 | 5 | 0 | 6 | 4.1 | CCc1nc2c(c(=O)n(C)c(=O)n2-c2ccc(Cl)cc2Cl)n1C(CC)CC | 10.1021/jm049787k | |||
| 56668632 | 64758 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 434 | 7 | 1 | 5 | 6.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC(F)F)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819083 | 64758 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 434 | 7 | 1 | 5 | 6.0 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC(F)F)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 46891286 | 6623 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 413 | 8 | 1 | 8 | 3.1 | CCOc1ccc(Nc2nc(C)nn(C(COC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083293 | 6623 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 413 | 8 | 1 | 8 | 3.1 | CCOc1ccc(Nc2nc(C)nn(C(COC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 42618219 | 184134 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCC(CC)Nc1nc(C)nc2c(-c3cnc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL482752 | 184134 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCC(CC)Nc1nc(C)nc2c(-c3cnc(OC)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 42618229 | 189797 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 396 | 8 | 0 | 8 | 3.0 | COCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL516242 | 189797 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 396 | 8 | 0 | 8 | 3.0 | COCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 42618220 | 191884 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL519967 | 191884 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 44190730 | 195973 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cn([C@H](C)C2CC2)c(=O)c(Nc2c(C)cc(Cl)cc2C)n1 | 10.1021/jm900302q | |||
| CHEMBL559701 | 195973 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cn([C@H](C)C2CC2)c(=O)c(Nc2c(C)cc(Cl)cc2C)n1 | 10.1021/jm900302q | |||
| 21912269 | 168910 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(COC)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL438553 | 168910 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(COC)cc2C)c1C | 10.1021/jm070578k | |||
| 11153312 | 65506 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 383 | 6 | 1 | 6 | 5.5 | CCC(CC)n1ccc2c(Nc3ccc(OC)cc3Cl)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830523 | 65506 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 383 | 6 | 1 | 6 | 5.5 | CCC(CC)n1ccc2c(Nc3ccc(OC)cc3Cl)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | |||
| 71580316 | 88441 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 441 | 8 | 0 | 6 | 4.2 | COc1cc(Cl)c2c(c1)CCN2c1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349567 | 88441 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 441 | 8 | 0 | 6 | 4.2 | COc1cc(Cl)c2c(c1)CCN2c1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| 21912269 | 168910 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(COC)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL438553 | 168910 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 357 | 8 | 0 | 4 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(COC)cc2C)c1C | 10.1021/jm070578k | |||
| 42618192 | 192593 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 409 | 5 | 0 | 7 | 4.5 | CCC1CCCCN1c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL521457 | 192593 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 409 | 5 | 0 | 7 | 4.5 | CCC1CCCCN1c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 57398971 | 69995 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 393 | 7 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939590 | 69995 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 393 | 7 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 24768339 | 85566 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 377 | 6 | 1 | 5 | 4.3 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| CHEMBL227946 | 85566 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 377 | 6 | 1 | 5 | 4.3 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| 11421422 | 11765 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 431 | 6 | 1 | 5 | 5.3 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1c(Cl)cc(C#N)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL1181649 | 11765 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 431 | 6 | 1 | 5 | 5.3 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1c(Cl)cc(C#N)cc1Cl | 10.1021/jm049737f | |||
| CHEMBL187410 | 11765 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 431 | 6 | 1 | 5 | 5.3 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1c(Cl)cc(C#N)cc1Cl | 10.1021/jm049737f | |||
| 9820671 | 188818 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL506214 | 188818 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 24768340 | 142925 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 363 | 6 | 1 | 5 | 4.8 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| CHEMBL389387 | 142925 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 363 | 6 | 1 | 5 | 4.8 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| 46891387 | 6484 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 369 | 5 | 1 | 7 | 3.1 | COc1ccc(Nc2nc(C)nn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082669 | 6484 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 369 | 5 | 1 | 7 | 3.1 | COc1ccc(Nc2nc(C)nn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 42618223 | 179275 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCCC(C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL473069 | 179275 | 0 | None | - | 0 | Rat | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCCC(C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 46891285 | 6622 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 397 | 7 | 1 | 7 | 3.9 | CCOc1ccc(Nc2nc(C)nn(C(CC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083292 | 6622 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 397 | 7 | 1 | 7 | 3.9 | CCOc1ccc(Nc2nc(C)nn(C(CC)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 46891231 | 6696 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCC(C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083590 | 6696 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCC(C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891232 | 6697 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 7 | 1 | 8 | 2.7 | COCC(C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083591 | 6697 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 7 | 1 | 8 | 2.7 | COCC(C1CC1)n1nc(C)nc(Nc2ccc(OC)nc2C(F)(F)F)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 9858549 | 97670 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 5.9 | CCC(CC)Oc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL271197 | 97670 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 5.9 | CCC(CC)Oc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| 44191009 | 196218 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 455 | 7 | 1 | 4 | 7.1 | CCCC(CCC)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL561553 | 196218 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 455 | 7 | 1 | 4 | 7.1 | CCCC(CCC)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 9858549 | 97670 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 5.9 | CCC(CC)Oc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL271197 | 97670 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 5.9 | CCC(CC)Oc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| 42618182 | 191901 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 397 | 8 | 0 | 7 | 4.4 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL519999 | 191901 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 397 | 8 | 0 | 7 | 4.4 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 57397276 | 69976 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 373 | 5 | 0 | 5 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939571 | 69976 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 373 | 5 | 0 | 5 | 4.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 57393713 | 69998 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939593 | 69998 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 44190556 | 195978 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 3.7 | COc1ccc(Nc2nc(C)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL559765 | 195978 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 3.7 | COc1ccc(Nc2nc(C)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| 42618166 | 172942 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 339 | 6 | 1 | 6 | 4.0 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL451693 | 172942 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 339 | 6 | 1 | 6 | 4.0 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1021/jm9000242 | |||
| 24180501 | 94477 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 386 | 6 | 0 | 4 | 6.4 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL251386 | 94477 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 386 | 6 | 0 | 4 | 6.4 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 24768328 | 97706 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 391 | 7 | 3 | 5 | 4.0 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)NC | 10.1021/jm070579c | |||
| CHEMBL271370 | 97706 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 391 | 7 | 3 | 5 | 4.0 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)NC | 10.1021/jm070579c | |||
| 3663 | 99967 | 83 | None | - | 29 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | 10.1021/np1000329 | |||
| CHEMBL286494 | 99967 | 83 | None | - | 29 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 504 | 0 | 6 | 8 | 5.1 | Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c65 | 10.1021/np1000329 | |||
| 54585866 | 60657 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 8 | 0 | 7 | 3.6 | CCCN(CCC)c1nc2c(c(-c3ccc(OC)cc3OC)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760261 | 60657 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 398 | 8 | 0 | 7 | 3.6 | CCCN(CCC)c1nc2c(c(-c3ccc(OC)cc3OC)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 54579975 | 60658 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 474 | 6 | 0 | 5 | 5.6 | CCCN(CCC)c1nc2c(c(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760262 | 60658 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 474 | 6 | 0 | 5 | 5.6 | CCCN(CCC)c1nc2c(c(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 11250707 | 12267 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 522 | 8 | 1 | 6 | 4.6 | CCN(CCCS(C)(=O)=O)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1021/jm049737f | |||
| CHEMBL1184720 | 12267 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 522 | 8 | 1 | 6 | 4.6 | CCN(CCCS(C)(=O)=O)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1021/jm049737f | |||
| CHEMBL365488 | 12267 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 522 | 8 | 1 | 6 | 4.6 | CCN(CCCS(C)(=O)=O)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1021/jm049737f | |||
| 56666769 | 65308 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 441 | 9 | 1 | 6 | 6.4 | CCCN(CCC)c1c(C2CCCC2)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828894 | 65308 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 441 | 9 | 1 | 6 | 6.4 | CCCN(CCC)c1c(C2CCCC2)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 11247672 | 174906 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 4 | 1 | 7 | 2.2 | COc1ccc(N2CCc3c(-n4ccc(N5CCNS5(=O)=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL456449 | 174906 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 440 | 4 | 1 | 7 | 2.2 | COc1ccc(N2CCc3c(-n4ccc(N5CCNS5(=O)=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 58223435 | 127870 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 461 | 11 | 0 | 9 | 4.2 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCC1 | nan | |||
| CHEMBL3664583 | 127870 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 461 | 11 | 0 | 9 | 4.2 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCC1 | nan | |||
| 22177839 | 64737 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 380 | 6 | 1 | 6 | 4.6 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819061 | 64737 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 380 | 6 | 1 | 6 | 4.6 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | |||
| 46881865 | 8011 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 8 | 1 | 9 | 2.4 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(C)nc(OC)nc2OC)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1090739 | 8011 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 8 | 1 | 9 | 2.4 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(C)nc(OC)nc2OC)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 24768328 | 97706 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 391 | 7 | 3 | 5 | 4.0 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)NC | 10.1021/jm070579c | |||
| CHEMBL271370 | 97706 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 391 | 7 | 3 | 5 | 4.0 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)NC | 10.1021/jm070579c | |||
| 56680359 | 65311 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828897 | 65311 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 10180350 | 63407 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 418 | 6 | 0 | 4 | 6.5 | CCCC(CCC)N1CCC2CN(c3ccc(Cl)cc3Cl)c3nc(C)nc1c32 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL179608 | 63407 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 418 | 6 | 0 | 4 | 6.5 | CCCC(CCC)N1CCC2CN(c3ccc(Cl)cc3Cl)c3nc(C)nc1c32 | 10.1016/j.bmcl.2007.06.077 | |||
| 21912361 | 98039 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 331 | 6 | 0 | 3 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(F)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL273068 | 98039 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 331 | 6 | 0 | 3 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(F)cc2C)c1C | 10.1021/jm070578k | |||
| 54580963 | 60656 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 428 | 9 | 0 | 8 | 3.6 | CCCN(CCC)c1nc2c(c(-c3c(OC)cc(OC)cc3OC)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760260 | 60656 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 428 | 9 | 0 | 8 | 3.6 | CCCN(CCC)c1nc2c(c(-c3c(OC)cc(OC)cc3OC)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 57395432 | 69983 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 337 | 5 | 0 | 4 | 5.2 | CCC(CC)c1nc(C)c2nc(-c3ccc(OC)cc3C)c(C)cn12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939578 | 69983 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 337 | 5 | 0 | 4 | 5.2 | CCC(CC)c1nc(C)c2nc(-c3ccc(OC)cc3C)c(C)cn12 | 10.1016/j.bmc.2011.11.015 | |||
| 24768337 | 166015 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 429 | 9 | 1 | 8 | 3.1 | CCCN(CCOC)c1nc(C)nc2c1NC(=O)CN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL425476 | 166015 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 429 | 9 | 1 | 8 | 3.1 | CCCN(CCOC)c1nc(C)nc2c1NC(=O)CN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| 11235455 | 175466 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 418 | 5 | 1 | 6 | 3.5 | CCOc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL457710 | 175466 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 418 | 5 | 1 | 6 | 3.5 | CCOc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 44589349 | 176117 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 367 | 3 | 0 | 7 | 3.3 | Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-n4cccn4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL459181 | 176117 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 367 | 3 | 0 | 7 | 3.3 | Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-n4cccn4)n3)ccnc21 | 10.1021/jm800743q | |||
| 53358606 | 130593 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 386 | 4 | 1 | 4 | 4.1 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2cc3c(n2)CCCC3)CC1 | nan | |||
| CHEMBL3681376 | 130593 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 386 | 4 | 1 | 4 | 4.1 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2cc3c(n2)CCCC3)CC1 | nan | |||
| 58223385 | 127855 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 475 | 13 | 0 | 9 | 4.5 | CCOCc1cc(OC)c(-c2csc3c(N(CCOC)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664568 | 127855 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 475 | 13 | 0 | 9 | 4.5 | CCOCc1cc(OC)c(-c2csc3c(N(CCOC)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58223464 | 127862 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | CCOCc1cc(OC)c(-c2csc3c(N(CC4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664575 | 127862 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | CCOCc1cc(OC)c(-c2csc3c(N(CC4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 56663335 | 65305 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 10 | 1 | 6 | 5.7 | CCCc1c(Nc2ccc(OC)cc2Cl)nc2ccnn2c1N(CCC)CCC | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828891 | 65305 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 10 | 1 | 6 | 5.7 | CCCc1c(Nc2ccc(OC)cc2Cl)nc2ccnn2c1N(CCC)CCC | 10.1016/j.bmc.2011.08.055 | |||
| 21912361 | 98039 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 331 | 6 | 0 | 3 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(F)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL273068 | 98039 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 331 | 6 | 0 | 3 | 5.8 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(F)cc2C)c1C | 10.1021/jm070578k | |||
| 11948286 | 156669 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4069551 | 156669 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 11201828 | 175952 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 453 | 3 | 1 | 6 | 3.7 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(C#N)cc1C(F)(F)F)CC2 | 10.1021/jm800744m | |||
| CHEMBL458810 | 175952 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 453 | 3 | 1 | 6 | 3.7 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(C#N)cc1C(F)(F)F)CC2 | 10.1021/jm800744m | |||
| 42618212 | 184092 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 4.1 | CCCCN(CC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL482542 | 184092 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 4.1 | CCCCN(CC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 57786096 | 165095 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 475 | 4 | 0 | 6 | 5.8 | Cc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4227177 | 165095 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 475 | 4 | 0 | 6 | 5.8 | Cc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| 70686154 | 75587 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 466 | 9 | 0 | 7 | 5.5 | CCN(c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12)C1CCOCC1 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2046530 | 75587 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 466 | 9 | 0 | 7 | 5.5 | CCN(c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12)C1CCOCC1 | 10.1016/j.bmcl.2012.05.066 | |||
| 11476167 | 189704 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 439 | 4 | 0 | 7 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(N5CCCS5(=O)=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL515503 | 189704 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 439 | 4 | 0 | 7 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(N5CCCS5(=O)=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 10184943 | 66702 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 490 | 5 | 0 | 4 | 6.6 | CCc1nc2c(n1Cc1ccc(-c3ccccc3)cc1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL185541 | 66702 | 0 | None | - | 0 | Rat | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 490 | 5 | 0 | 4 | 6.6 | CCc1nc2c(n1Cc1ccc(-c3ccccc3)cc1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 58223455 | 124424 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 457 | 9 | 0 | 8 | 4.7 | COc1cc(C)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| CHEMBL3639634 | 124424 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 457 | 9 | 0 | 8 | 4.7 | COc1cc(C)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| 58223403 | 127872 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 483 | 10 | 0 | 8 | 5.2 | COc1cc(C2CC2)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| CHEMBL3664585 | 127872 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 483 | 10 | 0 | 8 | 5.2 | COc1cc(C2CC2)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| 58223493 | 127891 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 468 | 10 | 0 | 9 | 5.2 | CCCN(c1ccccn1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664603 | 127891 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 468 | 10 | 0 | 9 | 5.2 | CCCN(c1ccccn1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 56683762 | 65500 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830518 | 65500 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 388 | 8 | 0 | 7 | 4.2 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 46890979 | 6839 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 352 | 4 | 1 | 5 | 4.3 | Cc1nc(Nc2c(C)cc(Cl)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084025 | 6839 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 352 | 4 | 1 | 5 | 4.3 | Cc1nc(Nc2c(C)cc(Cl)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 46891189 | 6888 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 397 | 4 | 1 | 6 | 4.2 | Cc1nc(Nc2cc(C(F)(F)F)c(C#N)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084242 | 6888 | 0 | None | - | 0 | Rat | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 397 | 4 | 1 | 6 | 4.2 | Cc1nc(Nc2cc(C(F)(F)F)c(C#N)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 54586829 | 60654 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 380 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1nc2c(c(-c3ccc(C)cc3C)c(C)n2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760258 | 60654 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 380 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1nc2c(c(-c3ccc(C)cc3C)c(C)n2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 21984580 | 77552 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 433 | 8 | 0 | 5 | 5.6 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CCCO1 | 10.1021/jm300259r | |||
| CHEMBL2087560 | 77552 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 433 | 8 | 0 | 5 | 5.6 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CCCO1 | 10.1021/jm300259r | |||
| 60155991 | 77579 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 515 | 12 | 0 | 9 | 4.8 | COCCN(CC1CCOCC1)c1c(SC)nn2c(-c3c(OC)cc(COC)cc3OC)cccc12 | 10.1021/jm300259r | |||
| CHEMBL2087801 | 77579 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 515 | 12 | 0 | 9 | 4.8 | COCCN(CC1CCOCC1)c1c(SC)nn2c(-c3c(OC)cc(COC)cc3OC)cccc12 | 10.1021/jm300259r | |||
| 45273018 | 196527 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 381 | 6 | 0 | 5 | 4.7 | CCN(c1c(Cl)cc(OC)cc1Cl)c1nccn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| CHEMBL563618 | 196527 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 381 | 6 | 0 | 5 | 4.7 | CCN(c1c(Cl)cc(OC)cc1Cl)c1nccn([C@H](C)C2CC2)c1=O | 10.1021/jm900301y | |||
| 44589302 | 189788 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 425 | 5 | 0 | 7 | 5.0 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)F)c1 | 10.1021/jm800743q | |||
| CHEMBL516175 | 189788 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 425 | 5 | 0 | 7 | 5.0 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)F)c1 | 10.1021/jm800743q | |||
| 56677029 | 65307 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 429 | 11 | 1 | 6 | 6.1 | CCCCc1c(Nc2ccc(OC)cc2Cl)nc2ccnn2c1N(CCC)CCC | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828893 | 65307 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 429 | 11 | 1 | 6 | 6.1 | CCCCc1c(Nc2ccc(OC)cc2Cl)nc2ccnn2c1N(CCC)CCC | 10.1016/j.bmc.2011.08.055 | |||
| 10379 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1016/j.bmc.2016.11.011 | |||
| 9884366 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL482950 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1016/j.bmc.2016.11.011 | |||
| DB12572 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1016/j.bmc.2016.11.011 | |||
| 24805438 | 98009 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(CC)Oc1nc(C)cc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272893 | 98009 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(CC)Oc1nc(C)cc(Oc2c(C)cc(C)cc2C)c1C | 10.1021/jm070578k | |||
| 44589221 | 175645 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 375 | 3 | 1 | 7 | 4.1 | Cc1cc(O)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL458115 | 175645 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 375 | 3 | 1 | 7 | 4.1 | Cc1cc(O)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 58223394 | 127857 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 489 | 14 | 0 | 9 | 4.9 | CCOCc1cc(OC)c(-c2csc3c(N(CCCOC)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664570 | 127857 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 489 | 14 | 0 | 9 | 4.9 | CCOCc1cc(OC)c(-c2csc3c(N(CCCOC)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| 54582098 | 61042 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 388 | 9 | 0 | 8 | 2.6 | COCCN(CCCF)c1nc(C)nc2c(-c3ccc(OC)nc3)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| CHEMBL1762823 | 61042 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 388 | 9 | 0 | 8 | 2.6 | COCCN(CCCF)c1nc(C)nc2c(-c3ccc(OC)nc3)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| 10075105 | 77566 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 511 | 11 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087574 | 77566 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 511 | 11 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 9970050 | 64740 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 380 | 6 | 1 | 6 | 4.7 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819064 | 64740 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 380 | 6 | 1 | 6 | 4.7 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)COC2 | 10.1016/j.bmc.2011.07.055 | |||
| 44190055 | 196093 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 347 | 5 | 2 | 5 | 3.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@@H](CO)C3CC3)c2=O)c(C)c1 | 10.1021/jm900301y | |||
| CHEMBL560823 | 196093 | 0 | None | - | 0 | Rat | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 347 | 5 | 2 | 5 | 3.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@@H](CO)C3CC3)c2=O)c(C)c1 | 10.1021/jm900301y | |||
| 53357140 | 130591 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 554 | 7 | 3 | 4 | 7.1 | COc1ccc(-c2c(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n[nH]c2C)c(Cl)c1 | nan | |||
| CHEMBL3681374 | 130591 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 554 | 7 | 3 | 4 | 7.1 | COc1ccc(-c2c(NC[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n[nH]c2C)c(Cl)c1 | nan | |||
| 145968888 | 165158 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4228089 | 165158 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| 58223459 | 127866 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 12 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC(C)OC)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664579 | 127866 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 12 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC(C)OC)c(OC)nn23)c(OC)c1 | nan | |||
| 58223427 | 127892 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 468 | 10 | 0 | 9 | 5.2 | CCCN(c1cccnc1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664604 | 127892 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 468 | 10 | 0 | 9 | 5.2 | CCCN(c1cccnc1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 44191107 | 194804 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 367 | 5 | 1 | 5 | 4.6 | COc1cc(Cl)c(C)cc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900302q | |||
| CHEMBL538866 | 194804 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 367 | 5 | 1 | 5 | 4.6 | COc1cc(Cl)c(C)cc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1021/jm900302q | |||
| 57786134 | 165122 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 387 | 4 | 0 | 3 | 6.1 | CCN(CC)c1cccc2nc3n(c12)CCCC3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4227554 | 165122 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 387 | 4 | 0 | 3 | 6.1 | CCN(CC)c1cccc2nc3n(c12)CCCC3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 44589291 | 175482 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 454 | 5 | 1 | 9 | 2.9 | COc1cc(-n2cccn2)ccc1N1CCc2c(-n3ccc(-n4cc[nH]c4=O)n3)cc(C)nc21 | 10.1021/jm800744m | |||
| CHEMBL457742 | 175482 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 454 | 5 | 1 | 9 | 2.9 | COc1cc(-n2cccn2)ccc1N1CCc2c(-n3ccc(-n4cc[nH]c4=O)n3)cc(C)nc21 | 10.1021/jm800744m | |||
| 44589330 | 175479 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 398 | 3 | 0 | 6 | 4.5 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5ccccn5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| CHEMBL457740 | 175479 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 398 | 3 | 0 | 6 | 4.5 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5ccccn5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| 90654069 | 128815 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 461 | 9 | 2 | 9 | 3.3 | CCc1sc2c(NC(=O)C3(O)CC3)c(OC)nn2c1-c1c(OC)cc(COC)cc1OC | nan | |||
| CHEMBL3669433 | 128815 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 461 | 9 | 2 | 9 | 3.3 | CCc1sc2c(NC(=O)C3(O)CC3)c(OC)nn2c1-c1c(OC)cc(COC)cc1OC | nan | |||
| 10177704 | 64736 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 378 | 6 | 1 | 5 | 5.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819060 | 64736 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 378 | 6 | 1 | 5 | 5.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 10178898 | 64741 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 396 | 6 | 1 | 6 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CSC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819065 | 64741 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 396 | 6 | 1 | 6 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CSC2 | 10.1016/j.bmc.2011.07.055 | |||
| 10222795 | 64757 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 402 | 5 | 1 | 4 | 6.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(Cl)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819082 | 64757 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 402 | 5 | 1 | 4 | 6.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(Cl)cc4Cl)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 11751039 | 175880 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 440 | 4 | 1 | 7 | 3.3 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(-n3cccn3)cc1C)CC2 | 10.1021/jm800744m | |||
| CHEMBL458626 | 175880 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 440 | 4 | 1 | 7 | 3.3 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(-n3cccn3)cc1C)CC2 | 10.1021/jm800744m | |||
| 21984783 | 77551 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 433 | 8 | 0 | 5 | 5.4 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CCOC1 | 10.1021/jm300259r | |||
| CHEMBL2087559 | 77551 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 433 | 8 | 0 | 5 | 5.4 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CC1CC1)CC1CCOC1 | 10.1021/jm300259r | |||
| 10135080 | 64749 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 391 | 6 | 1 | 5 | 5.2 | CCC(CC)Nc1c2c(nc3c(-c4ccc(N(C)C)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819073 | 64749 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 391 | 6 | 1 | 5 | 5.2 | CCC(CC)Nc1c2c(nc3c(-c4ccc(N(C)C)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 42618205 | 180170 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 353 | 5 | 0 | 6 | 3.9 | CCN(CC)c1nc(C)nc2c(-c3ccc(OC)c(C)c3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474906 | 180170 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 353 | 5 | 0 | 6 | 3.9 | CCN(CC)c1nc(C)nc2c(-c3ccc(OC)c(C)c3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 54582962 | 60652 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 364 | 2 | 0 | 5 | 3.9 | Cc1cc(C)c(-c2cn(C)c3nc(N4CCCCC4)n(C)c(=O)c23)c(C)c1 | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760256 | 60652 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 364 | 2 | 0 | 5 | 3.9 | Cc1cc(C)c(-c2cn(C)c3nc(N4CCCCC4)n(C)c(=O)c23)c(C)c1 | 10.1016/j.bmcl.2011.02.086 | |||
| 10296796 | 63761 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 436 | 7 | 0 | 4 | 6.5 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)C(C)N2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL180151 | 63761 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 436 | 7 | 0 | 4 | 6.5 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)C(C)N2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 44589278 | 175465 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 501 | 5 | 0 | 10 | 2.9 | CS(=O)(=O)c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(S(C)(=O)=O)c1 | 10.1021/jm800743q | |||
| CHEMBL457708 | 175465 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 501 | 5 | 0 | 10 | 2.9 | CS(=O)(=O)c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(S(C)(=O)=O)c1 | 10.1021/jm800743q | |||
| 58223475 | 127831 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 463 | 11 | 0 | 8 | 5.9 | CCCN(CCC)c1c(C)nn2c(-c3c(OC)cc(COC)cc3OC)c(SC)sc12 | nan | |||
| CHEMBL3664544 | 127831 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 463 | 11 | 0 | 8 | 5.9 | CCCN(CCC)c1c(C)nn2c(-c3c(OC)cc(COC)cc3OC)c(SC)sc12 | nan | |||
| 58223398 | 127873 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 471 | 9 | 0 | 8 | 5.4 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664586 | 127873 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 471 | 9 | 0 | 8 | 5.4 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12)C1CCOCC1 | nan | |||
| 46891036 | 7404 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.9 | Cc1nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086511 | 7404 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 422 | 5 | 1 | 6 | 4.9 | Cc1nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 44189948 | 195423 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 347 | 6 | 1 | 4 | 5.0 | CCC(CC)Cn1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL552237 | 195423 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 347 | 6 | 1 | 4 | 5.0 | CCC(CC)Cn1cc(Cl)nc(Nc2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 57786117 | 165120 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 402 | 4 | 0 | 4 | 5.3 | CCN(CC)c1cccc2nc3n(c12)CCC(=O)N3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4227537 | 165120 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 402 | 4 | 0 | 4 | 5.3 | CCN(CC)c1cccc2nc3n(c12)CCC(=O)N3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.bmcl.2007.06.077 | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.bmcl.2007.06.077 | |||
| 44444314 | 94257 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 395 | 7 | 0 | 4 | 6.3 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)c(F)c1)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL250182 | 94257 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 395 | 7 | 0 | 4 | 6.3 | CCCC(CCC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)c(F)c1)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 44444336 | 94494 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 374 | 5 | 0 | 5 | 4.8 | CCC(COC)n1cc2c3c(nc(C)cc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL251551 | 94494 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 374 | 5 | 0 | 5 | 4.8 | CCC(COC)n1cc2c3c(nc(C)cc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm800744m | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm800744m | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm800744m | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm800743q | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm800743q | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm800743q | |||
| 44589328 | 189741 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 444 | 4 | 0 | 8 | 4.5 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)n1 | 10.1021/jm800743q | |||
| CHEMBL515843 | 189741 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 444 | 4 | 0 | 8 | 4.5 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)n1 | 10.1021/jm800743q | |||
| 21912363 | 97501 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 341 | 7 | 0 | 4 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C=O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL270343 | 97501 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 341 | 7 | 0 | 4 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C=O)cc2C)c1C | 10.1021/jm070578k | |||
| 21912239 | 97707 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 371 | 7 | 1 | 4 | 5.9 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(C)(C)O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271373 | 97707 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 371 | 7 | 1 | 4 | 5.9 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(C)(C)O)cc2C)c1C | 10.1021/jm070578k | |||
| 54581053 | 61043 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 389 | 9 | 0 | 9 | 2.0 | COCCN(CCCF)c1nc(C)nc2c(-c3cnc(OC)nc3)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| CHEMBL1762824 | 61043 | 0 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 389 | 9 | 0 | 9 | 2.0 | COCCN(CCCF)c1nc(C)nc2c(-c3cnc(OC)nc3)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| 71451516 | 81523 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 454 | 11 | 0 | 7 | 4.9 | CCN(CCOC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160172 | 81523 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 454 | 11 | 0 | 7 | 4.9 | CCN(CCOC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 10376 | 2930 | 4 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | |||
| 9801039 | 2930 | 4 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819077 | 2930 | 4 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | |||
| 42618202 | 189767 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 433 | 6 | 0 | 7 | 4.0 | CCN(CC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3Br)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL516026 | 189767 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 433 | 6 | 0 | 7 | 4.0 | CCN(CC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3Br)c(C)nn12 | 10.1021/jm9000242 | |||
| 71455126 | 81989 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 395 | 8 | 1 | 6 | 4.2 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OCF)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165195 | 81989 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 395 | 8 | 1 | 6 | 4.2 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OCF)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 44190825 | 195146 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 425 | 4 | 1 | 4 | 5.9 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL550215 | 195146 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 425 | 4 | 1 | 4 | 5.9 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 11948286 | 156669 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4069551 | 156669 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 410 | 5 | 0 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 11363701 | 67414 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 482 | 6 | 1 | 5 | 6.0 | CCN(Cc1ccco1)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1021/jm049737f | |||
| CHEMBL188858 | 67414 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 482 | 6 | 1 | 5 | 6.0 | CCN(Cc1ccco1)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1021/jm049737f | |||
| 54754516 | 65304 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 401 | 9 | 1 | 6 | 5.3 | CCCN(CCC)c1c(CC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828890 | 65304 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 401 | 9 | 1 | 6 | 5.3 | CCCN(CCC)c1c(CC)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 9908904 | 180487 | 4 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm200365y | |||
| CHEMBL474287 | 180487 | 4 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm200365y | |||
| CHEMBL475306 | 180487 | 4 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm200365y | |||
| 57402456 | 70009 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 353 | 4 | 0 | 5 | 4.1 | CCC(C)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939603 | 70009 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 353 | 4 | 0 | 5 | 4.1 | CCC(C)c1cc(C)n2nc(-c3c(C)cc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 24768329 | 85606 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 368 | 7 | 1 | 5 | 4.9 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL228227 | 85606 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 368 | 7 | 1 | 5 | 4.9 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| 3499 | 1448 | 28 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm9000242 | |||
| 9909468 | 1448 | 28 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm9000242 | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm9000242 | |||
| 9908904 | 180487 | 4 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474287 | 180487 | 4 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL475306 | 180487 | 4 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 11181033 | 11774 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 383 | 7 | 1 | 6 | 3.8 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1C | 10.1021/jm049737f | |||
| CHEMBL1181692 | 11774 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 383 | 7 | 1 | 6 | 3.8 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1C | 10.1021/jm049737f | |||
| CHEMBL188861 | 11774 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 383 | 7 | 1 | 6 | 3.8 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1C | 10.1021/jm049737f | |||
| 44591727 | 191471 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 381 | 7 | 0 | 6 | 4.7 | CCCCN(CC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL519339 | 191471 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 381 | 7 | 0 | 6 | 4.7 | CCCCN(CC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 56961969 | 81996 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 443 | 9 | 1 | 7 | 3.5 | COCC(COC)n1cc(Br)nc(Nc2c(C)cc(OCF)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165201 | 81996 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 443 | 9 | 1 | 7 | 3.5 | COCC(COC)n1cc(Br)nc(Nc2c(C)cc(OCF)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 44191186 | 195615 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 414 | 6 | 1 | 6 | 4.7 | C[C@H](C1CC1)n1cc(C#N)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL556089 | 195615 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 414 | 6 | 1 | 6 | 4.7 | C[C@H](C1CC1)n1cc(C#N)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 56683688 | 65314 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 413 | 10 | 0 | 6 | 5.3 | C=CCN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828900 | 65314 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 413 | 10 | 0 | 6 | 5.3 | C=CCN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | |||
| 57398970 | 69990 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 403 | 7 | 1 | 6 | 4.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939585 | 69990 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 403 | 7 | 1 | 6 | 4.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 46891493 | 6565 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 434 | 8 | 1 | 7 | 4.2 | COC[C@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083012 | 6565 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 434 | 8 | 1 | 7 | 4.2 | COC[C@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 9820671 | 188818 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL506214 | 188818 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 369 | 6 | 1 | 7 | 3.9 | CC[C@@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 71580313 | 88438 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 424 | 8 | 1 | 6 | 4.4 | Cc1cc(C#N)cc(Cl)c1Nc1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349564 | 88438 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 424 | 8 | 1 | 6 | 4.4 | Cc1cc(C#N)cc(Cl)c1Nc1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| 57397279 | 69999 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC(F)F)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939594 | 69999 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC(F)F)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 10379 | 3059 | 39 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| 9884366 | 3059 | 39 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| CHEMBL482950 | 3059 | 39 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| DB12572 | 3059 | 39 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| 42618222 | 179633 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCC[C@H](C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL474289 | 179633 | 0 | None | - | 0 | Rat | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.7 | CCC[C@H](C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 57395433 | 69988 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 387 | 6 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939583 | 69988 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 387 | 6 | 0 | 5 | 5.1 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 44190341 | 196124 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 6 | 0 | 4 | 5.3 | CC[C@H](C1CC1)n1cc(Cl)nc(N(CC)c2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL561035 | 196124 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 6 | 0 | 4 | 5.3 | CC[C@H](C1CC1)n1cc(Cl)nc(N(CC)c2c(C)cc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 9908904 | 180487 | 4 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474287 | 180487 | 4 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL475306 | 180487 | 4 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 399 | 9 | 0 | 8 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 56659949 | 65508 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 381 | 6 | 1 | 5 | 6.0 | CCc1cc(Cl)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830525 | 65508 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 381 | 6 | 1 | 5 | 6.0 | CCc1cc(Cl)ccc1Nc1nc2ccnn2c2c1ccn2C(CC)CC | 10.1016/j.bmc.2011.08.055 | |||
| 71580427 | 88444 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 346 | 6 | 1 | 6 | 3.2 | COc1nc(C)c(Nc2nc(C)cn([C@@H](CF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349571 | 88444 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 346 | 6 | 1 | 6 | 3.2 | COc1nc(C)c(Nc2nc(C)cn([C@@H](CF)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2013.02.009 | |||
| 58280028 | 139923 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 463 | 10 | 2 | 8 | 4.1 | CCCCNC(=O)OC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799560 | 139923 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 463 | 10 | 2 | 8 | 4.1 | CCCCNC(=O)OC[C@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2016.03.067 | |||
| 46881836 | 7744 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1089038 | 7744 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 414 | 8 | 1 | 7 | 3.9 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cc(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 44191108 | 196681 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900302q | |||
| CHEMBL564639 | 196681 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 331 | 4 | 1 | 4 | 4.5 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1C | 10.1021/jm900302q | |||
| 57400682 | 70002 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 359 | 4 | 0 | 5 | 4.2 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939597 | 70002 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 359 | 4 | 0 | 5 | 4.2 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 127046470 | 139618 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 469 | 8 | 1 | 9 | 3.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3ccncc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3797551 | 139618 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 469 | 8 | 1 | 9 | 3.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3ccncc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 42618234 | 188276 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 368 | 7 | 0 | 7 | 3.7 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL500013 | 188276 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 368 | 7 | 0 | 7 | 3.7 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 42618186 | 179996 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 367 | 6 | 0 | 7 | 3.4 | C=CCN(C)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474699 | 179996 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 367 | 6 | 0 | 7 | 3.4 | C=CCN(C)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618203 | 179252 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 493 | 10 | 0 | 9 | 3.3 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3Br)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL472874 | 179252 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 493 | 10 | 0 | 9 | 3.3 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3Br)c(C)nn12 | 10.1021/jm9000242 | |||
| 58223391 | 127846 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 463 | 13 | 0 | 9 | 4.5 | CCCCN(CCOC)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664559 | 127846 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 463 | 13 | 0 | 9 | 4.5 | CCCCN(CCOC)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 60155710 | 77555 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 463 | 9 | 0 | 6 | 5.5 | CCc1nn2c(-c3c(C)cc(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087563 | 77555 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 463 | 9 | 0 | 6 | 5.5 | CCc1nn2c(-c3c(C)cc(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 60155795 | 77563 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 451 | 9 | 0 | 6 | 5.5 | CCCN(CC1CCOCC1)c1c(CC)nn2c(-c3c(OC)cc(C)cc3OC)cccc12 | 10.1021/jm300259r | |||
| CHEMBL2087571 | 77563 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 451 | 9 | 0 | 6 | 5.5 | CCCN(CC1CCOCC1)c1c(CC)nn2c(-c3c(OC)cc(C)cc3OC)cccc12 | 10.1021/jm300259r | |||
| 21912363 | 97501 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 341 | 7 | 0 | 4 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C=O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL270343 | 97501 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 341 | 7 | 0 | 4 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C=O)cc2C)c1C | 10.1021/jm070578k | |||
| 21912239 | 97707 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 371 | 7 | 1 | 4 | 5.9 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(C)(C)O)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271373 | 97707 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 371 | 7 | 1 | 4 | 5.9 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C(C)(C)O)cc2C)c1C | 10.1021/jm070578k | |||
| 53358377 | 124446 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 388 | 5 | 1 | 4 | 4.7 | Cc1cc(C(C)C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| CHEMBL3639802 | 124446 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 388 | 5 | 1 | 4 | 4.7 | Cc1cc(C(C)C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| 11383860 | 67023 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL187039 | 67023 | 0 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 21984555 | 77549 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 407 | 9 | 0 | 5 | 5.1 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CCOC)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087557 | 77549 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 407 | 9 | 0 | 5 | 5.1 | CCc1nn2c(-c3c(C)cc(C)cc3OC)cccc2c1N(CCOC)CC1CC1 | 10.1021/jm300259r | |||
| 71455051 | 81513 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 444 | 9 | 0 | 5 | 6.2 | CCN(CC)c1ccc(C(F)F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160162 | 81513 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 444 | 9 | 0 | 5 | 6.2 | CCN(CC)c1ccc(C(F)F)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 56670201 | 65312 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 415 | 10 | 0 | 6 | 5.6 | CCCN(CCC)c1cc(N(CCC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828898 | 65312 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 415 | 10 | 0 | 6 | 5.6 | CCCN(CCC)c1cc(N(CCC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 56659947 | 65498 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 374 | 7 | 1 | 7 | 4.2 | CCC(CC)Nc1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830516 | 65498 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 374 | 7 | 1 | 7 | 4.2 | CCC(CC)Nc1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 56663414 | 65504 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830521 | 65504 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 401 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(N(CC)c2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | |||
| 58730488 | 77556 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 479 | 10 | 0 | 7 | 5.2 | CCc1nn2c(-c3c(OC)cc(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087564 | 77556 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 479 | 10 | 0 | 7 | 5.2 | CCc1nn2c(-c3c(OC)cc(OC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 25150449 | 175761 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 401 | 4 | 0 | 7 | 5.0 | COc1ccc(-n2ccc3c(-n4ccc(-c5nccs5)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800743q | |||
| CHEMBL458353 | 175761 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 401 | 4 | 0 | 7 | 5.0 | COc1ccc(-n2ccc3c(-n4ccc(-c5nccs5)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800743q | |||
| 58223397 | 127845 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 457 | 8 | 0 | 8 | 4.8 | COc1cc(C)cc(OC)c1-c1csc2c(N(CC3CC3)C3CCOCC3)c(OC)nn12 | nan | |||
| CHEMBL3664558 | 127845 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 457 | 8 | 0 | 8 | 4.8 | COc1cc(C)cc(OC)c1-c1csc2c(N(CC3CC3)C3CCOCC3)c(OC)nn12 | nan | |||
| 71462615 | 82604 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCCO4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179182 | 82604 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCCO4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 24768335 | 85492 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 428 | 9 | 1 | 7 | 3.7 | CCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL227028 | 85492 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 428 | 9 | 1 | 7 | 3.7 | CCCN(CCOC)c1cc(C)nc2c1NC(=O)CN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| 10202622 | 123822 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 424 | 7 | 0 | 5 | 4.9 | CCCC(COC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL362413 | 123822 | 0 | None | - | 0 | Rat | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 424 | 7 | 0 | 5 | 4.9 | CCCC(COC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 58223445 | 127843 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 471 | 10 | 0 | 8 | 4.9 | CCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664556 | 127843 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 471 | 10 | 0 | 8 | 4.9 | CCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58896479 | 176269 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 6 | 1 | 5 | 8.1 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(CC(C)(C)C)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4566348 | 176269 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 6 | 1 | 5 | 8.1 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(CC(C)(C)C)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4595038 | 176269 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 496 | 6 | 1 | 5 | 8.1 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(CC(C)(C)C)c3ccc(Cl)cc3)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 145959453 | 162155 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 370 | 4 | 1 | 7 | 3.3 | CCN(CC)c1nc(C)nc2c1s/c(=N/N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | |||
| CHEMBL4161963 | 162155 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 370 | 4 | 1 | 7 | 3.3 | CCN(CC)c1nc(C)nc2c1s/c(=N/N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | |||
| 58223386 | 127847 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 10 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(CC4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664560 | 127847 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 10 | 0 | 9 | 4.6 | COCc1cc(OC)c(-c2csc3c(N(CC4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58223431 | 127858 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 10 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2csc3c(N(CC(C)C)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664571 | 127858 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 475 | 10 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2csc3c(N(CC(C)C)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58223396 | 127895 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.3 | CCCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664607 | 127895 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.3 | CCCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58223461 | 127896 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 499 | 11 | 0 | 9 | 4.3 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4C5COCC54)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664608 | 127896 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 499 | 11 | 0 | 9 | 4.3 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4C5COCC54)c(OC)nn23)c(OC)c1 | nan | |||
| 10182058 | 65258 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 444 | 5 | 0 | 5 | 5.0 | CCc1nc2c(n1Cc1ccc(OC)cc1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL182779 | 65258 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 444 | 5 | 0 | 5 | 5.0 | CCc1nc2c(n1Cc1ccc(OC)cc1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 10137474 | 64606 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 428 | 4 | 0 | 4 | 5.3 | CCc1nc2c(n1Cc1ccccc1C)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL181699 | 64606 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 428 | 4 | 0 | 4 | 5.3 | CCc1nc2c(n1Cc1ccccc1C)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 51352159 | 82619 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 485 | 10 | 0 | 8 | 5.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | nan | |||
| CHEMBL2179197 | 82619 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 485 | 10 | 0 | 8 | 5.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | nan | |||
| 71455473 | 82618 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 470 | 9 | 0 | 9 | 4.7 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179196 | 82618 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 470 | 9 | 0 | 9 | 4.7 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 51352159 | 82619 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 485 | 10 | 0 | 8 | 5.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179197 | 82619 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 485 | 10 | 0 | 8 | 5.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 57786009 | 164935 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 507 | 6 | 0 | 8 | 5.2 | COc1nc(C)nc(OC)c1N1CCCn2c1nc1c(Cl)ccc(C(OC(F)F)C(F)(F)F)c12 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4224781 | 164935 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 507 | 6 | 0 | 8 | 5.2 | COc1nc(C)nc(OC)c1N1CCCn2c1nc1c(Cl)ccc(C(OC(F)F)C(F)(F)F)c12 | 10.1016/j.bmc.2018.01.020 | |||
| 24768323 | 98050 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 371 | 7 | 0 | 5 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C(=O)OC | 10.1021/jm070578k | |||
| CHEMBL273117 | 98050 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 371 | 7 | 0 | 5 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C(=O)OC | 10.1021/jm070578k | |||
| 70692631 | 75900 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.ejmech.2021.114085 | |||
| CHEMBL2049190 | 75900 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 378 | 7 | 2 | 4 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)[nH]c12 | 10.1016/j.ejmech.2021.114085 | |||
| 58223442 | 127889 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OCC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664601 | 127889 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OCC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | nan | |||
| 58223478 | 128813 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 11 | 0 | 9 | 4.8 | COCc1cc(OC)c(-c2csc3c(N(CC4=CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3669431 | 128813 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 11 | 0 | 9 | 4.8 | COCc1cc(OC)c(-c2csc3c(N(CC4=CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| 60155888 | 77574 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 481 | 9 | 0 | 7 | 5.7 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(SC)nn12 | 10.1021/jm300259r | |||
| CHEMBL2087796 | 77574 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 481 | 9 | 0 | 7 | 5.7 | COc1cc(C)cc(OC)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(SC)nn12 | 10.1021/jm300259r | |||
| 24768323 | 98050 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 371 | 7 | 0 | 5 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C(=O)OC | 10.1021/jm070578k | |||
| CHEMBL273117 | 98050 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 371 | 7 | 0 | 5 | 5.5 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1C(=O)OC | 10.1021/jm070578k | |||
| 70696716 | 75906 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 437 | 11 | 1 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Nc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049197 | 75906 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 437 | 11 | 1 | 6 | 6.1 | CCCN(CCC)c1cccc2nc(Nc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 58223502 | 82605 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 12 | 0 | 9 | 4.1 | COCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL2179183 | 82605 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 12 | 0 | 9 | 4.1 | COCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58223374 | 127860 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 475 | 13 | 0 | 9 | 4.5 | CCOCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664573 | 127860 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 475 | 13 | 0 | 9 | 4.5 | CCOCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58223416 | 127881 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 485 | 11 | 0 | 8 | 5.8 | COCCCN(c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12)C1CCCC1 | nan | |||
| CHEMBL3664593 | 127881 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 485 | 11 | 0 | 8 | 5.8 | COCCCN(c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12)C1CCCC1 | nan | |||
| 71455472 | 82603 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179181 | 82603 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.5 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 58223502 | 82605 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 12 | 0 | 9 | 4.1 | COCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | 10.1021/jm300864p | |||
| CHEMBL2179183 | 82605 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 12 | 0 | 9 | 4.1 | COCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | 10.1021/jm300864p | |||
| 137656239 | 158530 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 466 | 7 | 2 | 6 | 4.9 | CCN(CCO)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4091442 | 158530 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 466 | 7 | 2 | 6 | 4.9 | CCN(CCO)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 44156254 | 164971 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 476 | 5 | 0 | 6 | 5.8 | COc1ccc(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225373 | 164971 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 476 | 5 | 0 | 6 | 5.8 | COc1ccc(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| 57786307 | 165224 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 475 | 5 | 0 | 5 | 6.4 | COc1ccc(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)c1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4229125 | 165224 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 475 | 5 | 0 | 5 | 6.4 | COc1ccc(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)c1 | 10.1016/j.bmc.2018.01.020 | |||
| 58223379 | 127848 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 477 | 9 | 0 | 8 | 5.0 | COc1cc(Cl)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| CHEMBL3664561 | 127848 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 477 | 9 | 0 | 8 | 5.0 | COc1cc(Cl)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| 9827578 | 77561 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 507 | 12 | 0 | 7 | 5.8 | CCOCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(CC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087569 | 77561 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 507 | 12 | 0 | 7 | 5.8 | CCOCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(CC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 22177864 | 64753 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 410 | 7 | 1 | 6 | 5.5 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4SC)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819078 | 64753 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 410 | 7 | 1 | 6 | 5.5 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4SC)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 56665181 | 64760 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 386 | 6 | 1 | 5 | 5.6 | CCC(CC)Nc1c(C)c(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819085 | 64760 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 386 | 6 | 1 | 5 | 5.6 | CCC(CC)Nc1c(C)c(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | |||
| 53357923 | 130613 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 5 | 1 | 3 | 6.1 | CCc1nn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(C)c1Cl | nan | |||
| CHEMBL3681396 | 130613 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 5 | 1 | 3 | 6.1 | CCc1nn(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(C)c1Cl | nan | |||
| 44392688 | 66315 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL184930 | 66315 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 11237255 | 12254 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 380 | 7 | 1 | 4 | 5.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1 | 10.1021/jm049737f | |||
| CHEMBL1184638 | 12254 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 380 | 7 | 1 | 4 | 5.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1 | 10.1021/jm049737f | |||
| CHEMBL361296 | 12254 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 380 | 7 | 1 | 4 | 5.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1 | 10.1021/jm049737f | |||
| 10112758 | 64744 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 418 | 7 | 1 | 5 | 6.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C4CCC4)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819068 | 64744 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 418 | 7 | 1 | 5 | 6.1 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C4CCC4)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 71580315 | 88440 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 444 | 8 | 1 | 6 | 4.8 | N#Cc1cc(Cl)c(Nc2nc(Cl)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349566 | 88440 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 444 | 8 | 1 | 6 | 4.8 | N#Cc1cc(Cl)c(Nc2nc(Cl)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| 56961966 | 81991 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 421 | 8 | 1 | 7 | 3.8 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165197 | 81991 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 421 | 8 | 1 | 7 | 3.8 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 57400681 | 70000 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 339 | 4 | 0 | 5 | 3.8 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939595 | 70000 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 339 | 4 | 0 | 5 | 3.8 | CCC(C)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 46891154 | 7340 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 328 | 5 | 1 | 6 | 3.3 | COc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086233 | 7340 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 328 | 5 | 1 | 6 | 3.3 | COc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2010.04.121 | |||
| 42618177 | 184355 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 383 | 7 | 1 | 7 | 4.3 | CCC(CC)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL484408 | 184355 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 383 | 7 | 1 | 7 | 4.3 | CCC(CC)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 3496 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | |||
| 9862166 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | |||
| CHEMBL270948 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | |||
| 42618224 | 179276 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 368 | 7 | 1 | 7 | 4.1 | CCCCC(C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL473070 | 179276 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 368 | 7 | 1 | 7 | 4.1 | CCCCC(C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 3496 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 9862166 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| CHEMBL270948 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 3496 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 9862166 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| CHEMBL270948 | 1180 | 42 | None | -1 | 2 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 326 | 6 | 1 | 3 | 6.0 | CCC(Nc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 127047521 | 140019 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 469 | 8 | 1 | 9 | 3.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3cccnc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3800125 | 140019 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 469 | 8 | 1 | 9 | 3.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3cccnc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 25114821 | 69997 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939592 | 69997 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 127047518 | 139585 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 406 | 7 | 1 | 8 | 3.2 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(C)=O)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3797368 | 139585 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 406 | 7 | 1 | 8 | 3.2 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(C)=O)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 56961968 | 81992 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 439 | 9 | 1 | 7 | 4.1 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(OCF)cc2Cl)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165198 | 81992 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 439 | 9 | 1 | 7 | 4.1 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(OCF)cc2Cl)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 9841231 | 97733 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 347 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271546 | 97733 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 347 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070578k | |||
| 54584993 | 61038 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 388 | 8 | 0 | 8 | 2.5 | COCCN(CCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| CHEMBL1762819 | 61038 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 388 | 8 | 0 | 8 | 2.5 | COCCN(CCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| 9841231 | 97733 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 347 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL271546 | 97733 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 347 | 6 | 0 | 3 | 6.3 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070578k | |||
| 3495 | 1175 | 28 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm960861b | |||
| 5311055 | 1175 | 28 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm960861b | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm960861b | |||
| 44190559 | 196154 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 378 | 5 | 1 | 6 | 3.4 | C#Cc1cn([C@H](C)C2CC2)c(=O)c(Nc2ccc(OC)nc2C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL561225 | 196154 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 378 | 5 | 1 | 6 | 3.4 | C#Cc1cn([C@H](C)C2CC2)c(=O)c(Nc2ccc(OC)nc2C(F)(F)F)n1 | 10.1021/jm900301y | |||
| 21912379 | 155706 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 6.5 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL405198 | 155706 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 6.5 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070579c | |||
| 21912379 | 155706 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 6.5 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL405198 | 155706 | 0 | None | - | 0 | Rat | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 390 | 6 | 1 | 3 | 6.5 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C | 10.1021/jm070579c | |||
| 57397278 | 69992 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 379 | 6 | 0 | 5 | 5.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939587 | 69992 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 379 | 6 | 0 | 5 | 5.0 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 42618226 | 179304 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 368 | 7 | 0 | 7 | 3.7 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL473277 | 179304 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 368 | 7 | 0 | 7 | 3.7 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 54584992 | 61037 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 358 | 6 | 0 | 7 | 2.9 | CCN(CCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| CHEMBL1762818 | 61037 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 358 | 6 | 0 | 7 | 2.9 | CCN(CCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1016/j.bmcl.2011.02.050 | |||
| 24768343 | 142798 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 394 | 7 | 1 | 5 | 4.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| CHEMBL389288 | 142798 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 394 | 7 | 1 | 5 | 4.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| 44190241 | 196094 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 351 | 6 | 1 | 6 | 3.5 | COC[C@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL560827 | 196094 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 351 | 6 | 1 | 6 | 3.5 | COC[C@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 25115057 | 69993 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 399 | 6 | 0 | 5 | 5.4 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939588 | 69993 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 399 | 6 | 0 | 5 | 5.4 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3Cl)n(C3CC3)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 10255153 | 77559 | 8 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087549 | 77559 | 8 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| CHEMBL2087567 | 77559 | 8 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 493 | 11 | 0 | 7 | 5.4 | CCc1nn2c(-c3c(OC)cc(COC)cc3OC)cccc2c1N(CC1CCOCC1)CC1CC1 | 10.1021/jm300259r | |||
| 71453734 | 82601 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCCOC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179179 | 82601 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCCOC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 57786200 | 165220 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 4 | 0 | 4 | 7.4 | FC(F)OC(c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl)C(F)(F)F | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4229070 | 165220 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 499 | 4 | 0 | 4 | 7.4 | FC(F)OC(c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl)C(F)(F)F | 10.1016/j.bmc.2018.01.020 | |||
| 58896503 | 176542 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 8 | 1 | 6 | 6.7 | COCCN(c1ccc(Cl)cc1)c1cccc2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4540030 | 176542 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 8 | 1 | 6 | 6.7 | COCCN(c1ccc(Cl)cc1)c1cccc2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4597163 | 176542 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 484 | 8 | 1 | 6 | 6.7 | COCCN(c1ccc(Cl)cc1)c1cccc2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.08.005 | |||
| 10113560 | 65322 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 430 | 8 | 0 | 4 | 6.5 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL182914 | 65322 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 430 | 8 | 0 | 4 | 6.5 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049787k | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm040058e | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm040058e | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm040058e | |||
| 11372928 | 170270 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 398 | 7 | 0 | 6 | 4.5 | CCCN(CCC)c1c(F)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL444614 | 170270 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 398 | 7 | 0 | 6 | 4.5 | CCCN(CCC)c1c(F)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 9865060 | 63543 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 387 | 6 | 0 | 5 | 5.8 | CCCC(CCC)n1cc2c3c(nc(C)nc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL180025 | 63543 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 387 | 6 | 0 | 5 | 5.8 | CCCC(CCC)n1cc2c3c(nc(C)nc31)N(c1ccc(C#N)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 44444318 | 94410 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 367 | 5 | 0 | 4 | 5.5 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)c(F)c1)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL250996 | 94410 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 367 | 5 | 0 | 4 | 5.5 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)c(F)c1)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 11475476 | 174992 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 413 | 4 | 1 | 6 | 3.2 | CCc1cc(C#N)ccc1N1CCc2c(-n3ccc(N4CCNC4=O)n3)cc(C)nc21 | 10.1021/jm800744m | |||
| CHEMBL456660 | 174992 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 413 | 4 | 1 | 6 | 3.2 | CCc1cc(C#N)ccc1N1CCc2c(-n3ccc(N4CCNC4=O)n3)cc(C)nc21 | 10.1021/jm800744m | |||
| 58223494 | 127833 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 4.8 | COCc1cc(OC)c(-c2c(C)sc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664546 | 127833 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 4.8 | COCc1cc(OC)c(-c2c(C)sc3c(N(CC4CC4)CC4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58223415 | 127838 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 10 | 0 | 9 | 4.2 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOC1 | nan | |||
| CHEMBL3664551 | 127838 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 461 | 10 | 0 | 9 | 4.2 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOC1 | nan | |||
| 58223501 | 127890 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 489 | 12 | 0 | 9 | 4.9 | CCCN(CC1CCOC1)c1c(OCC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664602 | 127890 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 489 | 12 | 0 | 9 | 4.9 | CCCN(CC1CCOC1)c1c(OCC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58801661 | 77565 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 495 | 11 | 0 | 8 | 4.8 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087573 | 77565 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 495 | 11 | 0 | 8 | 4.8 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 46890981 | 6841 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 358 | 7 | 1 | 7 | 2.9 | COCC(C1CC1)n1nc(C)nc(Nc2c(C)cc(OC)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084027 | 6841 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 358 | 7 | 1 | 7 | 2.9 | COCC(C1CC1)n1nc(C)nc(Nc2c(C)cc(OC)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 11361847 | 63898 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 408 | 5 | 0 | 4 | 5.5 | CCc1nc2c(n1C(CC)C(C)C)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL180491 | 63898 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 408 | 5 | 0 | 4 | 5.5 | CCc1nc2c(n1C(CC)C(C)C)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 58223387 | 127841 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | COc1cc(C(C)OC)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| CHEMBL3664554 | 127841 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | COc1cc(C(C)OC)cc(OC)c1-c1csc2c(N(CC3CC3)CC3CCOC3)c(OC)nn12 | nan | |||
| 58223495 | 127879 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 473 | 9 | 0 | 9 | 4.4 | COCc1cc(OC)c(-c2csc3c(N(C4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664591 | 127879 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 473 | 9 | 0 | 9 | 4.4 | COCc1cc(OC)c(-c2csc3c(N(C4CCC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58223451 | 127886 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 456 | 9 | 0 | 9 | 4.4 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12)C1CCCC1 | nan | |||
| CHEMBL3664598 | 127886 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 456 | 9 | 0 | 9 | 4.4 | COCCN(c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12)C1CCCC1 | nan | |||
| 58223407 | 127894 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 480 | 10 | 0 | 9 | 5.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)c4cccnc4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664606 | 127894 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 480 | 10 | 0 | 9 | 5.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)c4cccnc4)c(OC)nn23)c(OC)c1 | nan | |||
| 60155540 | 77572 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 490 | 10 | 0 | 8 | 4.7 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C#N)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087794 | 77572 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 490 | 10 | 0 | 8 | 4.7 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4CC4)c(C#N)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 44237814 | 82610 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.0 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179188 | 82610 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.0 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 155553483 | 174191 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 508 | 7 | 1 | 6 | 7.0 | COc1cccc(N(c2cccc3nc(Nc4c(C)cc(Br)cc4OC)n(C)c23)C(C)C)c1 | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4547748 | 174191 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 508 | 7 | 1 | 6 | 7.0 | COc1cccc(N(c2cccc3nc(Nc4c(C)cc(Br)cc4OC)n(C)c23)C(C)C)c1 | 10.1016/j.bmc.2016.08.005 | |||
| 10157505 | 123855 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 394 | 5 | 0 | 4 | 5.3 | CCCC(C)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL362601 | 123855 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 394 | 5 | 0 | 4 | 5.3 | CCCC(C)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 58223477 | 127859 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 482 | 11 | 0 | 9 | 5.0 | CCCN(Cc1ccncc1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664572 | 127859 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 482 | 11 | 0 | 9 | 5.0 | CCCN(Cc1ccncc1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58223420 | 127893 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 486 | 11 | 0 | 9 | 5.1 | COCc1cc(OC)c(-c2csc3c(N(CCCF)c4cccnc4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664605 | 127893 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 486 | 11 | 0 | 9 | 5.1 | COCc1cc(OC)c(-c2csc3c(N(CCCF)c4cccnc4)c(OC)nn23)c(OC)c1 | nan | |||
| 71580428 | 88445 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 397 | 8 | 1 | 8 | 3.1 | COc1nc(C)c(Nc2nc(Cl)cn(C(CCF)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349572 | 88445 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 397 | 8 | 1 | 8 | 3.1 | COc1nc(C)c(Nc2nc(Cl)cn(C(CCF)C3CC3)c2=O)c(OC)n1 | 10.1016/j.bmcl.2013.02.009 | |||
| 137635682 | 156000 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 480 | 7 | 2 | 6 | 5.3 | CCN(CC(C)O)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4061900 | 156000 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 480 | 7 | 2 | 6 | 5.3 | CCN(CC(C)O)c1ccc(Br)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 155565844 | 175617 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 535 | 7 | 2 | 6 | 6.3 | CNC(=O)c1cccc(N(c2cccc3nc(Nc4c(C)cc(Br)cc4OC)n(C)c23)C(C)C)c1 | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4580457 | 175617 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 535 | 7 | 2 | 6 | 6.3 | CNC(=O)c1cccc(N(c2cccc3nc(Nc4c(C)cc(Br)cc4OC)n(C)c23)C(C)C)c1 | 10.1016/j.bmc.2016.08.005 | |||
| 44589203 | 175957 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 389 | 4 | 0 | 7 | 4.4 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C)c1 | 10.1021/jm800743q | |||
| CHEMBL458825 | 175957 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 389 | 4 | 0 | 7 | 4.4 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C)c1 | 10.1021/jm800743q | |||
| 90654667 | 110072 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 386 | 9 | 1 | 5 | 6.2 | CCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)c1SCC | 10.1016/j.ejmech.2014.03.040 | |||
| CHEMBL3235703 | 110072 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 386 | 9 | 1 | 5 | 6.2 | CCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)c1SCC | 10.1016/j.ejmech.2014.03.040 | |||
| 10432407 | 66317 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 422 | 7 | 0 | 4 | 6.1 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL184938 | 66317 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 422 | 7 | 0 | 4 | 6.1 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 10271870 | 123433 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 392 | 4 | 0 | 4 | 4.9 | CCc1nc2c(n1C(C)C1CC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL361745 | 123433 | 0 | None | - | 0 | Rat | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 392 | 4 | 0 | 4 | 4.9 | CCc1nc2c(n1C(C)C1CC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 10112643 | 66352 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.0 | CCc1nc2c(n1C(CC)C(C)C)C(=O)N(C)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL185103 | 66352 | 0 | None | - | 0 | Rat | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.0 | CCc1nc2c(n1C(CC)C(C)C)C(=O)N(C)CN2c1ccc(C(C)C)cc1Cl | 10.1021/jm049787k | |||
| 58896411 | 176205 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 464 | 7 | 1 | 6 | 6.8 | COc1ccc(N(c2cccc3nc(Nc4c(C)cc(Cl)cc4OC)n(C)c23)C(C)C)cc1 | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4593848 | 176205 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 464 | 7 | 1 | 6 | 6.8 | COc1ccc(N(c2cccc3nc(Nc4c(C)cc(Cl)cc4OC)n(C)c23)C(C)C)cc1 | 10.1016/j.bmc.2016.08.005 | |||
| 58223488 | 127837 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 473 | 10 | 0 | 9 | 4.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664550 | 127837 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 473 | 10 | 0 | 9 | 4.2 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)C4CCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58223480 | 127840 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 445 | 8 | 0 | 8 | 4.8 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(C)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664553 | 127840 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 445 | 8 | 0 | 8 | 4.8 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(C)cc3OC)csc12)C1CCOCC1 | nan | |||
| 11374063 | 176114 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 440 | 5 | 1 | 6 | 3.7 | COc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C(F)F)c1 | 10.1021/jm800744m | |||
| CHEMBL459173 | 176114 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 440 | 5 | 1 | 6 | 3.7 | COc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C(F)F)c1 | 10.1021/jm800744m | |||
| 44589238 | 177012 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 409 | 4 | 0 | 7 | 4.7 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| CHEMBL462789 | 177012 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 409 | 4 | 0 | 7 | 4.7 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(Cl)c1 | 10.1021/jm800743q | |||
| 70692630 | 75898 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.ejmech.2021.114085 | |||
| CHEMBL2049188 | 75898 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 376 | 7 | 1 | 4 | 6.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12 | 10.1016/j.ejmech.2021.114085 | |||
| 58223497 | 127850 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 475 | 13 | 0 | 9 | 4.5 | COCCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664563 | 127850 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 475 | 13 | 0 | 9 | 4.5 | COCCCN(CC1CC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58223377 | 127854 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 13 | 0 | 9 | 4.5 | CCCN(CCCOC)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664567 | 127854 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 463 | 13 | 0 | 9 | 4.5 | CCCN(CCCOC)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 21984746 | 77548 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 365 | 8 | 0 | 4 | 5.5 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3C)cccc12 | 10.1021/jm300259r | |||
| CHEMBL2087556 | 77548 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 365 | 8 | 0 | 4 | 5.5 | CCCN(CCC)c1c(CC)nn2c(-c3ccc(OC)cc3C)cccc12 | 10.1021/jm300259r | |||
| 24768341 | 85604 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 378 | 6 | 1 | 6 | 3.7 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| CHEMBL228223 | 85604 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 378 | 6 | 1 | 6 | 3.7 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(C#N)cc1C | 10.1021/jm0611410 | |||
| 58223474 | 127883 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 500 | 12 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCCF)Cc4cccnc4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664595 | 127883 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 500 | 12 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCCF)Cc4cccnc4)c(OC)nn23)c(OC)c1 | nan | |||
| 42618210 | 179811 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 367 | 5 | 0 | 7 | 3.3 | CCN(CC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL474493 | 179811 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 367 | 5 | 0 | 7 | 3.3 | CCN(CC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 145969226 | 164997 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225709 | 164997 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 491 | 5 | 0 | 7 | 5.5 | COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc([C@@H](OC(F)F)C(F)(F)F)c23)c(C)n1 | 10.1016/j.bmc.2018.01.020 | |||
| 44589115 | 175468 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 4 | 0 | 8 | 5.0 | O=[N+]([O-])c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| CHEMBL457714 | 175468 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 4 | 0 | 8 | 5.0 | O=[N+]([O-])c1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| 155520133 | 173240 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 492 | 8 | 1 | 6 | 7.6 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3cccc(OC(C)C)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4524490 | 173240 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 492 | 8 | 1 | 6 | 7.6 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3cccc(OC(C)C)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 90654668 | 110073 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 418 | 11 | 1 | 7 | 4.7 | CCSc1c(Nc2c(C)cc(C)cc2C)nc(C)nc1N(CCOC)CCOC | 10.1016/j.ejmech.2014.03.040 | |||
| CHEMBL3235705 | 110073 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 418 | 11 | 1 | 7 | 4.7 | CCSc1c(Nc2c(C)cc(C)cc2C)nc(C)nc1N(CCOC)CCOC | 10.1016/j.ejmech.2014.03.040 | |||
| 58223491 | 127864 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 13 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CCOC(C)C)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664577 | 127864 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 13 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CCOC(C)C)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| 22177860 | 64745 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 432 | 6 | 1 | 5 | 5.8 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C(F)(F)F)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819069 | 64745 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 432 | 6 | 1 | 5 | 5.8 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C(F)(F)F)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 67364197 | 130603 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 5 | 1 | 5 | 6.2 | Cc1cc(-c2ccc3c(c2)OCO3)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | |||
| CHEMBL3681386 | 130603 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 5 | 1 | 5 | 6.2 | Cc1cc(-c2ccc3c(c2)OCO3)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | |||
| 56678852 | 64759 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 372 | 6 | 1 | 5 | 5.3 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819084 | 64759 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 372 | 6 | 1 | 5 | 5.3 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3Cl)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | |||
| 10112776 | 166214 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 418 | 5 | 0 | 4 | 5.3 | CCc1nc2c(n1C(C1CC1)C1CC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL426607 | 166214 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 418 | 5 | 0 | 4 | 5.3 | CCc1nc2c(n1C(C1CC1)C1CC1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 42618201 | 179251 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 447 | 7 | 1 | 7 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(OC)c(OC)cc3Br)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL472873 | 179251 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 447 | 7 | 1 | 7 | 4.8 | CCC(CC)Nc1nc(C)nc2c(-c3cc(OC)c(OC)cc3Br)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618167 | 180653 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 339 | 5 | 0 | 6 | 3.6 | CCN(CC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL475505 | 180653 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 339 | 5 | 0 | 6 | 3.6 | CCN(CC)c1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 10379 | 3059 | 39 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1124/dmd.111.043596 | |||
| 9884366 | 3059 | 39 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1124/dmd.111.043596 | |||
| CHEMBL482950 | 3059 | 39 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1124/dmd.111.043596 | |||
| DB12572 | 3059 | 39 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1124/dmd.111.043596 | |||
| 11552261 | 65510 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 361 | 5 | 1 | 5 | 5.7 | CCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830527 | 65510 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 361 | 5 | 1 | 5 | 5.7 | CCC(CC)n1ccc2c(Nc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | |||
| 10379 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm200365y | |||
| 9884366 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm200365y | |||
| CHEMBL482950 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm200365y | |||
| DB12572 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm200365y | |||
| 10379 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| 9884366 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| CHEMBL482950 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| DB12572 | 3059 | 39 | None | - | 1 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 10.1021/jm900025h | |||
| 46891032 | 6669 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 398 | 7 | 1 | 7 | 3.6 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083420 | 6669 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 398 | 7 | 1 | 7 | 3.6 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891091 | 6822 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 434 | 8 | 1 | 7 | 4.2 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083948 | 6822 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 434 | 8 | 1 | 7 | 4.2 | COCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891034 | 7402 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 420 | 5 | 1 | 5 | 5.4 | CCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086509 | 7402 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 420 | 5 | 1 | 5 | 5.4 | CCC(C1CC1)n1nc(C)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 44190240 | 196740 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| CHEMBL565144 | 196740 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 382 | 4 | 1 | 5 | 4.8 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C#N)cc2Cl)c1=O | 10.1021/jm900301y | |||
| 24768327 | 98037 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 392 | 7 | 2 | 6 | 4.4 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)OC | 10.1021/jm070579c | |||
| CHEMBL273040 | 98037 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 392 | 7 | 2 | 6 | 4.4 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)OC | 10.1021/jm070579c | |||
| 24768327 | 98037 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 392 | 7 | 2 | 6 | 4.4 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)OC | 10.1021/jm070579c | |||
| CHEMBL273040 | 98037 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 392 | 7 | 2 | 6 | 4.4 | CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)OC | 10.1021/jm070579c | |||
| 42618185 | 179816 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 369 | 6 | 0 | 7 | 3.6 | CCCN(C)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL474499 | 179816 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 369 | 6 | 0 | 7 | 3.6 | CCCN(C)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 52918269 | 61041 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 397 | 8 | 0 | 8 | 3.2 | COc1ccc(-c2c(C)nn3c(N(CCC#N)CCCF)nc(C)nc23)c(C)n1 | 10.1016/j.bmcl.2011.02.050 | |||
| CHEMBL1762822 | 61041 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 397 | 8 | 0 | 8 | 3.2 | COc1ccc(-c2c(C)nn3c(N(CCC#N)CCCF)nc(C)nc23)c(C)n1 | 10.1016/j.bmcl.2011.02.050 | |||
| 46891289 | 6883 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 343 | 6 | 1 | 7 | 3.1 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084205 | 6883 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 343 | 6 | 1 | 7 | 3.1 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(OC)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891553 | 7343 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 395 | 8 | 1 | 8 | 2.9 | COC[C@H](C1CC1)n1nc(C)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1086240 | 7343 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 395 | 8 | 1 | 8 | 2.9 | COC[C@H](C1CC1)n1nc(C)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 44191014 | 195026 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 441 | 5 | 1 | 5 | 5.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL549320 | 195026 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 441 | 5 | 1 | 5 | 5.8 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(OC(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 44190335 | 196075 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 331 | 5 | 1 | 4 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2ccc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL560633 | 196075 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 331 | 5 | 1 | 4 | 4.6 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2ccc(C)cc2C)c1=O | 10.1021/jm900301y | |||
| 42618228 | 180659 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 370 | 7 | 0 | 8 | 2.6 | CCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL475507 | 180659 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 370 | 7 | 0 | 8 | 2.6 | CCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 46891230 | 6393 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 369 | 5 | 1 | 7 | 3.1 | COc1ccc(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082300 | 6393 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 369 | 5 | 1 | 7 | 3.1 | COc1ccc(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 127047692 | 139857 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 441 | 8 | 1 | 8 | 4.1 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3cccnc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799211 | 139857 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 441 | 8 | 1 | 8 | 4.1 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3cccnc3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 44190557 | 196532 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 379 | 5 | 1 | 7 | 3.3 | COc1ccc(Nc2nc(C#N)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| CHEMBL563652 | 196532 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 379 | 5 | 1 | 7 | 3.3 | COc1ccc(Nc2nc(C#N)cn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1021/jm900301y | |||
| 10377 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 9818802 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| CHEMBL270738 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 10377 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| 9818802 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| CHEMBL270738 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| 10377 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | |||
| 9818802 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | |||
| CHEMBL270738 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm200365y | |||
| 127047549 | 139962 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 466 | 8 | 1 | 9 | 4.0 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3cc(C#N)ccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799801 | 139962 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 466 | 8 | 1 | 9 | 4.0 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3cc(C#N)ccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 46881790 | 7266 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 387 | 5 | 1 | 6 | 4.2 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1N1CCCC1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1085930 | 7266 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 387 | 5 | 1 | 6 | 4.2 | Cc1cc(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)nc1N1CCCC1 | 10.1016/j.bmcl.2010.01.129 | |||
| 10377 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 9818802 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| CHEMBL270738 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070579c | |||
| 10377 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| 9818802 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| CHEMBL270738 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| 10377 | 1179 | 27 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| 9818802 | 1179 | 27 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| CHEMBL270738 | 1179 | 27 | None | -1 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1021/jm070578k | |||
| 24768333 | 85584 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 400 | 8 | 1 | 8 | 2.9 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| CHEMBL228169 | 85584 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 400 | 8 | 1 | 8 | 2.9 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| 46891157 | 6493 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 323 | 4 | 1 | 6 | 3.2 | Cc1nc(Nc2cc(C)c(C#N)cc2C)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082705 | 6493 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 323 | 4 | 1 | 6 | 3.2 | Cc1nc(Nc2cc(C)c(C#N)cc2C)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 44589305 | 188703 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 390 | 4 | 0 | 8 | 3.8 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C)n1 | 10.1021/jm800743q | |||
| CHEMBL504383 | 188703 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 390 | 4 | 0 | 8 | 3.8 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C)n1 | 10.1021/jm800743q | |||
| 10294046 | 64754 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 394 | 7 | 1 | 6 | 4.8 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)c(OC)c4)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819079 | 64754 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 394 | 7 | 1 | 6 | 4.8 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)c(OC)c4)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 58223382 | 82600 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4(F)CCOCC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL2179178 | 82600 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4(F)CCOCC4)c(OC)nn23)c(OC)c1 | nan | |||
| 58223515 | 127875 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 12 | 0 | 9 | 5.0 | COCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| CHEMBL3664588 | 127875 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 12 | 0 | 9 | 5.0 | COCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| 58223449 | 127876 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 457 | 8 | 0 | 8 | 5.0 | CCN(c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664589 | 127876 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 457 | 8 | 0 | 8 | 5.0 | CCN(c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12)C1CCOCC1 | nan | |||
| 58223517 | 127882 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 500 | 12 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCCF)Cc4ccncc4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664594 | 127882 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 500 | 12 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCCF)Cc4ccncc4)c(OC)nn23)c(OC)c1 | nan | |||
| 56673724 | 65301 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 373 | 8 | 1 | 6 | 4.8 | CCCN(CCC)c1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828888 | 65301 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 373 | 8 | 1 | 6 | 4.8 | CCCN(CCC)c1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 58223382 | 82600 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4(F)CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179178 | 82600 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 519 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4(F)CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 21912450 | 98012 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 343 | 7 | 1 | 4 | 5.2 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(CO)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272904 | 98012 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 343 | 7 | 1 | 4 | 5.2 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(CO)cc2C)c1C | 10.1021/jm070578k | |||
| 21912450 | 98012 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 343 | 7 | 1 | 4 | 5.2 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(CO)cc2C)c1C | 10.1021/jm070578k | |||
| CHEMBL272904 | 98012 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 343 | 7 | 1 | 4 | 5.2 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(CO)cc2C)c1C | 10.1021/jm070578k | |||
| 58223461 | 127896 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 499 | 11 | 0 | 9 | 4.3 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4C5COCC54)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664608 | 127896 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 499 | 11 | 0 | 9 | 4.3 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4C5COCC54)c(OC)nn23)c(OC)c1 | nan | |||
| 71455050 | 81512 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(Cl)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160161 | 81512 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(Cl)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 22177936 | 64746 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 424 | 8 | 1 | 6 | 5.7 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(CSC)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819070 | 64746 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 424 | 8 | 1 | 6 | 5.7 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(CSC)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 10495051 | 187176 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 308 | 3 | 1 | 4 | 4.4 | CCNc1nc(C)nc2c1c(C)cn2-c1c(C)cc(C)cc1C | 10.1021/jm960861b | |||
| CHEMBL49217 | 187176 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 308 | 3 | 1 | 4 | 4.4 | CCNc1nc(C)nc2c1c(C)cn2-c1c(C)cc(C)cc1C | 10.1021/jm960861b | |||
| 10161139 | 65197 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 450 | 8 | 0 | 4 | 6.9 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)C(CC)N2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL182497 | 65197 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 450 | 8 | 0 | 4 | 6.9 | CCCC(CCC)n1c(CC)nc2c1C(=O)N(C)C(CC)N2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 58223442 | 127889 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OCC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664601 | 127889 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OCC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | nan | |||
| 44478733 | 82615 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 479 | 9 | 0 | 8 | 5.3 | CCCN(c1c(OC)nn2c(-c3c(Cl)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179193 | 82615 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 479 | 9 | 0 | 8 | 5.3 | CCCN(c1c(OC)nn2c(-c3c(Cl)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 44191106 | 196358 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 435 | 5 | 1 | 6 | 4.3 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(S(C)(=O)=O)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL562492 | 196358 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 435 | 5 | 1 | 6 | 4.3 | C[C@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(S(C)(=O)=O)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 44444335 | 94466 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 349 | 5 | 0 | 4 | 5.4 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL251344 | 94466 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 349 | 5 | 0 | 4 | 5.4 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC)cc1)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 53358379 | 130601 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 4.2 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)cnc3C)CC2)n1 | nan | |||
| CHEMBL3681384 | 130601 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 4.2 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)cnc3C)CC2)n1 | nan | |||
| 58223511 | 127842 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 459 | 9 | 0 | 8 | 5.0 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(CC)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664555 | 127842 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 459 | 9 | 0 | 8 | 5.0 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(CC)cc3OC)csc12)C1CCOCC1 | nan | |||
| 70681899 | 75585 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 480 | 10 | 0 | 7 | 5.8 | CCN(CC1CCOCC1)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2046528 | 75585 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 480 | 10 | 0 | 7 | 5.8 | CCN(CC1CCOCC1)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 11271502 | 139406 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 10 | 1 | 7 | 4.5 | COCCN(CCOC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793560 | 139406 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 476 | 10 | 1 | 7 | 4.5 | COCCN(CCOC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 71457262 | 82613 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.0 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179191 | 82613 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.0 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 46881745 | 7221 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 332 | 4 | 1 | 5 | 3.9 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1085683 | 7221 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 332 | 4 | 1 | 5 | 3.9 | Cc1cc(C)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)c(C)n1 | 10.1016/j.bmcl.2010.01.129 | |||
| 58223516 | 127885 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 493 | 11 | 0 | 8 | 5.7 | COCCCN(c1c(OC)nn2c(-c3c(Cl)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| CHEMBL3664597 | 127885 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 493 | 11 | 0 | 8 | 5.7 | COCCCN(c1c(OC)nn2c(-c3c(Cl)cc(COC)cc3OC)csc12)C1CCCC1 | nan | |||
| 57786313 | 164984 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 418 | 3 | 0 | 4 | 6.6 | CCC(C#N)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225575 | 164984 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 418 | 3 | 0 | 4 | 6.6 | CCC(C#N)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 11223423 | 189542 | 30 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 404 | 4 | 1 | 6 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL514270 | 189542 | 30 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 404 | 4 | 1 | 6 | 3.1 | COc1ccc(N2CCc3c(-n4ccc(N5CCNC5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 53358376 | 130605 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 376 | 5 | 2 | 5 | 3.0 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(CO)cc2C)CC1 | nan | |||
| CHEMBL3681388 | 130605 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 376 | 5 | 2 | 5 | 3.0 | Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2nc(CO)cc2C)CC1 | nan | |||
| 56683764 | 65503 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 387 | 8 | 0 | 6 | 4.8 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830520 | 65503 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 387 | 8 | 0 | 6 | 4.8 | CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2nccn12 | 10.1016/j.bmc.2011.08.055 | |||
| 71449705 | 81508 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(Cl)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160157 | 81508 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(OC)c2nc(-c3c(Cl)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 127047520 | 140068 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 469 | 8 | 1 | 9 | 3.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3ccccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3800457 | 140068 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 469 | 8 | 1 | 9 | 3.9 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COC(=O)c3ccccn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmc.2016.11.011 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmc.2016.11.011 | |||
| 53357658 | 130608 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 429 | 5 | 1 | 4 | 4.9 | COc1cc(C)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | |||
| CHEMBL3681391 | 130608 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 429 | 5 | 1 | 4 | 4.9 | COc1cc(C)nn1C[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 | nan | |||
| 11317069 | 174981 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 4 | 1 | 6 | 4.0 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(OC(F)(F)F)cc1C)CC2 | 10.1021/jm800744m | |||
| CHEMBL456640 | 174981 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 458 | 4 | 1 | 6 | 4.0 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(OC(F)(F)F)cc1C)CC2 | 10.1021/jm800744m | |||
| 11350078 | 189787 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 1 | 6 | 3.0 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(C#N)cc1C)CC2 | 10.1021/jm800744m | |||
| CHEMBL516170 | 189787 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 399 | 3 | 1 | 6 | 3.0 | Cc1cc(-n2ccc(N3CCNC3=O)n2)c2c(n1)N(c1ccc(C#N)cc1C)CC2 | 10.1021/jm800744m | |||
| 70692632 | 75901 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 392 | 7 | 1 | 5 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)n(C)c12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049191 | 75901 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 392 | 7 | 1 | 5 | 5.2 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)n(C)c12 | 10.1016/j.bmcl.2012.05.066 | |||
| 46890980 | 6840 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 328 | 5 | 1 | 6 | 3.3 | COc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084026 | 6840 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 328 | 5 | 1 | 6 | 3.3 | COc1cc(C)c(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| 44397042 | 12270 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 408 | 6 | 2 | 5 | 4.6 | CCC(CNc1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl)OC | 10.1021/jm049737f | |||
| CHEMBL1184732 | 12270 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 408 | 6 | 2 | 5 | 4.6 | CCC(CNc1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl)OC | 10.1021/jm049737f | |||
| CHEMBL365868 | 12270 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 408 | 6 | 2 | 5 | 4.6 | CCC(CNc1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl)OC | 10.1021/jm049737f | |||
| 56683761 | 65495 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 431 | 11 | 0 | 7 | 4.8 | CCCN(CCC)c1cc(N(CCOC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830513 | 65495 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 431 | 11 | 0 | 7 | 4.8 | CCCN(CCC)c1cc(N(CCOC)c2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 71451919 | 82598 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179176 | 82598 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOCC4)CC4CC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 46891389 | 6486 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 398 | 7 | 1 | 7 | 3.6 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082671 | 6486 | 0 | None | - | 0 | Rat | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 398 | 7 | 1 | 7 | 3.6 | COC[C@@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 58896587 | 173369 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 449 | 6 | 1 | 6 | 6.5 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccc(C)cn3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4527586 | 173369 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 449 | 6 | 1 | 6 | 6.5 | COc1cc(Cl)cc(C)c1Nc1nc2cccc(N(c3ccc(C)cn3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 155548925 | 173815 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 6 | 1 | 6 | 6.8 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C#N)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4538409 | 173815 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 6 | 1 | 6 | 6.8 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C#N)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 53358268 | 130604 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 376 | 5 | 2 | 5 | 3.0 | Cc1cc(CO)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| CHEMBL3681387 | 130604 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 376 | 5 | 2 | 5 | 3.0 | Cc1cc(CO)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| 11703582 | 65511 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 378 | 7 | 0 | 6 | 5.4 | CCc1ccc(Oc2nc3ccnn3c3c2ccn3C(CC)CC)c(OC)c1 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830528 | 65511 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 378 | 7 | 0 | 6 | 5.4 | CCc1ccc(Oc2nc3ccnn3c3c2ccn3C(CC)CC)c(OC)c1 | 10.1016/j.bmc.2011.08.055 | |||
| 10376 | 2930 | 4 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | |||
| 9801039 | 2930 | 4 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819077 | 2930 | 4 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 398 | 6 | 1 | 5 | 5.5 | CCC(Nc1c2CCCc2nc2n1nc(c2c1ccc(cc1Cl)OC)C)CC | 10.1016/j.bmc.2011.07.055 | |||
| 56668633 | 64761 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819086 | 64761 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)CCO2 | 10.1016/j.bmc.2011.07.055 | |||
| 42618221 | 179632 | 11 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL474288 | 179632 | 11 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](C)Nc1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 56670271 | 65509 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 360 | 5 | 0 | 4 | 5.6 | CCC(CC)n1ccc2c(Cc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830526 | 65509 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 360 | 5 | 0 | 4 | 5.6 | CCC(CC)n1ccc2c(Cc3c(C)cc(C)cc3C)nc3ccnn3c21 | 10.1016/j.bmc.2011.08.055 | |||
| 57786006 | 164963 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 422 | 4 | 0 | 4 | 6.4 | CCN(CC)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225254 | 164963 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 422 | 4 | 0 | 4 | 6.4 | CCN(CC)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 11407418 | 66721 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 416 | 6 | 1 | 4 | 4.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccccc1Br | 10.1021/jm049737f | |||
| CHEMBL185648 | 66721 | 0 | None | - | 0 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 416 | 6 | 1 | 4 | 4.9 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccccc1Br | 10.1021/jm049737f | |||
| 46891492 | 6564 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 398 | 7 | 1 | 7 | 3.6 | COC[C@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083011 | 6564 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 398 | 7 | 1 | 7 | 3.6 | COC[C@H](C1CC1)n1nc(C)nc(Nc2c(Cl)cc(OC)cc2Cl)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 46891441 | 7068 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.6 | Cc1nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c(=O)n([C@@H](C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1084988 | 7068 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.6 | Cc1nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c(=O)n([C@@H](C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 10405373 | 97403 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 346 | 6 | 1 | 3 | 6.4 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL269833 | 97403 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 346 | 6 | 1 | 3 | 6.4 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070579c | |||
| 10405373 | 97403 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 346 | 6 | 1 | 3 | 6.4 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL269833 | 97403 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 346 | 6 | 1 | 3 | 6.4 | CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C | 10.1021/jm070579c | |||
| 54754515 | 65300 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 373 | 7 | 2 | 6 | 5.0 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828887 | 65300 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 373 | 7 | 2 | 6 | 5.0 | CCC(CC)Nc1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 71580314 | 88439 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 404 | 8 | 1 | 6 | 4.1 | Cc1cc(C#N)cc(C)c1Nc1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349565 | 88439 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 404 | 8 | 1 | 6 | 4.1 | Cc1cc(C#N)cc(C)c1Nc1nc(Cl)cn([C@@H](COCCF)C2CC2)c1=O | 10.1016/j.bmcl.2013.02.009 | |||
| 24758075 | 69982 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 350 | 5 | 0 | 4 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3cnc(N(C)C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939577 | 69982 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 350 | 5 | 0 | 4 | 5.3 | CCC(CC)c1cc(C)n2nc(-c3cnc(N(C)C)cc3C)c(C)cc12 | 10.1016/j.bmc.2011.11.015 | |||
| 58012370 | 158160 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 433 | 8 | 1 | 4 | 7.6 | CCCC(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4087369 | 158160 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 433 | 8 | 1 | 4 | 7.6 | CCCC(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 46891440 | 6397 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 4.0 | COc1cc(Cl)c(Nc2nc(C)nn([C@@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082309 | 6397 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 4.0 | COc1cc(Cl)c(Nc2nc(C)nn([C@@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| 44191185 | 195935 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 416 | 4 | 1 | 5 | 5.2 | C[C@H](C1CC1)n1cc(C#N)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL559443 | 195935 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 416 | 4 | 1 | 5 | 5.2 | C[C@H](C1CC1)n1cc(C#N)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 127030925 | 139493 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 386 | 6 | 1 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794475 | 139493 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 386 | 6 | 1 | 5 | 5.4 | CCN(CC)c1ccc(C)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 10713700 | 101910 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 362 | 5 | 0 | 4 | 5.4 | C/C=C/CN(CC)c1nc(C)nc2c1c(C)cn2-c1c(C)cc(C)cc1C | 10.1021/jm960861b | |||
| CHEMBL300935 | 101910 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 362 | 5 | 0 | 4 | 5.4 | C/C=C/CN(CC)c1nc(C)nc2c1c(C)cn2-c1c(C)cc(C)cc1C | 10.1021/jm960861b | |||
| 71580216 | 88435 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 440 | 9 | 1 | 7 | 4.1 | COc1cc(Cl)c(Nc2nc(C#N)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL2349561 | 88435 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 440 | 9 | 1 | 7 | 4.1 | COc1cc(Cl)c(Nc2nc(C#N)cn([C@@H](COCCF)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2013.02.009 | |||
| 127047691 | 139680 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 466 | 8 | 1 | 9 | 4.0 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3ccc(C#N)cn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3797955 | 139680 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 466 | 8 | 1 | 9 | 4.0 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3ccc(C#N)cn3)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 56961967 | 81995 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 425 | 8 | 1 | 7 | 3.2 | COCC(COC)n1cc(Br)nc(Nc2c(C)cc(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165200 | 81995 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 425 | 8 | 1 | 7 | 3.2 | COCC(COC)n1cc(Br)nc(Nc2c(C)cc(OC)cc2C)c1=O | 10.1016/j.bmcl.2012.08.112 | |||
| 57400679 | 69989 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 383 | 7 | 1 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939584 | 69989 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 383 | 7 | 1 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CCO)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 57393714 | 70003 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 367 | 5 | 0 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939598 | 70003 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 367 | 5 | 0 | 6 | 3.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 44191105 | 195248 | 1 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 425 | 4 | 1 | 4 | 5.9 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL551029 | 195248 | 1 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 425 | 4 | 1 | 4 | 5.9 | C[C@@H](C1CC1)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 58012303 | 156791 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 409 | 5 | 1 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4070898 | 156791 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 409 | 5 | 1 | 3 | 7.5 | CCC(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 42618190 | 179279 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 429 | 10 | 0 | 9 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL473076 | 179279 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 429 | 10 | 0 | 9 | 2.8 | COCCN(CCOC)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 | 10.1021/jm9000242 | |||
| 60141295 | 75588 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 410 | 9 | 0 | 6 | 5.3 | CCN(CC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2046534 | 75588 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 410 | 9 | 0 | 6 | 5.3 | CCN(CC)c1cccc2nc(Oc3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 57912459 | 82617 | 5 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179195 | 82617 | 5 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 503 | 12 | 0 | 9 | 5.4 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COCC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 58223389 | 127836 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 505 | 12 | 0 | 10 | 4.5 | CCCCN(CC1COCOC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664549 | 127836 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 505 | 12 | 0 | 10 | 4.5 | CCCCN(CC1COCOC1)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 22178019 | 64755 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 412 | 7 | 1 | 5 | 5.8 | CCOc1ccc(-c2c(C)nn3c(NC(CC)CC)c4c(nc23)CCC4)c(Cl)c1 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819080 | 64755 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 412 | 7 | 1 | 5 | 5.8 | CCOc1ccc(-c2c(C)nn3c(NC(CC)CC)c4c(nc23)CCC4)c(Cl)c1 | 10.1016/j.bmc.2011.07.055 | |||
| 24768345 | 85530 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 395 | 7 | 1 | 6 | 4.0 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| CHEMBL227572 | 85530 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 395 | 7 | 1 | 6 | 4.0 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| 22177924 | 64747 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(C)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819071 | 64747 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4ccc(C)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 46881791 | 7267 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 372 | 4 | 1 | 5 | 4.3 | Cc1nc(C(F)(F)F)ccc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1085931 | 7267 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 372 | 4 | 1 | 5 | 4.3 | Cc1nc(C(F)(F)F)ccc1Nc1nc(Cl)cn([C@H](C)C2CC2)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 58223439 | 127874 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 475 | 12 | 0 | 9 | 4.6 | COCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCC1 | nan | |||
| CHEMBL3664587 | 127874 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 475 | 12 | 0 | 9 | 4.6 | COCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCC1 | nan | |||
| 58223408 | 127849 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 465 | 8 | 0 | 8 | 5.1 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(Cl)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664562 | 127849 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 465 | 8 | 0 | 8 | 5.1 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(Cl)cc3OC)csc12)C1CCOCC1 | nan | |||
| 58223434 | 128814 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 517 | 12 | 0 | 9 | 5.8 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC(C)C)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3669432 | 128814 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 517 | 12 | 0 | 9 | 5.8 | CCCCN(c1c(OC)nn2c(-c3c(OC)cc(COC(C)C)cc3OC)csc12)C1CCOCC1 | nan | |||
| 46881746 | 6924 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 346 | 4 | 1 | 6 | 3.3 | Cc1nc2c(cc1Nc1nc(Cl)cn([C@H](C)C3CC3)c1=O)COC2 | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1084422 | 6924 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 346 | 4 | 1 | 6 | 3.3 | Cc1nc2c(cc1Nc1nc(Cl)cn([C@H](C)C3CC3)c1=O)COC2 | 10.1016/j.bmcl.2010.01.129 | |||
| 21912204 | 97705 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 325 | 6 | 2 | 3 | 6.0 | CCC(CC)Nc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL271368 | 97705 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 325 | 6 | 2 | 3 | 6.0 | CCC(CC)Nc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| 44589258 | 175678 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 395 | 3 | 0 | 8 | 3.8 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C#N)c1 | 10.1021/jm800743q | |||
| CHEMBL458177 | 175678 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 395 | 3 | 0 | 8 | 3.8 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C#N)c1 | 10.1021/jm800743q | |||
| 70690480 | 75904 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 443 | 7 | 1 | 4 | 6.9 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CCOCC4)CC4CC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049195 | 75904 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 443 | 7 | 1 | 4 | 6.9 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CCOCC4)CC4CC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| 58223505 | 127884 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 500 | 12 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCCF)Cc4ccccn4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664596 | 127884 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 500 | 12 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCCF)Cc4ccccn4)c(OC)nn23)c(OC)c1 | nan | |||
| 70688433 | 75903 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 399 | 7 | 1 | 3 | 6.8 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CC4)CC4CC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049194 | 75903 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 399 | 7 | 1 | 3 | 6.8 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CC4)CC4CC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| 71450106 | 82602 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCCCO4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179180 | 82602 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4CCCCO4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 155541854 | 173045 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 549 | 7 | 1 | 6 | 6.6 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C(=O)N(C)C)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4519158 | 173045 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 549 | 7 | 1 | 6 | 6.6 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(C(=O)N(C)C)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 10127304 | 65249 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 7 | 0 | 6 | 4.9 | CCCC(CCC)n1c(CC)nc2c1c(=O)n(C)c(=O)n2-c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL182744 | 65249 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 7 | 0 | 6 | 4.9 | CCCC(CCC)n1c(CC)nc2c1c(=O)n(C)c(=O)n2-c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 9843355 | 11230 | 2 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| CHEMBL1178813 | 11230 | 2 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| CHEMBL44169 | 11230 | 2 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| 21912204 | 97705 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 325 | 6 | 2 | 3 | 6.0 | CCC(CC)Nc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| CHEMBL271368 | 97705 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 325 | 6 | 2 | 3 | 6.0 | CCC(CC)Nc1cc(C)nc(Nc2c(C)cc(C)cc2C)c1C | 10.1021/jm070579c | |||
| 58223421 | 82486 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 499 | 10 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2c(C)sc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | nan | |||
| CHEMBL2177105 | 82486 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 499 | 10 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2c(C)sc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | nan | |||
| 58223447 | 127887 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.3 | CCCN(c1c(OCC)nn2c(-c3c(OC)cc(OCC)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664599 | 127887 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 489 | 11 | 0 | 9 | 5.3 | CCCN(c1c(OCC)nn2c(-c3c(OC)cc(OCC)cc3OC)csc12)C1CCOCC1 | nan | |||
| 58223421 | 82486 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 499 | 10 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2c(C)sc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2177105 | 82486 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 499 | 10 | 0 | 8 | 5.5 | COCc1cc(OC)c(-c2c(C)sc3c(N(CC4CCOCC4)CC4CC4)c(C)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 44190056 | 196345 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 363 | 7 | 1 | 5 | 4.7 | CCC(CC)Cn1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL562435 | 196345 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 363 | 7 | 1 | 5 | 4.7 | CCC(CC)Cn1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O | 10.1021/jm900301y | |||
| 9865624 | 15544 | 12 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL121896 | 15544 | 12 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm040058e | |||
| 56663337 | 65313 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 427 | 10 | 0 | 6 | 5.7 | C=C(C)CN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828899 | 65313 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 427 | 10 | 0 | 6 | 5.7 | C=C(C)CN(c1cc(N(CCC)CCC)n2nccc2n1)c1ccc(OC)cc1Cl | 10.1016/j.bmc.2011.08.055 | |||
| 70690301 | 75584 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 11 | 0 | 7 | 6.1 | COCc1cc(OC)c(Oc2nc3cccc(N(CC4CCOCC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2046527 | 75584 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 506 | 11 | 0 | 7 | 6.1 | COCc1cc(OC)c(Oc2nc3cccc(N(CC4CCOCC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| 58223384 | 127880 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 503 | 11 | 0 | 9 | 5.4 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC(C)C)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3664592 | 127880 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 503 | 11 | 0 | 9 | 5.4 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC(C)C)cc3OC)csc12)C1CCOCC1 | nan | |||
| 58896519 | 139384 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 367 | 7 | 1 | 4 | 6.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)sc12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793190 | 139384 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 367 | 7 | 1 | 4 | 6.6 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)sc12 | 10.1021/acs.jmedchem.5b01715 | |||
| 54582017 | 60648 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 352 | 4 | 0 | 5 | 3.7 | CCN(CC)c1nc2c(c(-c3c(C)cc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760252 | 60648 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 352 | 4 | 0 | 5 | 3.7 | CCN(CC)c1nc2c(c(-c3c(C)cc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 70686532 | 76611 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 408 | 8 | 0 | 5 | 5.5 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063372 | 76611 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 408 | 8 | 0 | 5 | 5.5 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 70692469 | 75582 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.9 | CCCN(CCC)c1cccc2nc(Oc3c(C)cc(C)cc3C)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2046525 | 75582 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.9 | CCCN(CCC)c1cccc2nc(Oc3c(C)cc(C)cc3C)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 9843355 | 11230 | 2 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| CHEMBL1178813 | 11230 | 2 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| CHEMBL44169 | 11230 | 2 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| 44444325 | 94326 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 5 | 0 | 4 | 6.6 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC(F)(F)F)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| CHEMBL250603 | 94326 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 417 | 5 | 0 | 4 | 6.6 | CCC(CC)n1cc2c3c(nc(C)cc31)N(c1ccc(OC(F)(F)F)cc1C)CC2 | 10.1016/j.bmcl.2007.06.077 | |||
| 11200917 | 189708 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 418 | 4 | 0 | 6 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(N5CCN(C)C5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| CHEMBL515532 | 189708 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 418 | 4 | 0 | 6 | 3.5 | COc1ccc(N2CCc3c(-n4ccc(N5CCN(C)C5=O)n4)cc(C)nc32)c(C)c1 | 10.1021/jm800744m | |||
| 11383650 | 65302 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1828889 | 65302 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 387 | 8 | 1 | 6 | 5.1 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ccnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 56659948 | 65499 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 388 | 8 | 1 | 7 | 4.5 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| CHEMBL1830517 | 65499 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 388 | 8 | 1 | 7 | 4.5 | CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 | 10.1016/j.bmc.2011.08.055 | |||
| 42618200 | 184165 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 449 | 10 | 0 | 9 | 3.2 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL482983 | 184165 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 449 | 10 | 0 | 9 | 3.2 | COCCN(CCOC)c1nc(C)nc2c(-c3cc(OC)c(OC)cc3Cl)c(C)nn12 | 10.1021/jm9000242 | |||
| 42618233 | 184215 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 354 | 6 | 0 | 7 | 3.4 | CCCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL483350 | 184215 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 354 | 6 | 0 | 7 | 3.4 | CCCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 24768344 | 85542 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 7 | 1 | 5 | 5.1 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| CHEMBL227731 | 85542 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 7 | 1 | 5 | 5.1 | CCCCN(CC)c1cc(C)nc2c1NCCN2c1ccc(C(C)=O)cc1C | 10.1021/jm0611410 | |||
| 44191110 | 195625 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 371 | 5 | 1 | 5 | 4.4 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1F | 10.1021/jm900302q | |||
| CHEMBL556255 | 195625 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 371 | 5 | 1 | 5 | 4.4 | COc1cc(Cl)c(Nc2nc(Cl)cn([C@H](C)C3CC3)c2=O)cc1F | 10.1021/jm900302q | |||
| 46891340 | 6480 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 4.0 | COc1cc(Cl)c(Nc2nc(C)nn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082665 | 6480 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 368 | 5 | 1 | 6 | 4.0 | COc1cc(Cl)c(Nc2nc(C)nn([C@H](C)C3CC3)c2=O)c(Cl)c1 | 10.1016/j.bmcl.2010.04.121 | |||
| 25114821 | 69997 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939592 | 69997 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 390 | 6 | 0 | 6 | 4.2 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/acs.jmedchem.5b01715 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/acs.jmedchem.5b01715 | |||
| 42618227 | 189567 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 400 | 9 | 0 | 9 | 2.2 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL514465 | 189567 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 400 | 9 | 0 | 9 | 2.2 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 44191011 | 196247 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 4.8 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| CHEMBL561757 | 196247 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 459 | 7 | 1 | 6 | 4.8 | COCC(COC)n1cc(Cl)nc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)c1=O | 10.1021/jm900302q | |||
| 57400680 | 69996 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939591 | 69996 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 354 | 5 | 0 | 6 | 3.6 | CCC(CC)c1cc(C)n2nc(-c3cnc(OC)cc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 46891388 | 6485 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCOc1ccc(Nc2nc(C)nn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082670 | 6485 | 0 | None | - | 0 | Rat | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 383 | 6 | 1 | 7 | 3.5 | CCOc1ccc(Nc2nc(C)nn([C@H](C)C3CC3)c2=O)c(C(F)(F)F)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 24964079 | 158964 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 401 | 5 | 0 | 4 | 6.8 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(C#N)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL4096045 | 158964 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 401 | 5 | 0 | 4 | 6.8 | CCC(CC)c1ccc(Cl)c2nc(Oc3c(C)cc(C#N)cc3Cl)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 57402455 | 70001 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 345 | 3 | 0 | 5 | 3.8 | COc1ccc(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(Cl)c1 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939596 | 70001 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 345 | 3 | 0 | 5 | 3.8 | COc1ccc(-c2nn3c(C)cc(C(C)C)c3c(=O)n2C)c(Cl)c1 | 10.1016/j.bmc.2011.11.015 | |||
| 24758076 | 69981 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 4 | 6.1 | CCc1cc(OC)c(OC)cc1-c1nn2c(C)cc(C(CC)CC)c2cc1C | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939576 | 69981 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 4 | 6.1 | CCc1cc(OC)c(OC)cc1-c1nn2c(C)cc(C(CC)CC)c2cc1C | 10.1016/j.bmc.2011.11.015 | |||
| 58223396 | 127895 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.3 | CCCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| CHEMBL3664607 | 127895 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 487 | 11 | 0 | 9 | 4.3 | CCCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12 | nan | |||
| 58223425 | 127897 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 9 | 0 | 8 | 4.7 | CCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12 | nan | |||
| CHEMBL3664609 | 127897 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 9 | 0 | 8 | 4.7 | CCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(C4CC4)cc3OC)csc12 | nan | |||
| 10222402 | 64738 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 396 | 6 | 1 | 6 | 5.3 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCS2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819062 | 64738 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 396 | 6 | 1 | 6 | 5.3 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4C)c(C)nn13)CCS2 | 10.1016/j.bmc.2011.07.055 | |||
| 42618173 | 189589 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 337 | 3 | 0 | 6 | 3.3 | COc1ccc(-c2c(C)nn3c(N4CCCC4)nc(C)nc23)c(C)c1 | 10.1021/jm9000242 | |||
| CHEMBL514649 | 189589 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 337 | 3 | 0 | 6 | 3.3 | COc1ccc(-c2c(C)nn3c(N4CCCC4)nc(C)nc23)c(C)c1 | 10.1021/jm9000242 | |||
| 70684376 | 76619 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063382 | 76619 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 70684376 | 76619 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2063382 | 76619 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCN(CC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(Cl)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 57400683 | 70006 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 353 | 4 | 0 | 6 | 3.3 | CCC(C)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939600 | 70006 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 353 | 4 | 0 | 6 | 3.3 | CCC(C)c1cc(C)n2nc(-c3ccc(N(C)C)nc3C)n(C)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 42618231 | 173475 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 326 | 4 | 0 | 7 | 2.6 | CCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL453001 | 173475 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 326 | 4 | 0 | 7 | 2.6 | CCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 53357409 | 130602 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 505 | 6 | 1 | 4 | 6.5 | COc1ccc(-c2cc(C)n(C[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n2)cc1 | nan | |||
| CHEMBL3681385 | 130602 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 505 | 6 | 1 | 4 | 6.5 | COc1ccc(-c2cc(C)n(C[C@H]3CC[C@H](NC(=O)c4cc(C(F)(F)F)ccc4Cl)CC3)n2)cc1 | nan | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| 22177795 | 64750 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4cc(C)ccc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819074 | 64750 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4cc(C)ccc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 51352161 | 128812 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 505 | 11 | 0 | 9 | 5.7 | CCCCN(c1c(SC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | nan | |||
| CHEMBL3669430 | 128812 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 505 | 11 | 0 | 9 | 5.7 | CCCCN(c1c(SC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | nan | |||
| 71460919 | 82609 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCC4CC4)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179187 | 82609 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 501 | 11 | 0 | 9 | 5.0 | COCc1cc(OC)c(-c2csc3c(N(CCC4CC4)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 25150450 | 175943 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 510 | 3 | 1 | 7 | 5.4 | Cc1cc(-n2ccc(-c3nccs3)n2)c2[nH]c(=O)n(-c3ccc(C(F)(F)F)cc3C(F)(F)F)c2n1 | 10.1021/jm800743q | |||
| CHEMBL458780 | 175943 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 510 | 3 | 1 | 7 | 5.4 | Cc1cc(-n2ccc(-c3nccs3)n2)c2[nH]c(=O)n(-c3ccc(C(F)(F)F)cc3C(F)(F)F)c2n1 | 10.1021/jm800743q | |||
| 58896438 | 139502 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 350 | 7 | 1 | 4 | 5.6 | CCCN(CCC)c1cccc2nc(Nc3ccc(C)cc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793744 | 139502 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 350 | 7 | 1 | 4 | 5.6 | CCCN(CCC)c1cccc2nc(Nc3ccc(C)cc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3794592 | 139502 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 350 | 7 | 1 | 4 | 5.6 | CCCN(CCC)c1cccc2nc(Nc3ccc(C)cc3C)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 56668634 | 64763 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)OCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819088 | 64763 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 400 | 6 | 1 | 6 | 4.9 | CCC(CC)Nc1c2c(nc3c(-c4ccc(OC)cc4Cl)c(C)nn13)OCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 68581422 | 174586 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 503 | 6 | 1 | 6 | 6.8 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3ccc(C#N)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4556873 | 174586 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 503 | 6 | 1 | 6 | 6.8 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3ccc(C#N)cc3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 44589257 | 174814 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 452 | 4 | 0 | 8 | 5.7 | N#Cc1cc(-c2cccs2)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| CHEMBL456241 | 174814 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 452 | 4 | 0 | 8 | 5.7 | N#Cc1cc(-c2cccs2)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 | 10.1021/jm800743q | |||
| 21912341 | 97955 | 1 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(OC(CC)CC)c(C)c(Oc2c(C)cc(C)cc2C)n1 | 10.1021/jm070578k | |||
| CHEMBL272619 | 97955 | 1 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(OC(CC)CC)c(C)c(Oc2c(C)cc(C)cc2C)n1 | 10.1021/jm070578k | |||
| 10160760 | 124070 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 444 | 6 | 0 | 5 | 5.1 | CCc1nc2c(n1COCc1ccccc1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL363240 | 124070 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 444 | 6 | 0 | 5 | 5.1 | CCc1nc2c(n1COCc1ccccc1)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 58223395 | 127865 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 489 | 13 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CCC(C)OC)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664578 | 127865 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 489 | 13 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CCC(C)OC)CC4CC4)c(OC)nn23)c(OC)c1 | nan | |||
| 24768336 | 85528 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 414 | 9 | 1 | 7 | 4.1 | CCCN(CCOC)c1cc(C)nc2c1NCCN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL227503 | 85528 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 414 | 9 | 1 | 7 | 4.1 | CCCN(CCOC)c1cc(C)nc2c1NCCN2c1cc(OC)c(OC)cc1C | 10.1021/jm0611410 | |||
| 44589202 | 175956 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 438 | 3 | 0 | 7 | 5.0 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| CHEMBL458824 | 175956 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 438 | 3 | 0 | 7 | 5.0 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| 21912341 | 97955 | 1 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(OC(CC)CC)c(C)c(Oc2c(C)cc(C)cc2C)n1 | 10.1021/jm070578k | |||
| CHEMBL272619 | 97955 | 1 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1cc(OC(CC)CC)c(C)c(Oc2c(C)cc(C)cc2C)n1 | 10.1021/jm070578k | |||
| 44589303 | 176019 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 375 | 4 | 0 | 7 | 4.1 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)cc1 | 10.1021/jm800743q | |||
| CHEMBL458980 | 176019 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 375 | 4 | 0 | 7 | 4.1 | COc1ccc(N2CCc3c(-n4ccc(-c5nccs5)n4)ccnc32)cc1 | 10.1021/jm800743q | |||
| 10159424 | 122813 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 424 | 5 | 0 | 5 | 4.6 | CCc1nc2c(n1Cc1ccccc1C)C(=O)N(C)CN2c1ccc(OC)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL360532 | 122813 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 424 | 5 | 0 | 5 | 4.6 | CCc1nc2c(n1Cc1ccccc1C)C(=O)N(C)CN2c1ccc(OC)cc1Cl | 10.1021/jm049787k | |||
| 58223376 | 127899 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 513 | 11 | 0 | 9 | 4.7 | COCc1cc(OC)c(-c2csc3c(N(CC4CCC4)CC4C5COCC54)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664610 | 127899 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 513 | 11 | 0 | 9 | 4.7 | COCc1cc(OC)c(-c2csc3c(N(CC4CCC4)CC4C5COCC54)c(OC)nn23)c(OC)c1 | nan | |||
| 70682293 | 76608 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063369 | 76608 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 70692846 | 76612 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 460 | 10 | 0 | 5 | 6.3 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063373 | 76612 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 460 | 10 | 0 | 5 | 6.3 | COCc1cc(OC)c(-c2nc3c(C)ccc(N(CC4CC4)CC4CC4)c3cc2C)c(OC)c1 | 10.1016/j.bmcl.2012.07.047 | |||
| 70682293 | 76608 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2063369 | 76608 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 436 | 10 | 0 | 5 | 6.3 | CCCN(CCC)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 70688432 | 75902 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 375 | 7 | 1 | 3 | 6.8 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049193 | 75902 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 375 | 7 | 1 | 3 | 6.8 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)cc12 | 10.1016/j.bmcl.2012.05.066 | |||
| 67117558 | 139953 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.6 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](CO)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3799741 | 139953 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 364 | 6 | 2 | 7 | 2.6 | COc1nc(C)c(Nc2nc(Cl)cn([C@H](CO)C3CC3)c2=O)cc1C | 10.1016/j.bmcl.2016.03.067 | |||
| 53357410 | 126538 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 360 | 4 | 1 | 4 | 3.8 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| CHEMBL3652116 | 126538 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 360 | 4 | 1 | 4 | 3.8 | Cc1cc(C)n(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 | nan | |||
| 58223512 | 127852 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 507 | 12 | 0 | 9 | 5.0 | CCOCc1cc(OC)c(-c2csc3c(N(CCCF)C4CCOCC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664565 | 127852 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 507 | 12 | 0 | 9 | 5.0 | CCOCc1cc(OC)c(-c2csc3c(N(CCCF)C4CCOCC4)c(OC)nn23)c(OC)c1 | nan | |||
| 90654176 | 127888 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 515 | 12 | 0 | 9 | 5.3 | CCOc1nn2c(-c3c(OC)cc(COC)cc3OC)csc2c1N(CC1CCOCC1)CC1CC1 | nan | |||
| CHEMBL3664600 | 127888 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 515 | 12 | 0 | 9 | 5.3 | CCOc1nn2c(-c3c(OC)cc(COC)cc3OC)csc2c1N(CC1CCOCC1)CC1CC1 | nan | |||
| 58223489 | 128808 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 480 | 9 | 0 | 9 | 4.1 | COc1cc(C#N)cc(OC)c1-c1csc2c(N(CC3CC3)CC3C4COCC43)c(OC)nn12 | nan | |||
| CHEMBL3669427 | 128808 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 480 | 9 | 0 | 9 | 4.1 | COc1cc(C#N)cc(OC)c1-c1csc2c(N(CC3CC3)CC3C4COCC43)c(OC)nn12 | nan | |||
| 70684375 | 76613 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 424 | 9 | 0 | 6 | 4.8 | COCCN(C)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| CHEMBL2063374 | 76613 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 424 | 9 | 0 | 6 | 4.8 | COCCN(C)c1ccc(C)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12 | 10.1016/j.bmcl.2012.07.047 | |||
| 145967853 | 165004 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 3 | 1 | 5 | 5.8 | CCN(O)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL4225843 | 165004 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 410 | 3 | 1 | 5 | 5.8 | CCN(O)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl | 10.1016/j.bmc.2018.01.020 | |||
| 44589318 | 177685 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 494 | 3 | 1 | 6 | 4.8 | Cc1cc(-n2ccc(-n3cc[nH]c3=O)n2)c2c(n1)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1021/jm800744m | |||
| CHEMBL464185 | 177685 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 494 | 3 | 1 | 6 | 4.8 | Cc1cc(-n2ccc(-n3cc[nH]c3=O)n2)c2c(n1)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2 | 10.1021/jm800744m | |||
| 145955820 | 162674 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 355 | 4 | 1 | 6 | 4.0 | CCN(CC)c1nc(C)nc2c1sc(=N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | |||
| CHEMBL4170184 | 162674 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 355 | 4 | 1 | 6 | 4.0 | CCN(CC)c1nc(C)nc2c1sc(=N)n2-c1c(C)cc(C)cc1C | 10.1016/j.ejmech.2017.07.016 | |||
| 10272004 | 166244 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 394 | 6 | 0 | 4 | 5.5 | CCCC(CCC)n1cnc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL426791 | 166244 | 0 | None | - | 0 | Rat | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 394 | 6 | 0 | 4 | 5.5 | CCCC(CCC)n1cnc2c1C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 10111139 | 64752 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4c(C)cc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819076 | 64752 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 392 | 6 | 1 | 5 | 5.4 | CCC(CC)Nc1c2c(nc3c(-c4c(C)cc(OC)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 9819381 | 97698 | 3 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1c(OC(CC)CC)cc(C)nc1Oc1c(C)cc(C)cc1C | 10.1021/jm070578k | |||
| CHEMBL271324 | 97698 | 3 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1c(OC(CC)CC)cc(C)nc1Oc1c(C)cc(C)cc1C | 10.1021/jm070578k | |||
| 9819381 | 97698 | 3 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1c(OC(CC)CC)cc(C)nc1Oc1c(C)cc(C)cc1C | 10.1021/jm070578k | |||
| CHEMBL271324 | 97698 | 3 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 341 | 7 | 0 | 3 | 6.2 | CCc1c(OC(CC)CC)cc(C)nc1Oc1c(C)cc(C)cc1C | 10.1021/jm070578k | |||
| 58280029 | 139756 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 528 | 9 | 2 | 10 | 4.6 | COc1ccc(NC(=O)OC[C@H](C2CC2)n2cc(Cl)nc(Nc3cc(C)c(OC)nc3C)c2=O)c(C)n1 | 10.1016/j.bmcl.2016.03.067 | |||
| CHEMBL3798497 | 139756 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 528 | 9 | 2 | 10 | 4.6 | COc1ccc(NC(=O)OC[C@H](C2CC2)n2cc(Cl)nc(Nc3cc(C)c(OC)nc3C)c2=O)c(C)n1 | 10.1016/j.bmcl.2016.03.067 | |||
| 46891158 | 6494 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 337 | 5 | 1 | 6 | 3.5 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(C#N)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082706 | 6494 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 337 | 5 | 1 | 6 | 3.5 | CCC(C1CC1)n1nc(C)nc(Nc2cc(C)c(C#N)cc2C)c1=O | 10.1016/j.bmcl.2010.04.121 | |||
| 44190243 | 196103 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 351 | 5 | 1 | 4 | 5.0 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cccc2Cl)c1=O | 10.1021/jm900301y | |||
| CHEMBL560896 | 196103 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 351 | 5 | 1 | 4 | 5.0 | CC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)cccc2Cl)c1=O | 10.1021/jm900301y | |||
| 70909805 | 139314 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 434 | 8 | 1 | 5 | 6.6 | CCCN(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3792517 | 139314 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 434 | 8 | 1 | 5 | 6.6 | CCCN(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 70909805 | 139314 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 434 | 8 | 1 | 5 | 6.6 | CCCN(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| CHEMBL3792517 | 139314 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 434 | 8 | 1 | 5 | 6.6 | CCCN(CCC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2016.11.011 | |||
| 127030314 | 139389 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 406 | 6 | 1 | 5 | 5.8 | CCN(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2018.01.020 | |||
| CHEMBL3793277 | 139389 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 406 | 6 | 1 | 5 | 5.8 | CCN(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12 | 10.1016/j.bmc.2018.01.020 | |||
| 57392001 | 69987 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 367 | 6 | 0 | 5 | 4.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| CHEMBL1939582 | 69987 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 367 | 6 | 0 | 5 | 4.7 | CCC(CC)c1cc(C)n2nc(-c3ccc(OC)cc3C)n(CC)c(=O)c12 | 10.1016/j.bmc.2011.11.015 | |||
| 42618174 | 193334 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 385 | 8 | 1 | 8 | 2.8 | COCC(COC)Nc1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| CHEMBL524616 | 193334 | 0 | None | - | 1 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 385 | 8 | 1 | 8 | 2.8 | COCC(COC)Nc1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm9000242 | |||
| 24768324 | 97660 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1Br | 10.1021/jm070578k | |||
| CHEMBL271125 | 97660 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1Br | 10.1021/jm070578k | |||
| 9820041 | 158232 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 355 | 8 | 0 | 3 | 6.6 | CCCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL408824 | 158232 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 355 | 8 | 0 | 3 | 6.6 | CCCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 24768324 | 97660 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1Br | 10.1021/jm070578k | |||
| CHEMBL271125 | 97660 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 391 | 6 | 0 | 3 | 6.4 | CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1Br | 10.1021/jm070578k | |||
| 9820041 | 158232 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 355 | 8 | 0 | 3 | 6.6 | CCCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| CHEMBL408824 | 158232 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 355 | 8 | 0 | 3 | 6.6 | CCCc1cc(C)c(Oc2nc(C)cc(OC(CC)CC)c2C)c(C)c1 | 10.1021/jm070578k | |||
| 24768334 | 144578 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 386 | 8 | 1 | 8 | 3.4 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| CHEMBL390763 | 144578 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 386 | 8 | 1 | 8 | 3.4 | CCCCN(CC)c1nc(C)nc2c1NCCN2c1ccc(OC)nc1OC | 10.1021/jm0611410 | |||
| 46891089 | 6820 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.6 | Cc1nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1083946 | 6820 | 0 | None | - | 0 | Rat | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 404 | 6 | 1 | 6 | 4.6 | Cc1nc(Nc2c(Cl)cc(OC(F)F)cc2Cl)c(=O)n(C(C)C2CC2)n1 | 10.1016/j.bmcl.2010.04.121 | |||
| 70690481 | 75905 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 429 | 6 | 1 | 4 | 6.6 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| CHEMBL2049196 | 75905 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 429 | 6 | 1 | 4 | 6.6 | Cc1cc(C)c(Nc2nc3cccc(N(CC4CC4)C4CCOCC4)c3cc2C)c(C)c1 | 10.1016/j.bmcl.2012.05.066 | |||
| 58801667 | 77564 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 481 | 11 | 0 | 7 | 5.4 | CCCN(CC1CCOCC1)c1c(CC)nn2c(-c3c(OC)cc(COC)cc3OC)cccc12 | 10.1021/jm300259r | |||
| CHEMBL2087572 | 77564 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 481 | 11 | 0 | 7 | 5.4 | CCCN(CC1CCOCC1)c1c(CC)nn2c(-c3c(OC)cc(COC)cc3OC)cccc12 | 10.1021/jm300259r | |||
| 46881866 | 8012 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 395 | 8 | 1 | 9 | 2.4 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)nc(OC)nc2OC)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| CHEMBL1090740 | 8012 | 0 | None | - | 0 | Rat | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 395 | 8 | 1 | 9 | 2.4 | COC[C@H](C1CC1)n1cc(Cl)nc(Nc2c(C)nc(OC)nc2OC)c1=O | 10.1016/j.bmcl.2010.01.129 | |||
| 58896512 | 172977 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 556 | 7 | 1 | 7 | 6.3 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(S(C)(=O)=O)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| CHEMBL4517763 | 172977 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 556 | 7 | 1 | 7 | 6.3 | COc1cc(Br)cc(C)c1Nc1nc2cccc(N(c3cccc(S(C)(=O)=O)c3)C(C)C)c2n1C | 10.1016/j.bmc.2016.08.005 | |||
| 10205141 | 63465 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 464 | 4 | 0 | 4 | 6.1 | CCc1nc2c(n1Cc1cccc3ccccc13)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| CHEMBL179826 | 63465 | 0 | None | - | 0 | Rat | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 464 | 4 | 0 | 4 | 6.1 | CCc1nc2c(n1Cc1cccc3ccccc13)C(=O)N(C)CN2c1ccc(Cl)cc1Cl | 10.1021/jm049787k | |||
| 71453736 | 82612 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 489 | 10 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CC(C)C)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| CHEMBL2179190 | 82612 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 489 | 10 | 0 | 9 | 4.9 | COCc1cc(OC)c(-c2csc3c(N(CC(C)C)C4CCOCC4)c(OC)nn23)c(OC)c1 | 10.1021/jm300864p | |||
| 42618215 | 184094 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 413 | 9 | 0 | 9 | 2.3 | COCCN(CCOC)c1nc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| CHEMBL482544 | 184094 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 413 | 9 | 0 | 9 | 2.3 | COCCN(CCOC)c1nc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm900025h | |||
| 44190338 | 196123 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 453 | 9 | 1 | 6 | 5.4 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OCc3ccccc3)cc2C)c1=O | 10.1021/jm900301y | |||
| CHEMBL561034 | 196123 | 0 | None | - | 0 | Rat | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 453 | 9 | 1 | 6 | 5.4 | COC[C@@H](C1CC1)n1cc(Cl)nc(Nc2cc(C)c(OCc3ccccc3)cc2C)c1=O | 10.1021/jm900301y | |||
| 51352160 | 127835 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 503 | 11 | 0 | 10 | 4.1 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4COCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664548 | 127835 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 503 | 11 | 0 | 10 | 4.1 | COCc1cc(OC)c(-c2csc3c(N(CC4CC4)CC4COCOC4)c(OC)nn23)c(OC)c1 | nan | |||
| 10377 | 1179 | 27 | None | -1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2011.02.086 | |||
| 9818802 | 1179 | 27 | None | -1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL270738 | 1179 | 27 | None | -1 | 2 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2011.02.086 | |||
| 11280845 | 126836 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 393 | 7 | 1 | 6 | 3.9 | CCN(CCCC#N)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm049737f | |||
| CHEMBL365511 | 126836 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 393 | 7 | 1 | 6 | 3.9 | CCN(CCCC#N)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm049737f | |||
| 58223470 | 127830 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 563 | 12 | 0 | 10 | 6.3 | COCc1cc(OC)c(-c2c(SC)sc3c(N(CC4CCOCC4)CC4CC4)c(SC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664543 | 127830 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 563 | 12 | 0 | 10 | 6.3 | COCc1cc(OC)c(-c2c(SC)sc3c(N(CC4CCOCC4)CC4CC4)c(SC)nn23)c(OC)c1 | nan | |||
| 23567868 | 64748 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 366 | 5 | 1 | 4 | 5.2 | CCC(CC)Nc1c2c(nc3c(-c4ccc(F)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819072 | 64748 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 366 | 5 | 1 | 4 | 5.2 | CCC(CC)Nc1c2c(nc3c(-c4ccc(F)cc4C)c(C)nn13)CCC2 | 10.1016/j.bmc.2011.07.055 | |||
| 44589348 | 176026 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 432 | 3 | 0 | 6 | 4.9 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5ccccn5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| CHEMBL459006 | 176026 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 432 | 3 | 0 | 6 | 4.9 | N#Cc1ccc(N2CCc3c(-n4ccc(-c5ccccn5)n4)ccnc32)c(C(F)(F)F)c1 | 10.1021/jm800743q | |||
| 46891190 | 6426 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 339 | 5 | 1 | 7 | 2.9 | COc1cc(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C)cc1C#N | 10.1016/j.bmcl.2010.04.121 | |||
| CHEMBL1082401 | 6426 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 339 | 5 | 1 | 7 | 2.9 | COc1cc(Nc2nc(C)nn(C(C)C3CC3)c2=O)c(C)cc1C#N | 10.1016/j.bmcl.2010.04.121 | |||
| 67363460 | 130590 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 7 | 3 | 3 | 5.4 | O=C(O)Cc1ccc(NC[C@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1 | nan | |||
| CHEMBL3681373 | 130590 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 468 | 7 | 3 | 3 | 5.4 | O=C(O)Cc1ccc(NC[C@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)cc1 | nan | |||
| 58223507 | 127853 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 537 | 11 | 0 | 9 | 5.1 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOC4)CC4CC(F)(F)C4)c(OC)nn23)c(OC)c1 | nan | |||
| CHEMBL3664566 | 127853 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 537 | 11 | 0 | 9 | 5.1 | COCc1cc(OC)c(-c2csc3c(N(CC4CCOC4)CC4CC(F)(F)C4)c(OC)nn23)c(OC)c1 | nan | |||
| 24768330 | 85576 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 383 | 7 | 1 | 6 | 3.8 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| CHEMBL228110 | 85576 | 0 | None | - | 0 | Rat | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 383 | 7 | 1 | 6 | 3.8 | CCCCN(CC)c1nc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1021/jm0611410 | |||
| 53357797 | 130610 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 449 | 5 | 2 | 4 | 4.7 | O=C(N[C@H]1CC[C@H](Cn2cc(Cl)c(CO)n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | |||
| CHEMBL3681393 | 130610 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 449 | 5 | 2 | 4 | 4.7 | O=C(N[C@H]1CC[C@H](Cn2cc(Cl)c(CO)n2)CC1)c1cc(C(F)(F)F)ccc1Cl | nan | |||
| 58896424 | 139414 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 392 | 8 | 1 | 4 | 6.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)n(C(C)C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793781 | 139414 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 392 | 8 | 1 | 4 | 6.9 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)n(C(C)C)c12 | 10.1021/acs.jmedchem.5b01715 | |||
| 22178115 | 64743 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 392 | 7 | 1 | 5 | 5.4 | CCc1nn2c(NC(CC)CC)c3c(nc2c1-c1ccc(OC)cc1C)CCC3 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL1819067 | 64743 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 392 | 7 | 1 | 5 | 5.4 | CCc1nn2c(NC(CC)CC)c3c(nc2c1-c1ccc(OC)cc1C)CCC3 | 10.1016/j.bmc.2011.07.055 | |||
| 54580961 | 60650 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 408 | 8 | 0 | 5 | 5.3 | CCCCN(CCCC)c1nc2c(c(-c3c(C)cc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| CHEMBL1760254 | 60650 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 408 | 8 | 0 | 5 | 5.3 | CCCCN(CCCC)c1nc2c(c(-c3c(C)cc(C)cc3C)cn2C)c(=O)n1C | 10.1016/j.bmcl.2011.02.086 | |||
| 60155889 | 77575 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 527 | 11 | 1 | 9 | 4.6 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4(O)CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| CHEMBL2087797 | 77575 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 527 | 11 | 1 | 9 | 4.6 | COCc1cc(OC)c(-c2cccc3c(N(CC4CCOCC4)CC4(O)CC4)c(SC)nn23)c(OC)c1 | 10.1021/jm300259r | |||
| 57912441 | 82608 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 475 | 10 | 0 | 9 | 4.6 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| CHEMBL2179186 | 82608 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 475 | 10 | 0 | 9 | 4.6 | CCCN(c1c(OC)nn2c(-c3c(OC)cc(COC)cc3OC)csc12)C1CCOCC1 | 10.1021/jm300864p | |||
| 58223406 | 128809 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 468 | 9 | 0 | 9 | 4.1 | CCCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12 | nan | |||
| CHEMBL3669428 | 128809 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 468 | 9 | 0 | 9 | 4.1 | CCCN(CC1C2COCC21)c1c(OC)nn2c(-c3c(OC)cc(C#N)cc3OC)csc12 | nan | |||
| 71456848 | 81510 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 394 | 7 | 0 | 5 | 5.4 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| CHEMBL2160159 | 81510 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 394 | 7 | 0 | 5 | 5.4 | CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(C)cc3OC)c(C)cc12 | 10.1016/j.bmc.2012.09.028 | |||
| 58896475 | 139366 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 351 | 7 | 1 | 4 | 6.1 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)oc12 | 10.1021/acs.jmedchem.5b01715 | |||
| CHEMBL3793059 | 139366 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 351 | 7 | 1 | 4 | 6.1 | CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)oc12 | 10.1021/acs.jmedchem.5b01715 | |||
| 9884878 | 173025 | 18 | None | - | 1 | Human | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL45187 | 173025 | 18 | None | - | 1 | Human | 9.6 | pKd | = | 9.6 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2011.08.040 | |||
| 54591779 | 66030 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 429 | 8 | 1 | 7 | 4.6 | COc1cc(OC(F)F)ccc1-n1c(C)nc2c(NC(C3CC3)C3CC3)nc(C)nc21 | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL1836947 | 66030 | 0 | None | - | 1 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 429 | 8 | 1 | 7 | 4.6 | COc1cc(OC(F)F)ccc1-n1c(C)nc2c(NC(C3CC3)C3CC3)nc(C)nc21 | 10.1016/j.bmcl.2011.08.040 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2011.08.040 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 9.5 | pKd | = | 9.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2011.08.040 | |||
| 44545165 | 66028 | 0 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 433 | 7 | 1 | 6 | 5.3 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3Cl)c2n1 | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL1836945 | 66028 | 0 | None | - | 1 | Human | 9.4 | pKd | = | 9.4 | Binding | ChEMBL | 433 | 7 | 1 | 6 | 5.3 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3Cl)c2n1 | 10.1016/j.bmcl.2011.08.040 | |||
| 54591854 | 66015 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL1836932 | 66015 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 363 | 6 | 1 | 6 | 4.0 | COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)cc1 | 10.1016/j.bmcl.2011.08.040 | |||
| 45485040 | 197284 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 383 | 8 | 0 | 7 | 3.6 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL568606 | 197284 | 0 | None | - | 1 | Human | 7.9 | pKd | = | 7.9 | Binding | ChEMBL | 383 | 8 | 0 | 7 | 3.6 | CCCN(CCOC)c1nc(C)nc2c1c(C)nn2-c1ccc(OC)cc1C | 10.1016/j.bmcl.2011.08.040 | |||
| 44545161 | 66027 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 399 | 7 | 1 | 6 | 4.6 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL1836944 | 66027 | 0 | None | - | 1 | Human | 8.5 | pKd | = | 8.5 | Binding | ChEMBL | 399 | 7 | 1 | 6 | 4.6 | Cc1nc(NC(C2CC2)C2CC2)c2nc(C)n(-c3ccc(OC(F)F)cc3)c2n1 | 10.1016/j.bmcl.2011.08.040 | |||
| CHEMBL4299295 | 213562 | 0 | None | 1 | 2 | Human | 9.8 | pKi | = | 9.8 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 127033542 | 138622 | 0 | None | 2 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 3960 | 128 | 56 | 50 | -10.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775796 | 138622 | 0 | None | 2 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 3960 | 128 | 56 | 50 | -10.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 127032315 | 138428 | 0 | None | 1 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 3880 | 126 | 55 | 49 | -10.4 | CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774395 | 138428 | 0 | None | 1 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 3880 | 126 | 55 | 49 | -10.4 | CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL4299341 | 213570 | 0 | None | -1 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C(N)=O)[C@H](C)CC)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||||
| 11546255 | 188117 | 0 | None | 12022 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 419 | 5 | 0 | 7 | 4.9 | CCC(CC)c1cc(C)nn2c(-c3sc(N4CCOCC4)nc3Cl)c(C)nc12 | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL498311 | 188117 | 0 | None | 12022 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 419 | 5 | 0 | 7 | 4.9 | CCC(CC)c1cc(C)nn2c(-c3sc(N4CCOCC4)nc3Cl)c(C)nc12 | 10.1016/j.bmcl.2008.07.063 | |||
| 127031741 | 138496 | 0 | None | 1 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 4028 | 129 | 57 | 50 | -9.6 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774868 | 138496 | 0 | None | 1 | 2 | Human | 9.7 | pKi | = | 9.7 | Binding | ChEMBL | 4028 | 129 | 57 | 50 | -9.6 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 127033842 | 138517 | 0 | None | 8 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 4000 | 127 | 56 | 51 | -10.2 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2cccs2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775030 | 138517 | 0 | None | 8 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 4000 | 127 | 56 | 51 | -10.2 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2cccs2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| 127032010 | 138471 | 0 | None | 9 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 4000 | 127 | 56 | 51 | -10.2 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2ccsc2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774682 | 138471 | 0 | None | 9 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 4000 | 127 | 56 | 51 | -10.2 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2ccsc2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| 127032315 | 138428 | 0 | None | 1 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 3880 | 126 | 55 | 49 | -10.4 | CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774395 | 138428 | 0 | None | 1 | 2 | Human | 9.6 | pKi | = | 9.6 | Binding | ChEMBL | 3880 | 126 | 55 | 49 | -10.4 | CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL4299349 | 213572 | 0 | None | 1 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)N[C@@](C)(CC(C)C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| CHEMBL4299348 | 213571 | 0 | None | 1 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(CC(C)C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 127033542 | 138622 | 0 | None | 2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 3960 | 128 | 56 | 50 | -10.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775796 | 138622 | 0 | None | 2 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 3960 | 128 | 56 | 50 | -10.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 127031439 | 138599 | 0 | None | 5 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 3994 | 127 | 56 | 50 | -10.3 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775621 | 138599 | 0 | None | 5 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | 3994 | 127 | 56 | 50 | -10.3 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL4299340 | 213569 | 0 | None | -1 | 2 | Human | 9.5 | pKi | = | 9.5 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(CCCC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N1)C(=O)N[C@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C(N)=O)[C@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 10111093 | 118751 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL341820 | 118751 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 127031736 | 138606 | 0 | None | 1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 3876 | 124 | 56 | 50 | -12.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775678 | 138606 | 0 | None | 1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 3876 | 124 | 56 | 50 | -12.4 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 127032314 | 138620 | 0 | None | -1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 3902 | 125 | 55 | 49 | -10.2 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](C)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775778 | 138620 | 0 | None | -1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | 3902 | 125 | 55 | 49 | -10.2 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](C)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL4299352 | 213573 | 0 | None | 2 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| CHEMBL4299286 | 213559 | 0 | None | 2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(Cc1ccccc1)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| CHEMBL4299295 | 213562 | 0 | None | 1 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 127031441 | 138576 | 0 | None | 1 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 3900 | 124 | 55 | 49 | -10.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775437 | 138576 | 0 | None | 1 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 3900 | 124 | 55 | 49 | -10.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 127033544 | 138625 | 0 | None | 2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 4044 | 127 | 56 | 50 | -9.1 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2ccc3ccccc3c2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775812 | 138625 | 0 | None | 2 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 4044 | 127 | 56 | 50 | -9.1 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2ccc3ccccc3c2)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| 9908879 | 10080 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 398 | 6 | 0 | 2 | 7.1 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115389 | 10080 | 0 | None | - | 1 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 398 | 6 | 0 | 2 | 7.1 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 127031132 | 138463 | 0 | None | 7 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 4044 | 127 | 56 | 50 | -9.1 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2cccc3ccccc23)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774594 | 138463 | 0 | None | 7 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 4044 | 127 | 56 | 50 | -9.1 | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(Cc2cccc3ccccc23)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||
| 127031129 | 138617 | 0 | None | -1 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 3936 | 130 | 55 | 49 | -8.8 | CCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775761 | 138617 | 0 | None | -1 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | 3936 | 130 | 55 | 49 | -8.8 | CCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL4299308 | 213564 | 0 | None | 1 | 2 | Human | 9.3 | pKi | = | 9.3 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(CCCC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1)C(=O)N[C@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C(N)=O)[C@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 127029856 | 138540 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3866 | 125 | 55 | 49 | -10.8 | CCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775192 | 138540 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3866 | 125 | 55 | 49 | -10.8 | CCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| 10715520 | 119336 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL344223 | 119336 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 127030817 | 138507 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3824 | 122 | 55 | 49 | -12.0 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774939 | 138507 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3824 | 122 | 55 | 49 | -12.0 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 9909978 | 10038 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL115142 | 10038 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 9909978 | 10038 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL115142 | 10038 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 127031129 | 138617 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3936 | 130 | 55 | 49 | -8.8 | CCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775761 | 138617 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3936 | 130 | 55 | 49 | -8.8 | CCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| 127033847 | 138490 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3880 | 124 | 55 | 49 | -10.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C(=O)N[C@H](C(N)=O)[C@@H](C)CC)C(C)C | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774836 | 138490 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3880 | 124 | 55 | 49 | -10.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C(=O)N[C@H](C(N)=O)[C@@H](C)CC)C(C)C | 10.1021/acs.jmedchem.5b00926 | |||
| 127029856 | 138540 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3866 | 125 | 55 | 49 | -10.8 | CCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775192 | 138540 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3866 | 125 | 55 | 49 | -10.8 | CCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| 127031738 | 138446 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3903 | 125 | 55 | 49 | -9.6 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774485 | 138446 | 0 | None | 1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3903 | 125 | 55 | 49 | -9.6 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 127031126 | 138478 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3838 | 123 | 55 | 49 | -11.6 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774742 | 138478 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 3838 | 123 | 55 | 49 | -11.6 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL4299297 | 213563 | 0 | None | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C(=O)N[C@H](C(N)=O)[C@@H](C)CC)C(C)C | 10.1021/acs.jmedchem.5b00926 | |||||
| 10294626 | 32134 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 403 | 6 | 0 | 5 | 5.3 | CCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL140894 | 32134 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 403 | 6 | 0 | 5 | 5.3 | CCCN(CC1CC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 44347388 | 114551 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 434 | 7 | 0 | 5 | 6.4 | CCCN(CC1CC1)c1cc(SC)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL333735 | 114551 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 434 | 7 | 0 | 5 | 6.4 | CCCN(CC1CC1)c1cc(SC)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 127033848 | 138443 | 0 | None | -2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 3852 | 124 | 55 | 49 | -11.2 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CCC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774465 | 138443 | 0 | None | -2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 3852 | 124 | 55 | 49 | -11.2 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CCC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL4299286 | 213559 | 0 | None | 2 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(Cc1ccccc1)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| CHEMBL4299340 | 213569 | 0 | None | -1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(CCCC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N1)C(=O)N[C@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C(N)=O)[C@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 44392711 | 123546 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 437 | 6 | 0 | 5 | 5.7 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL361782 | 123546 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 437 | 6 | 0 | 5 | 5.7 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10552787 | 120735 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 480 | 7 | 1 | 6 | 5.4 | CCCC(CCC)Nc1nc(C)nc2c1nnn2-c1ccc(Br)cc1Br | 10.1021/jm980224g | |||
| CHEMBL354886 | 120735 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 480 | 7 | 1 | 6 | 5.4 | CCCC(CCC)Nc1nc(C)nc2c1nnn2-c1ccc(Br)cc1Br | 10.1021/jm980224g | |||
| CHEMBL439883 | 213849 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1016/j.bmcl.2015.10.010 | |||||
| CHEMBL439883 | 213849 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O | 10.1016/j.bmcl.2015.10.010 | |||||
| 127033261 | 138474 | 0 | None | 1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 3992 | 134 | 55 | 49 | -7.3 | CCCCCCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774713 | 138474 | 0 | None | 1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 3992 | 134 | 55 | 49 | -7.3 | CCCCCCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| 177990 | 426 | 23 | None | -1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm980224g | |||
| 3489 | 426 | 23 | None | -1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm980224g | |||
| CHEMBL296641 | 426 | 23 | None | -1 | 2 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm980224g | |||
| 10694584 | 58732 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 443 | 7 | 0 | 5 | 5.9 | CCCCN(CC)c1nc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168554 | 58732 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 443 | 7 | 0 | 5 | 5.9 | CCCCN(CC)c1nc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10388138 | 9999 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.0 | CCCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL114912 | 9999 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.0 | CCCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 9821586 | 168103 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL432800 | 168103 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 9821586 | 168103 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL432800 | 168103 | 0 | None | - | 1 | Human | 9.1 | pKi | = | 9.1 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 10251024 | 168416 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 410 | 8 | 0 | 4 | 6.2 | CCCN(CCCCF)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL434882 | 168416 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 410 | 8 | 0 | 4 | 6.2 | CCCN(CCCCF)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL4299335 | 213568 | 0 | None | -1 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(Cc1ccccc1)C(=O)N[C@@H](C(N)=O)[C@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 177990 | 426 | 23 | None | 1 | 2 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm034077k | |||
| 3489 | 426 | 23 | None | 1 | 2 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm034077k | |||
| CHEMBL296641 | 426 | 23 | None | 1 | 2 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm034077k | |||
| 44341921 | 10294 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 444 | 9 | 0 | 4 | 7.0 | CCCCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL116171 | 10294 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 444 | 9 | 0 | 4 | 7.0 | CCCCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 9998661 | 57948 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | 360 | 3 | 0 | 4 | 4.4 | COc1cc(Br)c(-n2ccc3c(C)cc(C)nc32)c(OC)c1 | 10.1021/jm980223o | |||
| CHEMBL167241 | 57948 | 0 | None | - | 1 | Rat | 9.0 | pKi | = | 9 | Binding | ChEMBL | 360 | 3 | 0 | 4 | 4.4 | COc1cc(Br)c(-n2ccc3c(C)cc(C)nc32)c(OC)c1 | 10.1021/jm980223o | |||
| 9884878 | 173025 | 18 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm990590f | |||
| CHEMBL45187 | 173025 | 18 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1021/jm990590f | |||
| 9884878 | 173025 | 18 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.ejmech.2016.11.019 | |||
| CHEMBL45187 | 173025 | 18 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.ejmech.2016.11.019 | |||
| 10428930 | 203687 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 365 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)nn(C)c12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL67484 | 203687 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 365 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)nn(C)c12 | 10.1016/s0960-894x(02)00358-x | |||
| 9822241 | 64009 | 8 | None | 9 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 399 | 8 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | |||
| CHEMBL1807053 | 64009 | 8 | None | 9 | 2 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 399 | 8 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | |||
| 9884878 | 173025 | 18 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL45187 | 173025 | 18 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 352 | 6 | 1 | 5 | 4.9 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmc.2011.07.055 | |||
| CHEMBL2373995 | 210382 | 0 | None | 1 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)N[C@@H](CC(=O)O)C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(N)=O)C(C)C | 10.1021/jm990590f | |||||
| CHEMBL4299314 | 213566 | 0 | None | -1 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C(N)=O)[C@H](C)CC)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||||
| 9913240 | 67947 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 484 | 7 | 0 | 5 | 6.2 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(C(C)C)cc3Br)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL191090 | 67947 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 484 | 7 | 0 | 5 | 6.2 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(C(C)C)cc3Br)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44392663 | 65521 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 453 | 8 | 0 | 5 | 6.5 | CCCCN(CCCC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL183068 | 65521 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 453 | 8 | 0 | 5 | 6.5 | CCCCN(CCCC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44290322 | 101170 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL295563 | 101170 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 23595022 | 64014 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 363 | 8 | 1 | 5 | 5.0 | CCc1nc(-c2ccc(OC)cc2Cl)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807058 | 64014 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 363 | 8 | 1 | 5 | 5.0 | CCc1nc(-c2ccc(OC)cc2Cl)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 10667354 | 116600 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 377 | 5 | 1 | 5 | 5.3 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL336678 | 116600 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | 377 | 5 | 1 | 5 | 5.3 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL4299294 | 213561 | 0 | None | -3 | 2 | Human | 9.0 | pKi | = | 9.0 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H]1CCC(=O)NCCCC[C@H](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](CC(C)C)C(=O)NC(CC2CCCCC2)C(=O)N[C@H](CC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@@H](C(N)=O)[C@H](C)CC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](C)NC1=O | 10.1021/acs.jmedchem.5b00926 | |||||
| CHEMBL4299355 | 213574 | 0 | None | -1 | 2 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)N(C)[C@@H](C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 44392722 | 64566 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 439 | 7 | 0 | 5 | 6.1 | CCCCN(CCC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL181536 | 64566 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 439 | 7 | 0 | 5 | 6.1 | CCCCN(CCC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44392695 | 123872 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 425 | 6 | 0 | 5 | 5.7 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL362697 | 123872 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 425 | 6 | 0 | 5 | 5.7 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44341892 | 110320 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL323886 | 110320 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 10668220 | 31278 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 391 | 6 | 1 | 5 | 5.7 | CCCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL140143 | 31278 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 391 | 6 | 1 | 5 | 5.7 | CCCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 10832574 | 116789 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 363 | 4 | 0 | 5 | 4.6 | CCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL337768 | 116789 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 363 | 4 | 0 | 5 | 4.6 | CCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 44347200 | 161741 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)c(OC)c3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL413756 | 161741 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)c(OC)c3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 11774042 | 203352 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL65078 | 203352 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 44341936 | 9616 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 6.3 | CCCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112626 | 9616 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 6.3 | CCCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 44341723 | 168133 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 416 | 7 | 0 | 4 | 6.3 | CCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL432976 | 168133 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 416 | 7 | 0 | 4 | 6.3 | CCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 18629227 | 101487 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 389 | 4 | 0 | 5 | 5.5 | CCC(CC)n1nnc2c(N3CCc4cc(Cl)cc(Cl)c43)nc(C)cc21 | 10.1021/jm990590f | |||
| CHEMBL297868 | 101487 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 389 | 4 | 0 | 5 | 5.5 | CCC(CC)n1nnc2c(N3CCc4cc(Cl)cc(Cl)c43)nc(C)cc21 | 10.1021/jm990590f | |||
| 90231873 | 123950 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 494 | 6 | 1 | 4 | 5.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628728 | 123950 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 494 | 6 | 1 | 4 | 5.6 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 23595046 | 64010 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 383 | 7 | 1 | 5 | 5.1 | CCC(CC)Nc1nc(C)c(-c2ccc(C(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | |||
| CHEMBL1807054 | 64010 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 383 | 7 | 1 | 5 | 5.1 | CCC(CC)Nc1nc(C)c(-c2ccc(C(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | |||
| 11236249 | 126199 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 448 | 6 | 0 | 6 | 5.5 | CCN(Cc1ccc(Cl)cc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL364987 | 126199 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 448 | 6 | 0 | 6 | 5.5 | CCN(Cc1ccc(Cl)cc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10648981 | 120742 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 497 | 7 | 0 | 5 | 6.7 | CCCCN(CC)c1nc(C)nc2c1nc(C(F)(F)F)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL354982 | 120742 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 497 | 7 | 0 | 5 | 6.7 | CCCCN(CC)c1nc(C)nc2c1nc(C(F)(F)F)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341845 | 9498 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 436 | 8 | 0 | 5 | 6.2 | CCCCN(CCSC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112057 | 9498 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 436 | 8 | 0 | 5 | 6.2 | CCCCN(CCSC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 22248935 | 64008 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 399 | 9 | 1 | 5 | 5.6 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(OC(F)F)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807052 | 64008 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 399 | 9 | 1 | 5 | 5.6 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(OC(F)F)cc1Cl | 10.1021/jm200365y | |||
| 10479355 | 129479 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 459 | 8 | 0 | 6 | 5.6 | CCCCN(CC)c1nc(C)nc2c1nc(OC)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL367253 | 129479 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 459 | 8 | 0 | 6 | 5.6 | CCCCN(CC)c1nc(C)nc2c1nc(OC)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 44386320 | 131344 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 463 | 7 | 0 | 5 | 6.3 | CCCCN(CC)c1nc(C)nc2c1nc(Cl)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL368772 | 131344 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 463 | 7 | 0 | 5 | 6.3 | CCCCN(CC)c1nc(C)nc2c1nc(Cl)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10813254 | 120761 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 445 | 8 | 0 | 6 | 5.8 | CCCCC(CC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL355214 | 120761 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 445 | 8 | 0 | 6 | 5.8 | CCCCC(CC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341735 | 110921 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 430 | 8 | 0 | 4 | 6.7 | CCCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL326156 | 110921 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 430 | 8 | 0 | 4 | 6.7 | CCCCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 15486940 | 159801 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 356 | 5 | 1 | 4 | 5.6 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(C)cc3Cl)c(C)nn12 | 10.1016/j.ejmech.2016.11.019 | |||
| CHEMBL4105538 | 159801 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 356 | 5 | 1 | 4 | 5.6 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(C)cc3Cl)c(C)nn12 | 10.1016/j.ejmech.2016.11.019 | |||
| 9952997 | 170603 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1021/jm049085v | |||
| CHEMBL445075 | 170603 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1021/jm049085v | |||
| 11462455 | 114772 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL333903 | 114772 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm9904351 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm9904351 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm9904351 | |||
| 10136000 | 29139 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 405 | 7 | 1 | 5 | 6.1 | CCCC(CCC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL138154 | 29139 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 405 | 7 | 1 | 5 | 6.1 | CCCC(CCC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 10692703 | 32373 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 405 | 7 | 1 | 5 | 6.1 | CCCCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL141085 | 32373 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 405 | 7 | 1 | 5 | 6.1 | CCCCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 11774042 | 203352 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL65078 | 203352 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm040058e | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm980224g | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm980224g | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm980224g | |||
| 44392653 | 123231 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 473 | 6 | 0 | 5 | 6.5 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL361314 | 123231 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 473 | 6 | 0 | 5 | 6.5 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 9951076 | 67411 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL188844 | 67411 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165204 | 67411 | 2 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| 10291750 | 84613 | 26 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 355 | 7 | 1 | 7 | 3.8 | CCC(COC)n1nnc2c(Nc3ccc(OC)cc3C)nc(C)cc21 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165203 | 84613 | 26 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 355 | 7 | 1 | 7 | 3.8 | CCC(COC)n1nnc2c(Nc3ccc(OC)cc3C)nc(C)cc21 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2221285 | 84613 | 26 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 355 | 7 | 1 | 7 | 3.8 | CCC(COC)n1nnc2c(Nc3ccc(OC)cc3C)nc(C)cc21 | 10.1016/j.bmcl.2012.08.112 | |||
| 78075688 | 84614 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 436 | 9 | 0 | 6 | 4.4 | COCCN(CCOC)Cc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2165205 | 84614 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 436 | 9 | 0 | 6 | 4.4 | COCCN(CCOC)Cc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL2221286 | 84614 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 436 | 9 | 0 | 6 | 4.4 | COCCN(CCOC)Cc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.ejmech.2021.113537 | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.ejmech.2021.113537 | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1016/j.ejmech.2021.113537 | |||
| 9931767 | 9516 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 416 | 7 | 0 | 4 | 6.4 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL112152 | 9516 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 416 | 7 | 0 | 4 | 6.4 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 9952997 | 170603 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL445075 | 170603 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 9952997 | 170603 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL445075 | 170603 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| 137645497 | 157634 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 356 | 5 | 1 | 4 | 5.6 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(Cl)cc3C)c(C)nn12 | 10.1016/j.ejmech.2016.11.019 | |||
| CHEMBL4081285 | 157634 | 0 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 356 | 5 | 1 | 4 | 5.6 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(Cl)cc3C)c(C)nn12 | 10.1016/j.ejmech.2016.11.019 | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm9904351 | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm9904351 | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm9904351 | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm960149e | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm960149e | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm960149e | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm9900117 | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm9900117 | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 8.8 | pKi | = | 8.8 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm9900117 | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10.1021/jm990590f | |||
| 10224173 | 32371 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL141084 | 32371 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.8 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 10344587 | 167844 | 0 | None | 1 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1021/jm034077k | |||
| CHEMBL1762817 | 167844 | 0 | None | 1 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1021/jm034077k | |||
| CHEMBL430892 | 167844 | 0 | None | 1 | 2 | Rat | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1021/jm034077k | |||
| 9824227 | 58951 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 433 | 7 | 0 | 7 | 4.2 | CCC(COC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168936 | 58951 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 433 | 7 | 0 | 7 | 4.2 | CCC(COC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 9931814 | 59018 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 417 | 6 | 0 | 6 | 5.0 | CCC(CC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169248 | 59018 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 417 | 6 | 0 | 6 | 5.0 | CCC(CC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44347138 | 15271 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL121286 | 15271 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 23595043 | 64005 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 357 | 9 | 1 | 5 | 4.9 | CCc1cc(OC)ccc1-c1nc(OC)c(NC(CC)CC)nc1CC | 10.1021/jm200365y | |||
| CHEMBL1807049 | 64005 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 357 | 9 | 1 | 5 | 4.9 | CCc1cc(OC)ccc1-c1nc(OC)c(NC(CC)CC)nc1CC | 10.1021/jm200365y | |||
| 10786785 | 29140 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 393 | 6 | 1 | 6 | 4.6 | CCC(COC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL138155 | 29140 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 393 | 6 | 1 | 6 | 4.6 | CCC(COC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 11639435 | 71571 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 376 | 5 | 0 | 5 | 4.7 | CC[C@H]1Cn2nc(-c3ccc(OC)cc3C)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL196312 | 71571 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 376 | 5 | 0 | 5 | 4.7 | CC[C@H]1Cn2nc(-c3ccc(OC)cc3C)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11575986 | 124368 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 448 | 4 | 0 | 4 | 6.7 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3C[C@H](c1ccccc1)N2CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL363779 | 124368 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 448 | 4 | 0 | 4 | 6.7 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3C[C@H](c1ccccc1)N2CC1CC1 | 10.1021/jm049085v | |||
| 10740981 | 57836 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 4.0 | CCN(CC)c1nc(C)nc(N(CC)c2c(Br)cc(OC)cc2OC)n1 | 10.1021/jm980222w | |||
| CHEMBL167122 | 57836 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 4.0 | CCN(CC)c1nc(C)nc(N(CC)c2c(Br)cc(OC)cc2OC)n1 | 10.1021/jm980222w | |||
| 10595854 | 120259 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 378 | 8 | 0 | 6 | 4.5 | CCN(CC)c1cc(C)nc(N(CC)c2c(Cl)cc(OC)cc2OC)n1 | 10.1021/jm980222w | |||
| CHEMBL352378 | 120259 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 378 | 8 | 0 | 6 | 4.5 | CCN(CC)c1cc(C)nc(N(CC)c2c(Cl)cc(OC)cc2OC)n1 | 10.1021/jm980222w | |||
| 44392741 | 65240 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL182700 | 65240 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 11164902 | 66302 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL184850 | 66302 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44375351 | 56518 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 424 | 9 | 0 | 4 | 6.6 | CCCCN(CCCCF)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL163618 | 56518 | 0 | None | - | 1 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | 424 | 9 | 0 | 4 | 6.6 | CCCCN(CCCCF)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| 44307737 | 100852 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 8 | 0 | 7 | 4.0 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)cc3OC)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL293469 | 100852 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 383 | 8 | 0 | 7 | 4.0 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)cc3OC)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 11164902 | 66302 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL184850 | 66302 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44337527 | 7448 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 402 | 7 | 0 | 4 | 5.0 | CCCN(c1nc(-c2ccc(Br)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL108673 | 7448 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 402 | 7 | 0 | 4 | 5.0 | CCCN(c1nc(-c2ccc(Br)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 44266482 | 4499 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 477 | 5 | 0 | 3 | 7.8 | CCN(c1nc(C)cc(-c2c(Cl)cccc2Cl)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10208 | 4499 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 477 | 5 | 0 | 3 | 7.8 | CCN(c1nc(C)cc(-c2c(Cl)cccc2Cl)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10813394 | 59171 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 448 | 8 | 1 | 8 | 3.5 | COCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169998 | 59171 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 448 | 8 | 1 | 8 | 3.5 | COCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341818 | 110495 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 420 | 8 | 0 | 5 | 5.5 | CCCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL324889 | 110495 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 420 | 8 | 0 | 5 | 5.5 | CCCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 9867507 | 59067 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 432 | 7 | 0 | 7 | 3.9 | CCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169539 | 59067 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 432 | 7 | 0 | 7 | 3.9 | CCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10576086 | 59101 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 463 | 9 | 0 | 9 | 2.4 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(N(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169711 | 59101 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 463 | 9 | 0 | 9 | 2.4 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(N(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341817 | 172575 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 420 | 7 | 0 | 5 | 5.4 | COCCN(CC(C)C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL448788 | 172575 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 420 | 7 | 0 | 5 | 5.4 | COCCN(CC(C)C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 10574875 | 120744 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 434 | 7 | 0 | 7 | 4.6 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(SC)cc1Br | 10.1021/jm980224g | |||
| CHEMBL355006 | 120744 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 434 | 7 | 0 | 7 | 4.6 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(SC)cc1Br | 10.1021/jm980224g | |||
| 12967651 | 19919 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 445 | 8 | 0 | 4 | 6.8 | CCCN(Cc1sc(N(C)c2c(C)cc(C)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL130264 | 19919 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 445 | 8 | 0 | 4 | 6.8 | CCCN(Cc1sc(N(C)c2c(C)cc(C)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44392710 | 64600 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 366 | 7 | 0 | 7 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N=O)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL181684 | 64600 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 366 | 7 | 0 | 7 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N=O)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10671924 | 59376 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 466 | 7 | 0 | 8 | 3.3 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(S(C)(=O)=O)cc1Br | 10.1021/jm980224g | |||
| CHEMBL170844 | 59376 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 466 | 7 | 0 | 8 | 3.3 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(S(C)(=O)=O)cc1Br | 10.1021/jm980224g | |||
| 44347108 | 15246 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 370 | 7 | 0 | 4 | 5.5 | CCCN(CCC)c1cc(CC)nc2c(-c3ccc(Cl)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL121116 | 15246 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 370 | 7 | 0 | 4 | 5.5 | CCCN(CCC)c1cc(CC)nc2c(-c3ccc(Cl)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 44305971 | 100604 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 395 | 10 | 0 | 6 | 4.4 | C=CCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL291828 | 100604 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 395 | 10 | 0 | 6 | 4.4 | C=CCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 20780034 | 130468 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 382 | 7 | 0 | 4 | 4.8 | CCCN(CCC)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL368041 | 130468 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 382 | 7 | 0 | 4 | 4.8 | CCCN(CCC)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 10298157 | 123233 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 457 | 8 | 1 | 4 | 7.3 | C=CCN(CCC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL361323 | 123233 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 457 | 8 | 1 | 4 | 7.3 | C=CCN(CCC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 10207702 | 131991 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 508 | 8 | 1 | 5 | 7.7 | CCCN(Cc1ccncc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL369531 | 131991 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 508 | 8 | 1 | 5 | 7.7 | CCCN(Cc1ccncc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11246476 | 124055 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 396 | 6 | 0 | 7 | 3.4 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(OC)cc3C)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL363152 | 124055 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 396 | 6 | 0 | 7 | 3.4 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(OC)cc3C)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44389125 | 64617 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 429 | 4 | 1 | 4 | 6.5 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CCCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181765 | 64617 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 429 | 4 | 1 | 4 | 6.5 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CCCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 44460545 | 205567 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 6.8 | O=C(CCc1ccncc1)C(Nc1ccc(Cl)cc1Cl)c1ccccc1C(F)(F)F | 10.1021/jm049974i | |||
| CHEMBL81262 | 205567 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 452 | 7 | 1 | 3 | 6.8 | O=C(CCc1ccncc1)C(Nc1ccc(Cl)cc1Cl)c1ccccc1C(F)(F)F | 10.1021/jm049974i | |||
| 10790231 | 59038 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 462 | 10 | 0 | 10 | 2.1 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1S(C)(=O)=O | 10.1021/jm980224g | |||
| CHEMBL169365 | 59038 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 462 | 10 | 0 | 10 | 2.1 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1S(C)(=O)=O | 10.1021/jm980224g | |||
| 44446715 | 94741 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2Cl)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253084 | 94741 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2Cl)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44460553 | 205896 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 442 | 7 | 1 | 3 | 6.2 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2Br)c(Cl)c1 | 10.1021/jm049974i | |||
| CHEMBL83914 | 205896 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 442 | 7 | 1 | 3 | 6.2 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2Br)c(Cl)c1 | 10.1021/jm049974i | |||
| 10548395 | 102860 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 389 | 8 | 1 | 5 | 5.7 | CCCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| CHEMBL305671 | 102860 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 389 | 8 | 1 | 5 | 5.7 | CCCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| 10542924 | 205138 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 309 | 3 | 1 | 5 | 3.6 | Cc1cc(C)c(Nc2nc(C)nc(N3CC=CCC3)n2)c(C)c1 | 10.1021/jm960148m | |||
| CHEMBL78035 | 205138 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 309 | 3 | 1 | 5 | 3.6 | Cc1cc(C)c(Nc2nc(C)nc(N3CC=CCC3)n2)c(C)c1 | 10.1021/jm960148m | |||
| 10548395 | 102860 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 389 | 8 | 1 | 5 | 5.7 | CCCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| CHEMBL305671 | 102860 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 389 | 8 | 1 | 5 | 5.7 | CCCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| 10542924 | 205138 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 309 | 3 | 1 | 5 | 3.6 | Cc1cc(C)c(Nc2nc(C)nc(N3CC=CCC3)n2)c(C)c1 | 10.1021/jm9900117 | |||
| CHEMBL78035 | 205138 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 309 | 3 | 1 | 5 | 3.6 | Cc1cc(C)c(Nc2nc(C)nc(N3CC=CCC3)n2)c(C)c1 | 10.1021/jm9900117 | |||
| 44446735 | 94629 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCCN(CCn1ccnc1)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL252301 | 94629 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 428 | 8 | 0 | 5 | 5.9 | CCCN(CCn1ccnc1)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44460602 | 205746 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 459 | 6 | 2 | 4 | 6.2 | COc1ccc(C(=O)C(Nc2ccc(C)cc2Cl)c2ccccc2Br)cc1O | 10.1021/jm049974i | |||
| CHEMBL82707 | 205746 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 459 | 6 | 2 | 4 | 6.2 | COc1ccc(C(=O)C(Nc2ccc(C)cc2Cl)c2ccccc2Br)cc1O | 10.1021/jm049974i | |||
| 44317955 | 103920 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 470 | 6 | 2 | 3 | 5.8 | CNC(=O)c1cccc(C(=O)C(Nc2ccc(C)cc2Cl)c2ccccc2Br)c1 | 10.1021/jm049974i | |||
| CHEMBL309244 | 103920 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 470 | 6 | 2 | 3 | 5.8 | CNC(=O)c1cccc(C(=O)C(Nc2ccc(C)cc2Cl)c2ccccc2Br)c1 | 10.1021/jm049974i | |||
| 11395370 | 74178 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 396 | 5 | 2 | 5 | 4.4 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(CO)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL202299 | 74178 | 0 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 396 | 5 | 2 | 5 | 4.4 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(CO)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 11065773 | 202995 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 278 | 4 | 2 | 4 | 2.8 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1C#N | 10.1021/jm025512y | |||
| CHEMBL63140 | 202995 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 278 | 4 | 2 | 4 | 2.8 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1C#N | 10.1021/jm025512y | |||
| 44266473 | 4418 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 409 | 5 | 0 | 3 | 6.5 | CCN(c1nc(C)cc(-c2ccccc2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10150 | 4418 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 409 | 5 | 0 | 3 | 6.5 | CCN(c1nc(C)cc(-c2ccccc2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10494830 | 120348 | 1 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 305 | 2 | 0 | 3 | 3.9 | Cc1ccc(N(C)c2nc(C)cc(C)n2)c(Br)c1 | 10.1021/jm980222w | |||
| CHEMBL353075 | 120348 | 1 | None | - | 1 | Rat | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 305 | 2 | 0 | 3 | 3.9 | Cc1ccc(N(C)c2nc(C)cc(C)n2)c(Br)c1 | 10.1021/jm980222w | |||
| 20780064 | 124329 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 480 | 7 | 0 | 4 | 6.8 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CC4)CC4CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL363592 | 124329 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 480 | 7 | 0 | 4 | 6.8 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CC4)CC4CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 11797750 | 58096 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 448 | 10 | 0 | 5 | 5.7 | CCCN(CCOC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167444 | 58096 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 448 | 10 | 0 | 5 | 5.7 | CCCN(CCOC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10739468 | 59005 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 395 | 7 | 0 | 5 | 4.9 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| CHEMBL169094 | 59005 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 395 | 7 | 0 | 5 | 4.9 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| 44347356 | 112869 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 372 | 7 | 1 | 5 | 4.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(CO)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL330954 | 112869 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 372 | 7 | 1 | 5 | 4.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(CO)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 44341712 | 114960 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL334262 | 114960 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 10024020 | 203102 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 401 | 9 | 0 | 5 | 5.2 | CCCN(c1nccc(-c2c(Cl)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL63989 | 203102 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 401 | 9 | 0 | 5 | 5.2 | CCCN(c1nccc(-c2c(Cl)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 44307806 | 203772 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 393 | 8 | 0 | 5 | 5.8 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(CCC)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL68076 | 203772 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 393 | 8 | 0 | 5 | 5.8 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(CCC)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44305523 | 102168 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 392 | 6 | 0 | 5 | 4.8 | CCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL302645 | 102168 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 392 | 6 | 0 | 5 | 4.8 | CCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 20780164 | 93721 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 421 | 7 | 0 | 5 | 5.7 | C=CCN(CCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247151 | 93721 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 421 | 7 | 0 | 5 | 5.7 | C=CCN(CCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780148 | 151123 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 435 | 7 | 0 | 5 | 5.9 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL395929 | 151123 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 435 | 7 | 0 | 5 | 5.9 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 9980466 | 154128 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 436 | 9 | 1 | 6 | 5.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL398531 | 154128 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 436 | 9 | 1 | 6 | 5.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| 10302495 | 123289 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 541 | 8 | 1 | 4 | 8.9 | CCCN(Cc1ccc(Cl)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL361438 | 123289 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 541 | 8 | 1 | 4 | 8.9 | CCCN(Cc1ccc(Cl)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11189570 | 127483 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.2 | Cc1cc(N(Cc2ccccc2)C(C)C)n2nc(C)c(-c3cnc(N(C)C)cc3C)c2n1 | 10.1021/jm040058e | |||
| CHEMBL366096 | 127483 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.2 | Cc1cc(N(Cc2ccccc2)C(C)C)n2nc(C)c(-c3cnc(N(C)C)cc3C)c2n1 | 10.1021/jm040058e | |||
| 9803645 | 58723 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 446 | 7 | 0 | 7 | 4.3 | CCC(COC)N(C)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168519 | 58723 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 446 | 7 | 0 | 7 | 4.3 | CCC(COC)N(C)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341858 | 111134 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 446 | 7 | 0 | 5 | 6.0 | CCCCN(CC1CCCO1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL326355 | 111134 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 446 | 7 | 0 | 5 | 6.0 | CCCCN(CC1CCCO1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 18691306 | 98576 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 451 | 5 | 0 | 3 | 7.4 | CCN(c1nc(C)cc(-c2c(C)cc(C)cc2C)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL276716 | 98576 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 451 | 5 | 0 | 3 | 7.4 | CCN(c1nc(C)cc(-c2c(C)cc(C)cc2C)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 22249041 | 63977 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 358 | 9 | 1 | 6 | 4.3 | CCc1nc(-c2ccc(OC)nc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806958 | 63977 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 358 | 9 | 1 | 6 | 4.3 | CCc1nc(-c2ccc(OC)nc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 11155051 | 106350 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 446 | 8 | 0 | 5 | 6.2 | CCCN(c1nc(-c2ccc(OC)cc2C)n(C)n1)[C@@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL3085415 | 106350 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 446 | 8 | 0 | 5 | 6.2 | CCCN(c1nc(-c2ccc(OC)cc2C)n(C)n1)[C@@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL3139200 | 106350 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 446 | 8 | 0 | 5 | 6.2 | CCCN(c1nc(-c2ccc(OC)cc2C)n(C)n1)[C@@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| 136216703 | 78905 | 0 | None | -5 | 5 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 482 | 2 | 4 | 7 | 4.0 | N[C@H]1CCCC[C@@H]1NC(=O)c1c2c(c3c4c(ncnc14)-c1ccccc1C3=O)N[C@@H]1CCCC[C@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| CHEMBL2112936 | 78905 | 0 | None | -5 | 5 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 482 | 2 | 4 | 7 | 4.0 | N[C@H]1CCCC[C@@H]1NC(=O)c1c2c(c3c4c(ncnc14)-c1ccccc1C3=O)N[C@@H]1CCCC[C@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| 44392740 | 123826 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 337 | 6 | 0 | 5 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncccc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL362437 | 123826 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 337 | 6 | 0 | 5 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncccc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10142769 | 6502 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 520 | 8 | 0 | 4 | 7.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC4CC4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082720 | 6502 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 520 | 8 | 0 | 4 | 7.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC4CC4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 44392771 | 66671 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 399 | 10 | 0 | 7 | 3.7 | CCCN(CC1CC1)c1cc(C(=O)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL185400 | 66671 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 399 | 10 | 0 | 7 | 3.7 | CCCN(CC1CC1)c1cc(C(=O)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 44389050 | 62502 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 505 | 6 | 2 | 8 | 7.1 | CSc1snnc1NCc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL178131 | 62502 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 505 | 6 | 2 | 8 | 7.1 | CSc1snnc1NCc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 10140223 | 123255 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.5 | CCN(CCC1CC1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL361394 | 123255 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.5 | CCN(CCC1CC1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 10160871 | 19812 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 445 | 8 | 1 | 4 | 6.7 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1CC | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL130180 | 19812 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 445 | 8 | 1 | 4 | 6.7 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1CC | 10.1016/j.bmcl.2003.08.055 | |||
| 10551027 | 57589 | 0 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 438 | 3 | 0 | 5 | 4.9 | Cc1cc(N2CCOCC2)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL166760 | 57589 | 0 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 438 | 3 | 0 | 5 | 4.9 | Cc1cc(N2CCOCC2)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 44307652 | 203798 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 391 | 7 | 1 | 5 | 5.6 | CCCCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL68303 | 203798 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 391 | 7 | 1 | 5 | 5.6 | CCCCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44385525 | 60040 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 394 | 6 | 0 | 7 | 3.4 | CCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)nc1C | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL173624 | 60040 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 394 | 6 | 0 | 7 | 3.4 | CCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)nc1C | 10.1016/s0960-894x(99)00108-0 | |||
| 10902707 | 203598 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| CHEMBL66950 | 203598 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| 44308155 | 203715 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 446 | 7 | 0 | 6 | 5.0 | CCCN(CCN1CCCC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL67646 | 203715 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 446 | 7 | 0 | 6 | 5.0 | CCCN(CCN1CCCC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44443574 | 94331 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 381 | 8 | 2 | 5 | 5.6 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1ncc(Cl)cc1Cl | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL250616 | 94331 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 381 | 8 | 2 | 5 | 5.6 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1ncc(Cl)cc1Cl | 10.1016/j.bmcl.2007.09.008 | |||
| 10567951 | 205078 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 323 | 7 | 1 | 5 | 4.0 | C=CCN(CC=C)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| CHEMBL77391 | 205078 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 323 | 7 | 1 | 5 | 4.0 | C=CCN(CC=C)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| 10567951 | 205078 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 323 | 7 | 1 | 5 | 4.0 | C=CCN(CC=C)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| CHEMBL77391 | 205078 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 323 | 7 | 1 | 5 | 4.0 | C=CCN(CC=C)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| 10222698 | 187850 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 401 | 10 | 1 | 6 | 4.3 | CCCN(CCC)c1c(CC(C)O)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL496269 | 187850 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 401 | 10 | 1 | 6 | 4.3 | CCCN(CCC)c1c(CC(C)O)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 44385545 | 60277 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 499 | 9 | 0 | 6 | 5.8 | CCCCN(CC)c1nc(C)nc2c1n(CC1CC1)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL174213 | 60277 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 499 | 9 | 0 | 6 | 5.8 | CCCCN(CC)c1nc(C)nc2c1n(CC1CC1)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 44385463 | 61379 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 433 | 6 | 1 | 7 | 3.4 | COCCNc1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL176937 | 61379 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 433 | 6 | 1 | 7 | 3.4 | COCCNc1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 20780127 | 135242 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 446 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)C(=O)c1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL372499 | 135242 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 446 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)C(=O)c1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 135593026 | 63947 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 343 | 8 | 2 | 5 | 4.6 | CCc1nc(-c2ccc(OC)cc2O)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806735 | 63947 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 343 | 8 | 2 | 5 | 4.6 | CCc1nc(-c2ccc(OC)cc2O)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 44443571 | 94330 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 314 | 7 | 0 | 5 | 4.2 | CCCN(CCC)c1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL250615 | 94330 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 314 | 7 | 0 | 5 | 4.2 | CCCN(CCC)c1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| 11475729 | 75376 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 422 | 7 | 1 | 5 | 5.5 | C=CCOc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL203807 | 75376 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 422 | 7 | 1 | 5 | 5.5 | C=CCOc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| 9887145 | 126651 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 398 | 6 | 0 | 5 | 4.9 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(Cl)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL365260 | 126651 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 398 | 6 | 0 | 5 | 4.9 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(Cl)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 9907170 | 178099 | 0 | None | -2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 365 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980222w | |||
| CHEMBL46479 | 178099 | 0 | None | -2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 365 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980222w | |||
| 44392687 | 66668 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 457 | 8 | 0 | 7 | 4.2 | COCCN(CCOC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL185393 | 66668 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 457 | 8 | 0 | 7 | 4.2 | COCCN(CCOC)c1cc(C)nc2c(-c3ncc(C(F)(F)F)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 21916254 | 6405 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 576 | 7 | 0 | 4 | 8.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4ccc(Cl)cc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082338 | 6405 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 576 | 7 | 0 | 4 | 8.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4ccc(Cl)cc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 10300313 | 6819 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 494 | 7 | 0 | 4 | 6.9 | CCCN(CCC(F)(F)F)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083935 | 6819 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 494 | 7 | 0 | 4 | 6.9 | CCCN(CCC(F)(F)F)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 22248932 | 63994 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 6.2 | CCc1nc(NC(CC)CC)c(I)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807034 | 63994 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 463 | 6 | 1 | 3 | 6.2 | CCc1nc(NC(CC)CC)c(I)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 44388407 | 63011 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL178735 | 63011 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| 9907170 | 178099 | 0 | None | -2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 365 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm990590f | |||
| CHEMBL46479 | 178099 | 0 | None | -2 | 2 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 365 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm990590f | |||
| 44341663 | 110874 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 432 | 8 | 0 | 4 | 5.9 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL326107 | 110874 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 432 | 8 | 0 | 4 | 5.9 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 44384779 | 59711 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 487 | 8 | 0 | 7 | 4.2 | COCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL172358 | 59711 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 487 | 8 | 0 | 7 | 4.2 | COCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10739849 | 58503 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 401 | 5 | 0 | 5 | 4.9 | CCN(CC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168353 | 58503 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 401 | 5 | 0 | 5 | 4.9 | CCN(CC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341762 | 10155 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 406 | 7 | 0 | 5 | 5.1 | CCN(CCCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL115820 | 10155 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 406 | 7 | 0 | 5 | 5.1 | CCN(CCCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 11625175 | 71912 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 384 | 4 | 0 | 4 | 5.2 | CC[C@H]1Cn2nc(-c3ccc(F)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL197187 | 71912 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 384 | 4 | 0 | 4 | 5.2 | CC[C@H]1Cn2nc(-c3ccc(F)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11530590 | 140776 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 360 | 4 | 0 | 4 | 5.0 | CC[C@H]1Cn2nc(-c3ccc(C)cc3C)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL381850 | 140776 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 360 | 4 | 0 | 4 | 5.0 | CC[C@H]1Cn2nc(-c3ccc(C)cc3C)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 9957261 | 65276 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 490 | 7 | 0 | 6 | 7.0 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL18285 | 65276 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 490 | 7 | 0 | 6 | 7.0 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| 10669526 | 165414 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 414 | 4 | 1 | 6 | 4.8 | Cc1nc(NC2CCCC2)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| CHEMBL423833 | 165414 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 414 | 4 | 1 | 6 | 4.8 | Cc1nc(NC2CCCC2)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| 44446738 | 94648 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 473 | 10 | 0 | 4 | 7.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL252492 | 94648 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 473 | 10 | 0 | 4 | 7.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCCCC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 10117501 | 64185 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 7.9 | CCN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL180880 | 64185 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 7.9 | CCN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11441193 | 63416 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 408 | 10 | 0 | 6 | 5.3 | CCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL179647 | 63416 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 408 | 10 | 0 | 6 | 5.3 | CCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 44337549 | 9174 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 352 | 7 | 0 | 4 | 4.8 | CCCN(c1nc(-c2c(C)cc(C)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL110222 | 9174 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 352 | 7 | 0 | 4 | 4.8 | CCCN(c1nc(-c2c(C)cc(C)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 11223627 | 68671 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 410 | 6 | 0 | 6 | 3.9 | COCC(COC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL192082 | 68671 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 410 | 6 | 0 | 6 | 3.9 | COCC(COC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 44392731 | 123752 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 385 | 9 | 0 | 6 | 3.3 | COCCN(CCOC)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL362226 | 123752 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 385 | 9 | 0 | 6 | 3.3 | COCCN(CCOC)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 46891008 | 6434 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 424 | 3 | 0 | 4 | 5.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082441 | 6434 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 424 | 3 | 0 | 4 | 5.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780056 | 146241 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 444 | 5 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)Cc4ccncc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL392044 | 146241 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 444 | 5 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)Cc4ccncc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780286 | 7329 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 448 | 6 | 0 | 4 | 5.6 | CCCN(CC1CC1)C(=O)c1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1086164 | 7329 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 448 | 6 | 0 | 4 | 5.6 | CCCN(CC1CC1)C(=O)c1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 44389097 | 63015 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 441 | 4 | 1 | 4 | 6.6 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CC=CCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL178751 | 63015 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 441 | 4 | 1 | 4 | 6.6 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CC=CCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 10853581 | 120264 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 326 | 5 | 1 | 7 | 2.5 | COCCNc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL352436 | 120264 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 326 | 5 | 1 | 7 | 2.5 | COCCNc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 44443572 | 154774 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 326 | 7 | 0 | 5 | 4.2 | CCCN(CC1CC1)c1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL400155 | 154774 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 326 | 7 | 0 | 5 | 4.2 | CCCN(CC1CC1)c1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| 44443661 | 94119 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 503 | 9 | 1 | 6 | 6.1 | CCc1nc(N(C)c2ncc(Cl)cc2Cl)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL249212 | 94119 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 503 | 9 | 1 | 6 | 6.1 | CCc1nc(N(C)c2ncc(Cl)cc2Cl)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| 44443636 | 94414 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 390 | 6 | 1 | 6 | 4.7 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL251006 | 94414 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 390 | 6 | 1 | 6 | 4.7 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| 9890659 | 99062 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 464 | 3 | 0 | 7 | 5.2 | Cc1nc(N2CCOCC2)c2sc(=S)n(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL280449 | 99062 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 464 | 3 | 0 | 7 | 5.2 | Cc1nc(N2CCOCC2)c2sc(=S)n(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1016/s0960-894x(99)00159-6 | |||
| 10552595 | 59001 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 476 | 9 | 0 | 8 | 3.9 | CCN(c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br)C(COC)COC | 10.1021/jm980224g | |||
| CHEMBL169070 | 59001 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 476 | 9 | 0 | 8 | 3.9 | CCN(c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br)C(COC)COC | 10.1021/jm980224g | |||
| 44384893 | 59907 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 382 | 6 | 0 | 7 | 3.4 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)nc1C | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL173074 | 59907 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 382 | 6 | 0 | 7 | 3.4 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)nc1C | 10.1016/s0960-894x(99)00108-0 | |||
| 11684703 | 71737 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL196604 | 71737 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 20780017 | 64944 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 458 | 7 | 0 | 4 | 5.2 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL182278 | 64944 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 458 | 7 | 0 | 4 | 5.2 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| 44443634 | 93985 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 418 | 7 | 0 | 6 | 4.8 | CCc1nc(N(C)[C@@H]2c3ccccc3C[C@@H]2OC)c(CC)nc1Oc1cc(C)ccn1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248577 | 93985 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 418 | 7 | 0 | 6 | 4.8 | CCc1nc(N(C)[C@@H]2c3ccccc3C[C@@H]2OC)c(CC)nc1Oc1cc(C)ccn1 | 10.1016/j.bmcl.2007.09.008 | |||
| 10641825 | 120466 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 353 | 2 | 0 | 3 | 5.1 | Cc1ccc2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL354092 | 120466 | 0 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 353 | 2 | 0 | 3 | 5.1 | Cc1ccc2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 53310410 | 63986 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 411 | 10 | 0 | 5 | 4.7 | CCc1nc(N(CCOC)CCOC)c(CC)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807026 | 63986 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 411 | 10 | 0 | 5 | 4.7 | CCc1nc(N(CCOC)CCOC)c(CC)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 20780074 | 67671 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 522 | 7 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC(F)(F)F)CC4CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL190745 | 67671 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 522 | 7 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC(F)(F)F)CC4CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10643831 | 57614 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 385 | 10 | 0 | 6 | 4.5 | CCCCN(CCOC)c1nc(C)nc(N(CC)c2c(C)cc(C)cc2C)n1 | 10.1021/jm980222w | |||
| CHEMBL166835 | 57614 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 385 | 10 | 0 | 6 | 4.5 | CCCCN(CCOC)c1nc(C)nc(N(CC)c2c(C)cc(C)cc2C)n1 | 10.1021/jm980222w | |||
| 9866114 | 65250 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 407 | 10 | 0 | 4 | 5.6 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(CC)cc(CC)cc2CC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182752 | 65250 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 407 | 10 | 0 | 4 | 5.6 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(CC)cc(CC)cc2CC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 44392693 | 66339 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 408 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(CC)CC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL185055 | 66339 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 408 | 9 | 0 | 6 | 5.2 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(CC)CC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44392753 | 66655 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3NC)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL185292 | 66655 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3NC)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44342015 | 110217 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 467 | 8 | 0 | 5 | 6.5 | CCCCN(CCc1ccccn1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL323756 | 110217 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 467 | 8 | 0 | 5 | 6.5 | CCCCN(CCc1ccccn1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 9846806 | 110611 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 6.4 | CCCN(Cc1ccc(O)cc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL325638 | 110611 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 454 | 6 | 1 | 5 | 6.4 | CCCN(Cc1ccc(O)cc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 46891116 | 6811 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 454 | 8 | 0 | 5 | 5.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3ccc(OC)cc3C)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083922 | 6811 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 454 | 8 | 0 | 5 | 5.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3ccc(OC)cc3C)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780266 | 6886 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 506 | 6 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CC4CCC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084235 | 6886 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 506 | 6 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CC4CCC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916134 | 7127 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 436 | 7 | 0 | 4 | 5.9 | C=CCN(CC=C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1085265 | 7127 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 436 | 7 | 0 | 4 | 5.9 | C=CCN(CC=C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916107 | 7430 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 452 | 7 | 0 | 4 | 6.3 | CCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086594 | 7430 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 452 | 7 | 0 | 4 | 6.3 | CCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 11280879 | 67547 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 394 | 7 | 1 | 6 | 5.0 | Cc1cc(NC(C)CCC(C)C)n2nc(C)c(-c3cnc(N(C)C)cc3C)c2n1 | 10.1021/jm040058e | |||
| CHEMBL189754 | 67547 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 394 | 7 | 1 | 6 | 5.0 | Cc1cc(NC(C)CCC(C)C)n2nc(C)c(-c3cnc(N(C)C)cc3C)c2n1 | 10.1021/jm040058e | |||
| 11306515 | 70452 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 459 | 7 | 0 | 5 | 5.7 | CCCC(CCC)N1CCc2cn(-c3ccc(S(C)(=O)=O)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL194607 | 70452 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 459 | 7 | 0 | 5 | 5.7 | CCCC(CCC)N1CCc2cn(-c3ccc(S(C)(=O)=O)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 11166658 | 133413 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 6.2 | CCCC(CCC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL370501 | 133413 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 6.2 | CCCC(CCC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 9844591 | 60813 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 412 | 6 | 0 | 6 | 6.1 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=S)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL17619 | 60813 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 412 | 6 | 0 | 6 | 6.1 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=S)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| 44266463 | 4562 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 443 | 5 | 0 | 3 | 7.1 | CCN(c1nc(C)cc(-c2ccccc2Cl)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10249 | 4562 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 443 | 5 | 0 | 3 | 7.1 | CCN(c1nc(C)cc(-c2ccccc2Cl)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 44290640 | 101489 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)c(OC)c3)c(C)nn12 | 10.1021/jm990590f | |||
| CHEMBL297886 | 101489 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)c(OC)c3)c(C)nn12 | 10.1021/jm990590f | |||
| 44266481 | 5372 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 427 | 6 | 0 | 5 | 5.4 | CCN(c1nc(C)cc(-c2ccccc2)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10698 | 5372 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 427 | 6 | 0 | 5 | 5.4 | CCN(c1nc(C)cc(-c2ccccc2)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| 122193806 | 123976 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 490 | 8 | 0 | 4 | 6.0 | CCN(C)c1cc(C)nc2c1N(CCCCF)C(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628854 | 123976 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 490 | 8 | 0 | 4 | 6.0 | CCN(C)c1cc(C)nc2c1N(CCCCF)C(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL2372939 | 210320 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm034180+ | |||||
| 9800789 | 123141 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3cccc(OC)c3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL361242 | 123141 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3cccc(OC)c3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44384828 | 59761 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 491 | 9 | 0 | 8 | 3.4 | COCCN(CCOC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL172544 | 59761 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 491 | 9 | 0 | 8 | 3.4 | COCCN(CCOC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 21916340 | 7380 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 502 | 8 | 0 | 4 | 7.5 | CCCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086380 | 7380 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 502 | 8 | 0 | 4 | 7.5 | CCCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 10616216 | 103550 | 1 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 327 | 7 | 1 | 5 | 4.5 | CCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| CHEMBL308544 | 103550 | 1 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 327 | 7 | 1 | 5 | 4.5 | CCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| 10616216 | 103550 | 1 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 327 | 7 | 1 | 5 | 4.5 | CCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| CHEMBL308544 | 103550 | 1 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 327 | 7 | 1 | 5 | 4.5 | CCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| 10186078 | 64584 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 513 | 8 | 1 | 5 | 8.3 | CCCN(Cc1cccs1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181625 | 64584 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 513 | 8 | 1 | 5 | 8.3 | CCCN(Cc1cccs1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 18672249 | 64595 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 575 | 9 | 1 | 4 | 8.9 | FC(F)(F)CCN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181673 | 64595 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 575 | 9 | 1 | 4 | 8.9 | FC(F)(F)CCN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 20780053 | 168949 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 497 | 6 | 0 | 5 | 6.8 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCCC4CCc4ccccc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL438847 | 168949 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 497 | 6 | 0 | 5 | 6.8 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCCC4CCc4ccccc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 10229290 | 130420 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 508 | 8 | 1 | 5 | 7.7 | CCCN(Cc1ccccn1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL368018 | 130420 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 508 | 8 | 1 | 5 | 7.7 | CCCN(Cc1ccccn1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 44389082 | 62549 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 500 | 9 | 1 | 5 | 6.6 | CN(C)CCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL178246 | 62549 | 0 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 500 | 9 | 1 | 5 | 6.6 | CN(C)CCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 11340431 | 73392 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 7 | 1 | 5 | 6.5 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2cccc(OCc3ccccc3)c2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL201518 | 73392 | 0 | None | - | 1 | Rat | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 472 | 7 | 1 | 5 | 6.5 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2cccc(OCc3ccccc3)c2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 11798911 | 120353 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 479 | 9 | 0 | 7 | 6.1 | CCCCN(CC)c1nc(C)nc2c1nc(-c1ccccc1)n2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL353098 | 120353 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 479 | 9 | 0 | 7 | 6.1 | CCCCN(CC)c1nc(C)nc2c1nc(-c1ccccc1)n2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 44318119 | 205900 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 341 | 6 | 0 | 4 | 4.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2C)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL83934 | 205900 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 341 | 6 | 0 | 4 | 4.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2C)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 20780073 | 67285 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 452 | 7 | 0 | 4 | 6.4 | C=CCN(CC=C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL188194 | 67285 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 452 | 7 | 0 | 4 | 6.4 | C=CCN(CC=C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 10830877 | 205514 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 338 | 7 | 1 | 4 | 5.1 | CCCN(CC1CC1)c1cc(Nc2c(C)cc(C)cc2C)nc(C)n1 | 10.1021/jm960149e | |||
| CHEMBL80806 | 205514 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 338 | 7 | 1 | 4 | 5.1 | CCCN(CC1CC1)c1cc(Nc2c(C)cc(C)cc2C)nc(C)n1 | 10.1021/jm960149e | |||
| 10830877 | 205514 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 338 | 7 | 1 | 4 | 5.1 | CCCN(CC1CC1)c1cc(Nc2c(C)cc(C)cc2C)nc(C)n1 | 10.1021/jm9900117 | |||
| CHEMBL80806 | 205514 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 338 | 7 | 1 | 4 | 5.1 | CCCN(CC1CC1)c1cc(Nc2c(C)cc(C)cc2C)nc(C)n1 | 10.1021/jm9900117 | |||
| 10506052 | 57446 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 516 | 8 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(I)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL165531 | 57446 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 516 | 8 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(I)cc2Br)n1 | 10.1021/jm980222w | |||
| 10529311 | 57528 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 496 | 10 | 0 | 5 | 6.5 | CCN(c1nc(C)cc(N(CCOC)Cc2ccccc2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| CHEMBL166235 | 57528 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 496 | 10 | 0 | 5 | 6.5 | CCN(c1nc(C)cc(N(CCOC)Cc2ccccc2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| 44392657 | 65212 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3[N+](=O)[O-])c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL182567 | 65212 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3[N+](=O)[O-])c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10346761 | 110603 | 1 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 524 | 7 | 1 | 4 | 6.7 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(I)cc2Cl)c1Cl | 10.1016/s0960-894x(00)00661-2 | |||
| CHEMBL325577 | 110603 | 1 | None | - | 1 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 524 | 7 | 1 | 4 | 6.7 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(I)cc2Cl)c1Cl | 10.1016/s0960-894x(00)00661-2 | |||
| 21916292 | 7502 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 524 | 7 | 0 | 4 | 6.8 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CC2CC2)CC(F)(F)C(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087166 | 7502 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 524 | 7 | 0 | 4 | 6.8 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CC2CC2)CC(F)(F)C(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 11442212 | 62497 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 446 | 8 | 0 | 5 | 6.2 | CCCN(c1nc(-c2ccc(OC)cc2C)n(C)n1)C(CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL178117 | 62497 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 446 | 8 | 0 | 5 | 6.2 | CCCN(c1nc(-c2ccc(OC)cc2C)n(C)n1)C(CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| 11212115 | 122327 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 412 | 9 | 0 | 5 | 5.9 | CCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL359863 | 122327 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 412 | 9 | 0 | 5 | 5.9 | CCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 44337106 | 6253 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 356 | 8 | 1 | 5 | 3.9 | CCCN(CCC)c1nc(-c2ccc(Cl)cc2Cl)n(CCO)n1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL108158 | 6253 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 356 | 8 | 1 | 5 | 3.9 | CCCN(CCC)c1nc(-c2ccc(Cl)cc2Cl)n(CCO)n1 | 10.1016/s0960-894x(01)00657-6 | |||
| 122193726 | 123966 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 5.4 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2C/C=C/CF | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628745 | 123966 | 0 | None | - | 1 | Human | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 5.4 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2C/C=C/CF | 10.1016/j.bmcl.2015.10.010 | |||
| 9946605 | 64003 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 353 | 6 | 1 | 4 | 5.4 | CCC(CC)Nc1nc(OC)c(-c2ccc(Cl)cc2Cl)nc1C | 10.1021/jm200365y | |||
| CHEMBL1807043 | 64003 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 353 | 6 | 1 | 4 | 5.4 | CCC(CC)Nc1nc(OC)c(-c2ccc(Cl)cc2Cl)nc1C | 10.1021/jm200365y | |||
| 9957428 | 61279 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 494 | 9 | 0 | 8 | 4.1 | COCCN(CCOC)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL17666 | 61279 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 494 | 9 | 0 | 8 | 4.1 | COCCN(CCOC)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| 9798798 | 63152 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 356 | 4 | 0 | 6 | 3.9 | CCN(CC)c1nc(C)nc2c1sc(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL17897 | 63152 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 356 | 4 | 0 | 6 | 3.9 | CCN(CC)c1nc(C)nc2c1sc(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| 44341687 | 111316 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 378 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL326722 | 111316 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 378 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 11475328 | 126187 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 408 | 8 | 0 | 6 | 4.7 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OCC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL364938 | 126187 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 408 | 8 | 0 | 6 | 4.7 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OCC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44341634 | 10258 | 1 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 317 | 2 | 0 | 2 | 5.5 | COc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL116106 | 10258 | 1 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 317 | 2 | 0 | 2 | 5.5 | COc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 20780054 | 169130 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 409 | 3 | 0 | 6 | 4.1 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCOCC4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL440232 | 169130 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 409 | 3 | 0 | 6 | 4.1 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCOCC4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 11109264 | 102559 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 297 | 5 | 2 | 4 | 3.4 | COc1cccc(N/C(=N/Nc2ccccc2C)C(C)=O)c1 | 10.1021/jm025512y | |||
| CHEMBL304072 | 102559 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 297 | 5 | 2 | 4 | 3.4 | COc1cccc(N/C(=N/Nc2ccccc2C)C(C)=O)c1 | 10.1021/jm025512y | |||
| 20780180 | 67204 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 468 | 7 | 0 | 4 | 6.8 | CCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187815 | 67204 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 468 | 7 | 0 | 4 | 6.8 | CCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 11782614 | 203959 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 4 | 2 | 3 | 4.3 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1C(F)(F)F | 10.1021/jm025512y | |||
| CHEMBL69374 | 203959 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 335 | 4 | 2 | 3 | 4.3 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1C(F)(F)F | 10.1021/jm025512y | |||
| 44308156 | 102331 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 420 | 7 | 0 | 6 | 4.4 | CCCN(CCN(C)C)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL303639 | 102331 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 420 | 7 | 0 | 6 | 4.4 | CCCN(CCN(C)C)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 11245983 | 75913 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 380 | 4 | 1 | 4 | 5.2 | Cc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL204967 | 75913 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 380 | 4 | 1 | 4 | 5.2 | Cc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| 1799083 | 204013 | 3 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 365 | 4 | 2 | 3 | 4.3 | CC(=O)/C(=N\c1cccc(Cl)c1)NNc1ccc(Br)cc1 | 10.1021/jm025512y | |||
| CHEMBL69686 | 204013 | 3 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 365 | 4 | 2 | 3 | 4.3 | CC(=O)/C(=N\c1cccc(Cl)c1)NNc1ccc(Br)cc1 | 10.1021/jm025512y | |||
| 10594766 | 103136 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.9 | CCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| CHEMBL307871 | 103136 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.9 | CCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| 10594766 | 103136 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.9 | CCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| CHEMBL307871 | 103136 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.9 | CCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| 22324320 | 205948 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 381 | 7 | 0 | 4 | 5.2 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2Cl)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL84339 | 205948 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 381 | 7 | 0 | 4 | 5.2 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2Cl)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 10596113 | 120586 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 382 | 7 | 0 | 5 | 5.1 | CCN(CC)c1cc(C)nc(N(CC)c2c(Cl)cc(OC)cc2Cl)n1 | 10.1021/jm980222w | |||
| CHEMBL354584 | 120586 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 382 | 7 | 0 | 5 | 5.1 | CCN(CC)c1cc(C)nc(N(CC)c2c(Cl)cc(OC)cc2Cl)n1 | 10.1021/jm980222w | |||
| 10474043 | 64577 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 365 | 7 | 0 | 4 | 4.9 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL181593 | 64577 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 365 | 7 | 0 | 4 | 4.9 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 4183319 | 114749 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 352 | 7 | 0 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL333880 | 114749 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 352 | 7 | 0 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 44306488 | 202749 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 395 | 9 | 0 | 5 | 5.2 | CCCN(c1ncc(C)c(-c2c(C)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL61954 | 202749 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 395 | 9 | 0 | 5 | 5.2 | CCCN(c1ncc(C)c(-c2c(C)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 9865575 | 203397 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 397 | 10 | 0 | 6 | 4.6 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL65484 | 203397 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 397 | 10 | 0 | 6 | 4.6 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 44308017 | 102531 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 379 | 7 | 0 | 5 | 5.4 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)nn(CC)c12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL304059 | 102531 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 379 | 7 | 0 | 5 | 5.4 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)nn(CC)c12 | 10.1016/s0960-894x(02)00358-x | |||
| 44305208 | 100747 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.3 | CCCCN(CC)c1cc(C)nc2c(-c3ccccc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL292764 | 100747 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.3 | CCCCN(CC)c1cc(C)nc2c(-c3ccccc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 20780153 | 93761 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 449 | 8 | 0 | 5 | 6.3 | CCCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247359 | 93761 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 449 | 8 | 0 | 5 | 6.3 | CCCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780142 | 145063 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 415 | 7 | 0 | 5 | 5.5 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL391141 | 145063 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 415 | 7 | 0 | 5 | 5.5 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780165 | 147760 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 423 | 7 | 0 | 5 | 5.9 | CCCN(CCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL393250 | 147760 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 423 | 7 | 0 | 5 | 5.9 | CCCN(CCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 10132995 | 187991 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 357 | 8 | 0 | 5 | 4.7 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL497301 | 187991 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 357 | 8 | 0 | 5 | 4.7 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 11375016 | 124078 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 478 | 7 | 0 | 6 | 6.4 | CCCN(Cc1ccc2ccccc2c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL363269 | 124078 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 478 | 7 | 0 | 6 | 6.4 | CCCN(Cc1ccc2ccccc2c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44337304 | 109883 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 5.3 | CCCN(c1nc(-c2cc(F)c(Cl)cc2Cl)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL323437 | 109883 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 5.3 | CCCN(c1nc(-c2cc(F)c(Cl)cc2Cl)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 44387103 | 61786 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 473 | 8 | 1 | 6 | 5.7 | CCCCC(CC)Nc1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL177310 | 61786 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 473 | 8 | 1 | 6 | 5.7 | CCCCC(CC)Nc1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10717531 | 58510 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 430 | 10 | 0 | 9 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1SC | 10.1021/jm980224g | |||
| CHEMBL168388 | 58510 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 430 | 10 | 0 | 9 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1SC | 10.1021/jm980224g | |||
| 10812125 | 59135 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 421 | 7 | 0 | 7 | 4.2 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980224g | |||
| CHEMBL169862 | 59135 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 421 | 7 | 0 | 7 | 4.2 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980224g | |||
| 11656502 | 71197 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 402 | 4 | 0 | 4 | 6.0 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC(C)C | 10.1021/jm049085v | |||
| CHEMBL195636 | 71197 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 402 | 4 | 0 | 4 | 6.0 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC(C)C | 10.1021/jm049085v | |||
| 11361057 | 67672 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 382 | 6 | 0 | 7 | 3.1 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL190757 | 67672 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 382 | 6 | 0 | 7 | 3.1 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 21916165 | 67231 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 446 | 8 | 0 | 4 | 6.5 | CCCN(Cc1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187940 | 67231 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 446 | 8 | 0 | 4 | 6.5 | CCCN(Cc1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 44397642 | 67558 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 546 | 8 | 0 | 4 | 7.8 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3ccc(C(C)C)cc3Br)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL189809 | 67558 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 546 | 8 | 0 | 4 | 7.8 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3ccc(C(C)C)cc3Br)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 44347117 | 16447 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 466 | 7 | 0 | 6 | 5.0 | CCCN(CC1CC1)c1cc(S(C)(=O)=O)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL123306 | 16447 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 466 | 7 | 0 | 6 | 5.0 | CCCN(CC1CC1)c1cc(S(C)(=O)=O)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 21916109 | 6706 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 533 | 8 | 0 | 6 | 7.0 | CCCN(Cc1ccc([N+](=O)[O-])cc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083612 | 6706 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 533 | 8 | 0 | 6 | 7.0 | CCCN(Cc1ccc([N+](=O)[O-])cc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916289 | 6876 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.4 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084184 | 6876 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.4 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 10502620 | 119419 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 426 | 7 | 0 | 4 | 6.4 | CCCN(CC1CC1)c1nc(C)nc(N(C)c2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm960149e | |||
| CHEMBL344805 | 119419 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 426 | 7 | 0 | 4 | 6.4 | CCCN(CC1CC1)c1nc(C)nc(N(C)c2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm960149e | |||
| 10275456 | 63377 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 445 | 7 | 1 | 4 | 7.1 | CCCN(CC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL179576 | 63377 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 445 | 7 | 1 | 4 | 7.1 | CCCN(CC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11429073 | 62618 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 384 | 7 | 0 | 5 | 5.1 | CCC(c1ccccc1)N(CC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL178346 | 62618 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 384 | 7 | 0 | 5 | 5.1 | CCC(c1ccccc1)N(CC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 44337446 | 5200 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 420 | 8 | 0 | 4 | 5.8 | CCCN(c1nc(-c2c(C)cc(C)cc2C)n(CC(F)(F)F)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL106093 | 5200 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 420 | 8 | 0 | 4 | 5.8 | CCCN(c1nc(-c2c(C)cc(C)cc2C)n(CC(F)(F)F)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 22248956 | 63996 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 381 | 8 | 1 | 4 | 6.0 | CCOc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807036 | 63996 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 381 | 8 | 1 | 4 | 6.0 | CCOc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 46881398 | 7505 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 408 | 3 | 0 | 5 | 4.2 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CCOCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087173 | 7505 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 408 | 3 | 0 | 5 | 4.2 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CCOCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 22249081 | 63987 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 408 | 9 | 0 | 4 | 5.4 | CCCN(CCN(C)C)c1nc(CC)c(-c2ccc(Cl)cc2Cl)nc1CC | 10.1021/jm200365y | |||
| CHEMBL1807027 | 63987 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 408 | 9 | 0 | 4 | 5.4 | CCCN(CCN(C)C)c1nc(CC)c(-c2ccc(Cl)cc2Cl)nc1CC | 10.1021/jm200365y | |||
| 44460260 | 205338 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccccc1[C@@H](Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL79587 | 205338 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccccc1[C@@H](Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 44443575 | 93986 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 414 | 8 | 2 | 4 | 6.9 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1c(Cl)cc(Cl)cc1Cl | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248585 | 93986 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 414 | 8 | 2 | 4 | 6.9 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1c(Cl)cc(Cl)cc1Cl | 10.1016/j.bmcl.2007.09.008 | |||
| 20780024 | 65225 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 472 | 8 | 0 | 4 | 5.7 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL182624 | 65225 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 472 | 8 | 0 | 4 | 5.7 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| 11454794 | 75609 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.3 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3ccc(C#N)cc3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL204706 | 75609 | 0 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.3 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3ccc(C#N)cc3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 11704536 | 71765 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 424 | 5 | 0 | 6 | 4.9 | CC[C@H]1Cn2nc(-c3ccc(C(=O)OC)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL196682 | 71765 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 424 | 5 | 0 | 6 | 4.9 | CC[C@H]1Cn2nc(-c3ccc(C(=O)OC)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 9843989 | 71919 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 400 | 2 | 0 | 4 | 5.9 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2C1CCCCC1 | 10.1021/jm049085v | |||
| CHEMBL197204 | 71919 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 400 | 2 | 0 | 4 | 5.9 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2C1CCCCC1 | 10.1021/jm049085v | |||
| 11524923 | 124806 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 436 | 4 | 0 | 4 | 6.5 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1Cc1ccccc1 | 10.1021/jm049085v | |||
| CHEMBL364261 | 124806 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 436 | 4 | 0 | 4 | 6.5 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1Cc1ccccc1 | 10.1021/jm049085v | |||
| 44352386 | 18962 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 451 | 8 | 1 | 4 | 7.1 | CCCN(Cc1sc(Nc2c(C)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL128709 | 18962 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 451 | 8 | 1 | 4 | 7.1 | CCCN(Cc1sc(Nc2c(C)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44341635 | 10001 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 333 | 2 | 0 | 2 | 6.2 | CSc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL114914 | 10001 | 1 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 333 | 2 | 0 | 2 | 6.2 | CSc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 46891210 | 6638 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)CC4CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083320 | 6638 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)CC4CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780253 | 6949 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 452 | 6 | 0 | 4 | 6.3 | CCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CCC1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084511 | 6949 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 452 | 6 | 0 | 4 | 6.3 | CCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CCC1 | 10.1016/j.bmcl.2010.04.094 | |||
| 44307870 | 203543 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 377 | 5 | 1 | 5 | 5.2 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66492 | 203543 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 377 | 5 | 1 | 5 | 5.2 | CCC(CC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44307654 | 203567 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 351 | 6 | 1 | 4 | 4.8 | CCCN(CCC)c1[nH]c(C)nc2c(-c3c(C)cc(C)cc3C)nnc1-2 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66719 | 203567 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 351 | 6 | 1 | 4 | 4.8 | CCCN(CCC)c1[nH]c(C)nc2c(-c3c(C)cc(C)cc3C)nnc1-2 | 10.1016/s0960-894x(02)00358-x | |||
| 21916343 | 93380 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 469 | 7 | 0 | 5 | 6.2 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL245671 | 93380 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 469 | 7 | 0 | 5 | 6.2 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 44587491 | 188119 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 371 | 9 | 0 | 5 | 5.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OCC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL498318 | 188119 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 371 | 9 | 0 | 5 | 5.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OCC | 10.1016/j.bmcl.2008.07.063 | |||
| 11235868 | 135184 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 397 | 5 | 0 | 4 | 5.4 | CCC(COC)N1CCc2cn(-c3c(C)cc(Cl)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL372009 | 135184 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 397 | 5 | 0 | 4 | 5.4 | CCC(COC)N1CCc2cn(-c3c(C)cc(Cl)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 44341452 | 9515 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 9 | 0 | 4 | 7.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C(C)C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL112151 | 9515 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 446 | 9 | 0 | 4 | 7.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C(C)C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 9843717 | 66778 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 6 | 0 | 6 | 4.7 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL18590 | 66778 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 396 | 6 | 0 | 6 | 4.7 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| 11166649 | 106425 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 442 | 10 | 0 | 6 | 5.9 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2cc(OC)c(OC)cc2Cl)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3085418 | 106425 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 442 | 10 | 0 | 6 | 5.9 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2cc(OC)c(OC)cc2Cl)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3139572 | 106425 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 442 | 10 | 0 | 6 | 5.9 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2cc(OC)c(OC)cc2Cl)n(C)n1 | 10.1021/jm049339c | |||
| 122193722 | 123963 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 416 | 4 | 1 | 4 | 4.8 | CCN(C)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628742 | 123963 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 416 | 4 | 1 | 4 | 4.8 | CCN(C)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 135444727 | 120224 | 0 | None | -3 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 428 | 3 | 4 | 7 | 2.4 | NCCNC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=N[C@@H]1CCCC[C@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| CHEMBL352154 | 120224 | 0 | None | -3 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 428 | 3 | 4 | 7 | 2.4 | NCCNC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=N[C@@H]1CCCC[C@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| 21916299 | 6406 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 460 | 5 | 0 | 4 | 6.4 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082339 | 6406 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 460 | 5 | 0 | 4 | 6.4 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916288 | 6699 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 546 | 6 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(Cc4ccc(F)cc4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083593 | 6699 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 546 | 6 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(Cc4ccc(F)cc4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 10276375 | 63276 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 459 | 8 | 1 | 4 | 7.5 | CCCN(CCC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL179225 | 63276 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 459 | 8 | 1 | 4 | 7.5 | CCCN(CCC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 20780156 | 123675 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 544 | 8 | 0 | 4 | 8.1 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3ccc(Cl)cc3Cl)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL362124 | 123675 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 544 | 8 | 0 | 4 | 8.1 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3ccc(Cl)cc3Cl)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 46891009 | 6435 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 438 | 3 | 0 | 4 | 6.1 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCCC4C)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082442 | 6435 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 438 | 3 | 0 | 4 | 6.1 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCCC4C)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 10273816 | 19378 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 421 | 7 | 1 | 5 | 5.3 | CCN(CCOC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL129196 | 19378 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 421 | 7 | 1 | 5 | 5.3 | CCN(CCOC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| 44587372 | 187989 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 387 | 10 | 1 | 6 | 4.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OCCO | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL497286 | 187989 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 387 | 10 | 1 | 6 | 4.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OCCO | 10.1016/j.bmcl.2008.07.063 | |||
| 44462061 | 106591 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 425 | 8 | 0 | 5 | 5.0 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CC(F)(F)F)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL314267 | 106591 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 425 | 8 | 0 | 5 | 5.0 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CC(F)(F)F)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 44446732 | 94869 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 334 | 5 | 1 | 3 | 5.7 | CCCNc1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253915 | 94869 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 334 | 5 | 1 | 3 | 5.7 | CCCNc1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 22249005 | 63992 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 355 | 6 | 1 | 3 | 5.8 | CCc1nc(NC(CC)CC)c(F)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807032 | 63992 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 355 | 6 | 1 | 3 | 5.8 | CCc1nc(NC(CC)CC)c(F)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 44446717 | 155431 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 352 | 6 | 0 | 2 | 6.5 | CCCN(CCC)c1c(C)nc(-c2ccccc2Cl)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL403745 | 155431 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 352 | 6 | 0 | 2 | 6.5 | CCCN(CCC)c1c(C)nc(-c2ccccc2Cl)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 10787219 | 205171 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 401 | 5 | 2 | 5 | 5.5 | Cc1cc(C)c(Nc2nc(C)nc(NCc3ccc(C(F)(F)F)cc3)n2)c(C)c1 | 10.1021/jm960148m | |||
| CHEMBL78271 | 205171 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 401 | 5 | 2 | 5 | 5.5 | Cc1cc(C)c(Nc2nc(C)nc(NCc3ccc(C(F)(F)F)cc3)n2)c(C)c1 | 10.1021/jm960148m | |||
| 10787219 | 205171 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 401 | 5 | 2 | 5 | 5.5 | Cc1cc(C)c(Nc2nc(C)nc(NCc3ccc(C(F)(F)F)cc3)n2)c(C)c1 | 10.1021/jm9900117 | |||
| CHEMBL78271 | 205171 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 401 | 5 | 2 | 5 | 5.5 | Cc1cc(C)c(Nc2nc(C)nc(NCc3ccc(C(F)(F)F)cc3)n2)c(C)c1 | 10.1021/jm9900117 | |||
| 9954503 | 67552 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 6 | 0 | 5 | 5.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(C(F)(F)F)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL189780 | 67552 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 6 | 0 | 5 | 5.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(C(F)(F)F)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 10669045 | 58140 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 405 | 7 | 0 | 6 | 4.1 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(C(C)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167853 | 58140 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 405 | 7 | 0 | 6 | 4.1 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(C(C)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| 10647940 | 120723 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 466 | 8 | 0 | 4 | 6.9 | CCN(Cc1ccccc1)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL354791 | 120723 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 466 | 8 | 0 | 4 | 6.9 | CCN(Cc1ccccc1)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 44392709 | 129896 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 420 | 7 | 0 | 6 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N4CCCCC4)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL367583 | 129896 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 420 | 7 | 0 | 6 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N4CCCCC4)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44308187 | 204052 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 375 | 3 | 1 | 5 | 5.0 | Cc1nc(NC2CCCC2)c2nn(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL69968 | 204052 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 375 | 3 | 1 | 5 | 5.0 | Cc1nc(NC2CCCC2)c2nn(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(02)00358-x | |||
| 20780144 | 150989 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 443 | 8 | 0 | 5 | 6.2 | CCCN(Cc1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL395833 | 150989 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 443 | 8 | 0 | 5 | 6.2 | CCCN(Cc1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 11454873 | 140755 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 6.5 | COc1ccccc1COc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL381824 | 140755 | 0 | None | - | 1 | Rat | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 6.5 | COc1ccccc1COc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44446724 | 94807 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 414 | 9 | 0 | 4 | 6.4 | CCCN(CCC)c1c(C)nc(-c2ccc(OC(F)F)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253493 | 94807 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 414 | 9 | 0 | 4 | 6.4 | CCCN(CCC)c1c(C)nc(-c2ccc(OC(F)F)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 11485413 | 166155 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 5 | 1 | 6 | 4.2 | Cc1cc(NC(C)C(C)C)n2nc(C)c(-c3cnc(N(C)C)cc3C)c2n1 | 10.1021/jm040058e | |||
| CHEMBL426260 | 166155 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 366 | 5 | 1 | 6 | 4.2 | Cc1cc(NC(C)C(C)C)n2nc(C)c(-c3cnc(N(C)C)cc3C)c2n1 | 10.1021/jm040058e | |||
| 22249061 | 63980 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 359 | 9 | 1 | 7 | 3.7 | CCc1nc(-c2cnc(OC)nc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807020 | 63980 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 359 | 9 | 1 | 7 | 3.7 | CCc1nc(-c2cnc(OC)nc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 44384750 | 131801 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 395 | 7 | 1 | 6 | 4.7 | CCCCC(CC)Nc1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL369371 | 131801 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 395 | 7 | 1 | 6 | 4.7 | CCCCC(CC)Nc1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| 44266437 | 208408 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 477 | 5 | 0 | 3 | 7.5 | CCN(c1nc(C)cc(-c2cccc(C(F)(F)F)c2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL9975 | 208408 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 477 | 5 | 0 | 3 | 7.5 | CCN(c1nc(C)cc(-c2cccc(C(F)(F)F)c2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 11429605 | 124537 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 404 | 4 | 0 | 5 | 4.5 | CCC(CC)N1CCn2c(=O)n(-c3ccc(C(F)(F)F)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL364037 | 124537 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 404 | 4 | 0 | 5 | 4.5 | CCC(CC)N1CCn2c(=O)n(-c3ccc(C(F)(F)F)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44341983 | 9539 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.5 | CCCCNc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112266 | 9539 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.5 | CCCCNc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 21916286 | 6703 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 488 | 7 | 0 | 4 | 7.1 | CCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083608 | 6703 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 488 | 7 | 0 | 4 | 7.1 | CCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 46891057 | 7283 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 426 | 3 | 0 | 5 | 4.6 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCOCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086016 | 7283 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 426 | 3 | 0 | 5 | 4.6 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCOCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780039 | 6690 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 444 | 7 | 0 | 4 | 5.8 | CCCN(CCc1ccccc1)C(=O)c1c(C)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1083513 | 6690 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 444 | 7 | 0 | 4 | 5.8 | CCCN(CCc1ccccc1)C(=O)c1c(C)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 10785716 | 28291 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 375 | 8 | 1 | 5 | 5.1 | CCc1cccc(CC)c1Nc1nc(C)nc(N(CC)Cc2ccccc2)n1 | 10.1021/jm960148m | |||
| CHEMBL137434 | 28291 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 375 | 8 | 1 | 5 | 5.1 | CCc1cccc(CC)c1Nc1nc(C)nc(N(CC)Cc2ccccc2)n1 | 10.1021/jm960148m | |||
| 44446737 | 155608 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 459 | 10 | 0 | 4 | 6.9 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCCC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL404559 | 155608 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 459 | 10 | 0 | 4 | 6.9 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCCC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44443658 | 154919 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 489 | 9 | 2 | 6 | 6.1 | CCc1nc(N[C@@H]2c3ccccc3C[C@@H]2OCCF)c(CC)nc1Nc1ncc(Cl)cc1Cl | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL400952 | 154919 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 489 | 9 | 2 | 6 | 6.1 | CCc1nc(N[C@@H]2c3ccccc3C[C@@H]2OCCF)c(CC)nc1Nc1ncc(Cl)cc1Cl | 10.1016/j.bmcl.2007.09.008 | |||
| 44307479 | 203555 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 389 | 3 | 1 | 5 | 5.4 | Cc1nc(NC2CCCCC2)c2nn(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66631 | 203555 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 389 | 3 | 1 | 5 | 5.4 | Cc1nc(NC2CCCCC2)c2nn(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(02)00358-x | |||
| 44407869 | 75117 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 5.5 | Cc1ccc(S(=O)(=O)c2c(C)cc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL203609 | 75117 | 0 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 5.5 | Cc1ccc(S(=O)(=O)c2c(C)cc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44379386 | 120753 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 465 | 11 | 0 | 7 | 4.3 | CCN(c1nc(C)nc(N(CCOC)CCOC)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| CHEMBL355055 | 120753 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 465 | 11 | 0 | 7 | 4.3 | CCN(c1nc(C)nc(N(CCOC)CCOC)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| 44341823 | 10006 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 434 | 9 | 0 | 5 | 5.9 | CCCCN(CCCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL114928 | 10006 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 434 | 9 | 0 | 5 | 5.9 | CCCCN(CCCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 20780123 | 195612 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 451 | 9 | 0 | 5 | 6.7 | CCCCN(CCCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL556060 | 195612 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 451 | 9 | 0 | 5 | 6.7 | CCCCN(CCCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 44379486 | 120032 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm049737f | |||
| CHEMBL350356 | 120032 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm049737f | |||
| 18691318 | 97160 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 423 | 5 | 0 | 3 | 6.8 | CCN(c1nc(C)cc(-c2ccccc2C)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL268043 | 97160 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 423 | 5 | 0 | 3 | 6.8 | CCN(c1nc(C)cc(-c2ccccc2C)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 135958362 | 58166 | 0 | None | -2 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 482 | 2 | 4 | 7 | 3.7 | N[C@@H]1CCCC[C@H]1NC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=N[C@H]1CCCC[C@@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| CHEMBL168162 | 58166 | 0 | None | -2 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 482 | 2 | 4 | 7 | 3.7 | N[C@@H]1CCCC[C@H]1NC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=N[C@H]1CCCC[C@@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| 44392788 | 123751 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 387 | 6 | 0 | 4 | 5.8 | CCCN(c1ccccc1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL362224 | 123751 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 387 | 6 | 0 | 4 | 5.8 | CCCN(c1ccccc1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 44341612 | 110674 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 446 | 10 | 0 | 4 | 7.5 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CCC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL325960 | 110674 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 446 | 10 | 0 | 4 | 7.5 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CCC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 20779996 | 6590 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 450 | 5 | 0 | 5 | 5.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)Cc4ccco4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083101 | 6590 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 450 | 5 | 0 | 5 | 5.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)Cc4ccco4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 122193721 | 123962 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 402 | 3 | 1 | 4 | 4.4 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2 | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628741 | 123962 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 402 | 3 | 1 | 4 | 4.4 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2 | 10.1016/j.bmcl.2015.10.010 | |||
| 10204577 | 122027 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 454 | 5 | 1 | 5 | 6.7 | CCc1nccn1Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL359494 | 122027 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 454 | 5 | 1 | 5 | 6.7 | CCc1nccn1Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 44389071 | 63354 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 426 | 4 | 1 | 5 | 6.1 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1Cn1ccnc1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL179480 | 63354 | 0 | None | - | 1 | Human | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | 426 | 4 | 1 | 5 | 6.1 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1Cn1ccnc1 | 10.1016/j.bmcl.2004.10.055 | |||
| 11141163 | 163605 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1ccc(Cl)cc1)NNc1ccccc1C | 10.1021/jm025512y | |||
| CHEMBL420361 | 163605 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1ccc(Cl)cc1)NNc1ccccc1C | 10.1021/jm025512y | |||
| 10663467 | 57509 | 1 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 319 | 3 | 0 | 3 | 4.2 | CCc1ccc(N(C)c2nc(C)cc(C)n2)c(Br)c1 | 10.1021/jm980222w | |||
| CHEMBL166102 | 57509 | 1 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 319 | 3 | 0 | 3 | 4.2 | CCc1ccc(N(C)c2nc(C)cc(C)n2)c(Br)c1 | 10.1021/jm980222w | |||
| 44379486 | 120032 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL350356 | 120032 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 44392644 | 123021 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 355 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(F)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL360905 | 123021 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 355 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(F)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44306220 | 100869 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 381 | 9 | 0 | 5 | 4.9 | CCCN(c1ncc(C)c(-c2ccc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL293627 | 100869 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 381 | 9 | 0 | 5 | 4.9 | CCCN(c1ncc(C)c(-c2ccc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 46881397 | 7503 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 6 | 0 | 4 | 5.2 | C=CCN(CC=C)C(=O)c1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087167 | 7503 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 6 | 0 | 4 | 5.2 | C=CCN(CC=C)C(=O)c1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 10111096 | 63985 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 391 | 8 | 0 | 3 | 6.2 | CCCN(CC1CC1)c1nc(CC)c(-c2ccc(Cl)cc2Cl)nc1CC | 10.1021/jm200365y | |||
| CHEMBL1807025 | 63985 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 391 | 8 | 0 | 3 | 6.2 | CCCN(CC1CC1)c1nc(CC)c(-c2ccc(Cl)cc2Cl)nc1CC | 10.1021/jm200365y | |||
| 10694719 | 59055 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 446 | 6 | 1 | 8 | 3.8 | CCC(Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br)C(=O)OC | 10.1021/jm980224g | |||
| CHEMBL169460 | 59055 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 446 | 6 | 1 | 8 | 3.8 | CCC(Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br)C(=O)OC | 10.1021/jm980224g | |||
| 11568262 | 70285 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 434 | 4 | 0 | 4 | 6.1 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL194295 | 70285 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 434 | 4 | 0 | 4 | 6.1 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11713460 | 135572 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 414 | 4 | 0 | 4 | 6.1 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC1CCC1 | 10.1021/jm049085v | |||
| CHEMBL372905 | 135572 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 414 | 4 | 0 | 4 | 6.1 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC1CCC1 | 10.1021/jm049085v | |||
| 44462060 | 205905 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 385 | 9 | 0 | 5 | 4.9 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CCC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL83970 | 205905 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 385 | 9 | 0 | 5 | 4.9 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CCC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 11441545 | 67579 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 420 | 5 | 0 | 6 | 4.1 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(C(F)(F)F)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL190037 | 67579 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 420 | 5 | 0 | 6 | 4.1 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(C(F)(F)F)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 21916311 | 7300 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 5 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCC4Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086061 | 7300 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 500 | 5 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCC4Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11188091 | 168423 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 5.7 | CCCC(CCC)N1CCc2cn(-c3cccc(OC)c3)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL434910 | 168423 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 5.7 | CCCC(CCC)N1CCc2cn(-c3cccc(OC)c3)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 44392777 | 65484 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 401 | 10 | 1 | 7 | 3.5 | CCCN(CC1CC1)c1cc(C(O)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL183037 | 65484 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 401 | 10 | 1 | 7 | 3.5 | CCCN(CC1CC1)c1cc(C(O)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 44392750 | 125518 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 415 | 10 | 1 | 7 | 3.7 | CCCN(CC1CC1)c1cc(C(C)(O)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL364640 | 125518 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 415 | 10 | 1 | 7 | 3.7 | CCCN(CC1CC1)c1cc(C(C)(O)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 46890889 | 6597 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 475 | 6 | 0 | 5 | 5.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4cccnc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083119 | 6597 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 475 | 6 | 0 | 5 | 5.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4cccnc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 46890950 | 7299 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 556 | 8 | 0 | 4 | 7.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCc4ccccc4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086059 | 7299 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 556 | 8 | 0 | 4 | 7.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCc4ccccc4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11223591 | 68612 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 409 | 7 | 0 | 3 | 6.7 | CCCC(CCC)N1CCc2cn(Cc3ccc(Cl)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL191780 | 68612 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 409 | 7 | 0 | 3 | 6.7 | CCCC(CCC)N1CCc2cn(Cc3ccc(Cl)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 20780284 | 63503 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 380 | 8 | 0 | 4 | 5.1 | CCCN(Cc1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL179985 | 63503 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 380 | 8 | 0 | 4 | 5.1 | CCCN(Cc1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| 44389113 | 64612 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 474 | 8 | 1 | 5 | 6.2 | CCN(CCN(C)C)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181732 | 64612 | 0 | None | - | 1 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 474 | 8 | 1 | 5 | 6.2 | CCN(CCN(C)C)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 44307893 | 203475 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 335 | 3 | 1 | 5 | 4.1 | CCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66052 | 203475 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 335 | 3 | 1 | 5 | 4.1 | CCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 10501205 | 59086 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 400 | 3 | 0 | 6 | 4.0 | Cc1nc(N2CCCC2)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| CHEMBL169629 | 59086 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 400 | 3 | 0 | 6 | 4.0 | Cc1nc(N2CCCC2)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| 10741433 | 120368 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 432 | 6 | 1 | 7 | 4.2 | COCC(C)(C)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL353238 | 120368 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 432 | 6 | 1 | 7 | 4.2 | COCC(C)(C)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 11078292 | 168210 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 339 | 4 | 2 | 3 | 4.1 | CC(=O)/C(=N\c1cccc(F)c1)NNc1ccccc1C(F)(F)F | 10.1021/jm025512y | |||
| CHEMBL433505 | 168210 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 339 | 4 | 2 | 3 | 4.1 | CC(=O)/C(=N\c1cccc(F)c1)NNc1ccccc1C(F)(F)F | 10.1021/jm025512y | |||
| 11474959 | 75298 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 4.9 | COc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL203744 | 75298 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 4.9 | COc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| 10028059 | 102886 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 6.9 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1Br | 10.1021/jm9900117 | |||
| CHEMBL305900 | 102886 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 6.9 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1Br | 10.1021/jm9900117 | |||
| CHEMBL2372950 | 210321 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | None | None | None | CCCC[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](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCC)NC(=O)[C@H](CCCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(C)=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](N)Cc2ccccc2)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N1)C(=O)CN[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm034180+ | |||||
| 9843598 | 67776 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL190845 | 67776 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 10835052 | 58090 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 403 | 7 | 0 | 3 | 6.7 | CCC(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167407 | 58090 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 403 | 7 | 0 | 3 | 6.7 | CCC(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL263451 | 210572 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H](N)Cc2ccccc2)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc2c[nH]cn2)C(=O)N1)[C@@H](C)CC)C(N)=O | 10.1021/jm990590f | |||||
| 10344587 | 167844 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL1762817 | 167844 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2013.02.009 | |||
| CHEMBL430892 | 167844 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2013.02.009 | |||
| 10344587 | 167844 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL1762817 | 167844 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| CHEMBL430892 | 167844 | 0 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 467 | 8 | 0 | 7 | 3.9 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Br)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2012.08.112 | |||
| 44341832 | 9418 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL111665 | 9418 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 44341832 | 9418 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL111665 | 9418 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 44307738 | 100813 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| CHEMBL293228 | 100813 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| 44307491 | 102292 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| CHEMBL303380 | 102292 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| 44307738 | 100813 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL293228 | 100813 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44307491 | 102292 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL303380 | 102292 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 3533 | 1206 | 24 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1016/j.bmcl.2008.07.063 | |||
| 5282340 | 1206 | 24 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL291657 | 1206 | 24 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1016/j.bmcl.2008.07.063 | |||
| 42618174 | 193334 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 385 | 8 | 1 | 8 | 2.8 | COCC(COC)Nc1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL524616 | 193334 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 385 | 8 | 1 | 8 | 2.8 | COCC(COC)Nc1nc(C)nc2c(-c3ccc(OC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2008.07.063 | |||
| 44587375 | 193400 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 393 | 9 | 0 | 6 | 4.8 | CCCN(CCC)c1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL525716 | 193400 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 393 | 9 | 0 | 6 | 4.8 | CCCN(CCC)c1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 10028059 | 102886 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 6.9 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1Br | 10.1021/jm960149e | |||
| CHEMBL305900 | 102886 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 6.9 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1Br | 10.1021/jm960149e | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm049339c | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm049339c | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1021/jm049339c | |||
| 44341581 | 9991 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.1 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL114861 | 9991 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.1 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 44341877 | 110465 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 412 | 8 | 0 | 4 | 6.6 | CCCCN(CCCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL324728 | 110465 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 412 | 8 | 0 | 4 | 6.6 | CCCCN(CCCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 127033261 | 138474 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 3992 | 134 | 55 | 49 | -7.3 | CCCCCCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3774713 | 138474 | 0 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 3992 | 134 | 55 | 49 | -7.3 | CCCCCCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(CCCC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]1CCC(=O)NCCCC[C@@H](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](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC)NC(=O)C(C)(C)NC(=O)[C@H](C)NC1=O)C(C)C)[C@@H](C)O | 10.1021/acs.jmedchem.5b00926 | |||
| 10739593 | 58995 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 397 | 8 | 0 | 6 | 5.6 | CCCCN(CC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1SC | 10.1021/jm980224g | |||
| CHEMBL169010 | 58995 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 397 | 8 | 0 | 6 | 5.6 | CCCCN(CC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1SC | 10.1021/jm980224g | |||
| 44342074 | 9940 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 372 | 6 | 0 | 2 | 6.8 | CCCN(CC1CC1)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL114596 | 9940 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 372 | 6 | 0 | 2 | 6.8 | CCCN(CC1CC1)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 22249054 | 64007 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 397 | 8 | 1 | 5 | 5.3 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(OC)cc1C(F)(F)F | 10.1021/jm200365y | |||
| CHEMBL1807051 | 64007 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 397 | 8 | 1 | 5 | 5.3 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(OC)cc1C(F)(F)F | 10.1021/jm200365y | |||
| 11291949 | 127509 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL366155 | 127509 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44375151 | 56658 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL164206 | 56658 | 0 | None | - | 1 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| 9801874 | 102972 | 1 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 412 | 7 | 1 | 4 | 6.4 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm960149e | |||
| CHEMBL306482 | 102972 | 1 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 412 | 7 | 1 | 4 | 6.4 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm960149e | |||
| 9801874 | 102972 | 1 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 412 | 7 | 1 | 4 | 6.4 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm9900117 | |||
| CHEMBL306482 | 102972 | 1 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 412 | 7 | 1 | 4 | 6.4 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm9900117 | |||
| 11247393 | 66813 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.1 | CCN(Cc1ccc(C)cc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL186033 | 66813 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.1 | CCN(Cc1ccc(C)cc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44347137 | 14935 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 394 | 8 | 0 | 6 | 4.7 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL120823 | 14935 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 394 | 8 | 0 | 6 | 4.7 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 44347202 | 113514 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 7 | 0 | 5 | 4.6 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL332101 | 113514 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 7 | 0 | 5 | 4.6 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 9950788 | 110516 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 360 | 6 | 0 | 2 | 6.8 | CCCCN(CC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL325047 | 110516 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 360 | 6 | 0 | 2 | 6.8 | CCCCN(CC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 10095518 | 4379 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 454 | 6 | 0 | 5 | 6.4 | CCN(c1nc(C)cc(-c2ccccc2[N+](=O)[O-])n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10125 | 4379 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 454 | 6 | 0 | 5 | 6.4 | CCN(c1nc(C)cc(-c2ccccc2[N+](=O)[O-])n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10027220 | 66865 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.0 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL186252 | 66865 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.0 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 122193720 | 123961 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 508 | 6 | 0 | 4 | 5.7 | CCCCN(CC)c1cc(C)nc2c1N(C)C(=O)CN2c1ccc(Br)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628740 | 123961 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 508 | 6 | 0 | 4 | 5.7 | CCCCN(CC)c1cc(C)nc2c1N(C)C(=O)CN2c1ccc(Br)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 11430299 | 66732 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.1 | CCN(Cc1cccc(C)c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL185705 | 66732 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.1 | CCN(Cc1cccc(C)c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 11224120 | 123301 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.1 | CCN(Cc1ccccc1C)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL361509 | 123301 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 5.1 | CCN(Cc1ccccc1C)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44341874 | 9918 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 412 | 6 | 0 | 2 | 7.5 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL114422 | 9918 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 412 | 6 | 0 | 2 | 7.5 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 177990 | 426 | 23 | None | 1 | 2 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/s0960-894x(00)00071-8 | |||
| 3489 | 426 | 23 | None | 1 | 2 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL296641 | 426 | 23 | None | 1 | 2 | Rat | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1016/s0960-894x(00)00071-8 | |||
| 15490822 | 98266 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 481 | 5 | 0 | 4 | 7.1 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(SC)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL274578 | 98266 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 481 | 5 | 0 | 4 | 7.1 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(SC)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 90231885 | 123951 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 444 | 7 | 1 | 4 | 5.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1CC | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628729 | 123951 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 444 | 7 | 1 | 4 | 5.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1CC | 10.1016/j.bmcl.2015.10.010 | |||
| 90231897 | 123952 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 450 | 6 | 1 | 4 | 5.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628730 | 123952 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 450 | 6 | 1 | 4 | 5.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 22249128 | 64015 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 399 | 9 | 1 | 5 | 5.6 | CCc1nc(-c2ccc(OC(F)F)cc2Cl)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807059 | 64015 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 399 | 9 | 1 | 5 | 5.6 | CCc1nc(-c2ccc(OC(F)F)cc2Cl)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 10787254 | 204885 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 400 | 7 | 1 | 4 | 6.4 | CCCN(CCC)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm960149e | |||
| CHEMBL75859 | 204885 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 400 | 7 | 1 | 4 | 6.4 | CCCN(CCC)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm960149e | |||
| 10787254 | 204885 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 400 | 7 | 1 | 4 | 6.4 | CCCN(CCC)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm9900117 | |||
| CHEMBL75859 | 204885 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 400 | 7 | 1 | 4 | 6.4 | CCCN(CCC)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1C | 10.1021/jm9900117 | |||
| 11465828 | 66762 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 482 | 6 | 0 | 6 | 6.1 | CCN(Cc1ccc(Cl)c(Cl)c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL185858 | 66762 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 482 | 6 | 0 | 6 | 6.1 | CCN(Cc1ccc(Cl)c(Cl)c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 177990 | 426 | 23 | None | -1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm049085v | |||
| 3489 | 426 | 23 | None | -1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm049085v | |||
| CHEMBL296641 | 426 | 23 | None | -1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm049085v | |||
| 44347046 | 114545 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 377 | 6 | 0 | 3 | 6.5 | CCCCN(CC)c1cc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL333713 | 114545 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 377 | 6 | 0 | 3 | 6.5 | CCCCN(CC)c1cc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2004.05.056 | |||
| 44347046 | 114545 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 377 | 6 | 0 | 3 | 6.5 | CCCCN(CC)c1cc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL333713 | 114545 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 377 | 6 | 0 | 3 | 6.5 | CCCCN(CC)c1cc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2004.05.019 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2015.10.010 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2015.10.010 | |||
| 11773421 | 66088 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCCN(CC)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL183845 | 66088 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCCN(CC)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 11326815 | 67561 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 392 | 7 | 0 | 6 | 4.4 | CCCN(CC1CC1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL189821 | 67561 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 392 | 7 | 0 | 6 | 4.4 | CCCN(CC1CC1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm960861b | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm960861b | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm960861b | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2004.05.072 | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2004.05.072 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(99)00132-8 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(99)00132-8 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2005.05.117 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2005.05.117 | |||
| 90231888 | 123953 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 450 | 6 | 1 | 4 | 5.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1Cl | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628731 | 123953 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 450 | 6 | 1 | 4 | 5.5 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1Cl | 10.1016/j.bmcl.2015.10.010 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(02)00358-x | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(02)00358-x | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2007.12.050 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2007.12.050 | |||
| 11306178 | 78326 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCC[C@@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 11306179 | 78326 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCC[C@@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2094063 | 78326 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCC[C@@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2109725 | 78326 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCC[C@@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm990590f | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm990590f | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1021/jm990590f | |||
| 10788803 | 57577 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 430 | 7 | 1 | 6 | 5.4 | CCCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL166669 | 57577 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 430 | 7 | 1 | 6 | 5.4 | CCCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341879 | 9886 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 398 | 8 | 0 | 4 | 6.3 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(C)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL114273 | 9886 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 398 | 8 | 0 | 4 | 6.3 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(C)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 44290322 | 101170 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm990590f | |||
| CHEMBL295563 | 101170 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 382 | 8 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm990590f | |||
| 10646985 | 57827 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 444 | 8 | 0 | 5 | 6.4 | CCCCC(CC)Oc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL167017 | 57827 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 444 | 8 | 0 | 5 | 6.4 | CCCCC(CC)Oc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 11282181 | 67351 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 442 | 8 | 0 | 6 | 5.6 | CCCCN(Cc1ccccc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL188566 | 67351 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 442 | 8 | 0 | 6 | 5.6 | CCCCN(Cc1ccccc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 9802053 | 124194 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.4 | CCCC(CCC)N1CCc2nn(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL363414 | 124194 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.4 | CCCC(CCC)N1CCc2nn(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 11326483 | 67779 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 380 | 5 | 0 | 6 | 3.8 | CCC(CC)N1CCn2c(=O)n(-c3ccc(OC)cc3C)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL190881 | 67779 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 380 | 5 | 0 | 6 | 3.8 | CCC(CC)N1CCn2c(=O)n(-c3ccc(OC)cc3C)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 21916279 | 165803 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 414 | 7 | 0 | 4 | 6.1 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL424812 | 165803 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 414 | 7 | 0 | 4 | 6.1 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10810752 | 57499 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 396 | 7 | 0 | 6 | 4.3 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| CHEMBL165991 | 57499 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 396 | 7 | 0 | 6 | 4.3 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| 10710543 | 58506 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 316 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1ccc(N(C)C)cc1SC | 10.1021/jm980222w | |||
| CHEMBL168360 | 58506 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 316 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1ccc(N(C)C)cc1SC | 10.1021/jm980222w | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| 44307747 | 203585 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3c(Cl)cccc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66831 | 203585 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1nc(C)nc2c(-c3c(Cl)cccc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 20780178 | 93799 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 435 | 6 | 0 | 5 | 5.9 | CCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247558 | 93799 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 435 | 6 | 0 | 5 | 5.9 | CCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 11153216 | 125834 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)cnn12 | 10.1021/jm040058e | |||
| CHEMBL364828 | 125834 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)cnn12 | 10.1021/jm040058e | |||
| 10504455 | 58724 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 466 | 6 | 0 | 6 | 4.7 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(Br)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168531 | 58724 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 466 | 6 | 0 | 6 | 4.7 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(Br)cc1Br | 10.1021/jm980224g | |||
| 15490823 | 98449 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 513 | 5 | 0 | 5 | 5.8 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(S(C)(=O)=O)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL275738 | 98449 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 513 | 5 | 0 | 5 | 5.8 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(S(C)(=O)=O)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10500190 | 58787 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 8 | 0 | 7 | 3.1 | COCCN(CCOC)c1nc(C)nc2c1ncn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL168788 | 58787 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 383 | 8 | 0 | 7 | 3.1 | COCCN(CCOC)c1nc(C)nc2c1ncn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 10736859 | 120331 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 354 | 6 | 0 | 7 | 2.9 | CCN(CCOC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL352916 | 120331 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 354 | 6 | 0 | 7 | 2.9 | CCN(CCOC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 136216702 | 78621 | 0 | None | -2 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 428 | 3 | 4 | 7 | 2.7 | NCCNC(=O)c1c2c(c3c4c(ncnc14)-c1ccccc1C3=O)N[C@H]1CCCC[C@@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| CHEMBL2112326 | 78621 | 0 | None | -2 | 2 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 428 | 3 | 4 | 7 | 2.7 | NCCNC(=O)c1c2c(c3c4c(ncnc14)-c1ccccc1C3=O)N[C@H]1CCCC[C@@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| 11222924 | 67601 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 386 | 5 | 0 | 6 | 3.7 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(Cl)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL190262 | 67601 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 386 | 5 | 0 | 6 | 3.7 | CCCC(OC)N1CCn2c(=O)n(-c3ccc(Cl)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44392772 | 122979 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 351 | 7 | 0 | 4 | 4.6 | CCCN(CC1CC1)c1cc(C(=O)c2c(C)cc(C)cc2C)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL360845 | 122979 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 351 | 7 | 0 | 4 | 4.6 | CCCN(CC1CC1)c1cc(C(=O)c2c(C)cc(C)cc2C)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 44305974 | 102845 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 425 | 9 | 0 | 7 | 5.1 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1(c2ccsc2)CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL305583 | 102845 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 425 | 9 | 0 | 7 | 5.1 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1(c2ccsc2)CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 10761294 | 120395 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 364 | 2 | 0 | 5 | 4.1 | Cc1cc(C)c(-n2c(C)c(C)c3c(N4CCOCC4)nc(C)nc32)c(C)c1 | 10.1021/jm980224g | |||
| CHEMBL353425 | 120395 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 364 | 2 | 0 | 5 | 4.1 | Cc1cc(C)c(-n2c(C)c(C)c3c(N4CCOCC4)nc(C)nc32)c(C)c1 | 10.1021/jm980224g | |||
| 9980256 | 94417 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.7 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC(C)=O | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL251034 | 94417 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.7 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC(C)=O | 10.1016/j.bmcl.2007.09.008 | |||
| 10551475 | 120778 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 448 | 9 | 0 | 8 | 3.2 | COCCN(CCOC)c1ncnc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL355394 | 120778 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 448 | 9 | 0 | 8 | 3.2 | COCCN(CCOC)c1ncnc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44317962 | 205627 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 462 | 7 | 1 | 3 | 6.5 | O=C(CCc1ccncc1)C(Nc1ccc(Cl)cc1Cl)c1ccccc1Br | 10.1021/jm049974i | |||
| CHEMBL81726 | 205627 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 462 | 7 | 1 | 3 | 6.5 | O=C(CCc1ccncc1)C(Nc1ccc(Cl)cc1Cl)c1ccccc1Br | 10.1021/jm049974i | |||
| 135884427 | 57175 | 0 | None | -3 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 374 | 3 | 4 | 7 | 1.1 | NCCNC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=NCCN2 | 10.1016/s0960-894x(99)00075-x | |||
| CHEMBL164829 | 57175 | 0 | None | -3 | 2 | Rat | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 374 | 3 | 4 | 7 | 1.1 | NCCNC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=NCCN2 | 10.1016/s0960-894x(99)00075-x | |||
| 44318122 | 205828 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 371 | 8 | 0 | 5 | 4.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL83385 | 205828 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 371 | 8 | 0 | 5 | 4.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 44352382 | 116728 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 475 | 8 | 1 | 4 | 6.9 | CCCN(Cc1sc(Nc2c(C)cc(C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL337409 | 116728 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 475 | 8 | 1 | 4 | 6.9 | CCCN(Cc1sc(Nc2c(C)cc(C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 21916208 | 67339 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 428 | 8 | 0 | 4 | 6.4 | CCCN(Cc1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL188523 | 67339 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 428 | 8 | 0 | 4 | 6.4 | CCCN(Cc1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10717814 | 120347 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 436 | 10 | 0 | 10 | 2.3 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL353050 | 120347 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 436 | 10 | 0 | 10 | 2.3 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 10254503 | 9732 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 6.9 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Br)cc2Cl)c1Cl | 10.1016/s0960-894x(00)00661-2 | |||
| CHEMBL113333 | 9732 | 0 | None | - | 1 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 1 | 4 | 6.9 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Br)cc2Cl)c1Cl | 10.1016/s0960-894x(00)00661-2 | |||
| 21916260 | 6591 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 502 | 8 | 0 | 4 | 7.2 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083102 | 6591 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 502 | 8 | 0 | 4 | 7.2 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916302 | 7664 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 448 | 7 | 0 | 4 | 6.4 | CCCN(Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C)CC1CCC1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1088478 | 7664 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 448 | 7 | 0 | 4 | 6.4 | CCCN(Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C)CC1CCC1 | 10.1016/j.bmcl.2010.01.127 | |||
| 44446720 | 94779 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 366 | 6 | 0 | 2 | 6.8 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253287 | 94779 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 366 | 6 | 0 | 2 | 6.8 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 11393576 | 123794 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 337 | 6 | 0 | 5 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL362305 | 123794 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 337 | 6 | 0 | 5 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| 10552046 | 120791 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 462 | 8 | 0 | 8 | 3.5 | COCC(COC)N(C)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL355494 | 120791 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 462 | 8 | 0 | 8 | 3.5 | COCC(COC)N(C)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 122193727 | 123967 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 0 | 4 | 5.6 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2CCCCF | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628746 | 123967 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 476 | 7 | 0 | 4 | 5.6 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2CCCCF | 10.1016/j.bmcl.2015.10.010 | |||
| 11795486 | 120413 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 403 | 6 | 1 | 6 | 4.1 | COCCNc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL353662 | 120413 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 403 | 6 | 1 | 6 | 4.1 | COCCNc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44315264 | 205090 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.5 | Cc1cc(C)c(Nc2nc(C)nc(N(C)CCc3ccccc3)n2)c(C)c1 | 10.1021/jm960148m | |||
| CHEMBL77527 | 205090 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.5 | Cc1cc(C)c(Nc2nc(C)nc(N(C)CCc3ccccc3)n2)c(C)c1 | 10.1021/jm960148m | |||
| 44315264 | 205090 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.5 | Cc1cc(C)c(Nc2nc(C)nc(N(C)CCc3ccccc3)n2)c(C)c1 | 10.1021/jm9900117 | |||
| CHEMBL77527 | 205090 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 361 | 6 | 1 | 5 | 4.5 | Cc1cc(C)c(Nc2nc(C)nc(N(C)CCc3ccccc3)n2)c(C)c1 | 10.1021/jm9900117 | |||
| 44443597 | 93991 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 348 | 6 | 1 | 5 | 5.2 | CCC(Nc1nc(C)c(Oc2cc(C)ccn2)nc1C)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248623 | 93991 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 348 | 6 | 1 | 5 | 5.2 | CCC(Nc1nc(C)c(Oc2cc(C)ccn2)nc1C)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 44443649 | 154407 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 430 | 8 | 1 | 6 | 5.4 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC1CC1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL398843 | 154407 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 430 | 8 | 1 | 6 | 5.4 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC1CC1 | 10.1016/j.bmcl.2007.09.008 | |||
| 44446734 | 155607 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 431 | 8 | 0 | 4 | 6.1 | CCCN(CCN1CCCC1)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL404558 | 155607 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 431 | 8 | 0 | 4 | 6.1 | CCCN(CCN1CCCC1)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 1799074 | 203777 | 3 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 4.1 | CC(=O)/C(=N\Nc1ccccc1C)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| CHEMBL68118 | 203777 | 3 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 4.1 | CC(=O)/C(=N\Nc1ccccc1C)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| 44305524 | 203411 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 392 | 6 | 0 | 5 | 5.5 | CCCCN(OC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL65574 | 203411 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 392 | 6 | 0 | 5 | 5.5 | CCCCN(OC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 11795560 | 57688 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 5.7 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL166890 | 57688 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 5.7 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10741540 | 58128 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 434 | 9 | 0 | 5 | 5.3 | CCN(CCOC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167737 | 58128 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 434 | 9 | 0 | 5 | 5.3 | CCN(CCOC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10549990 | 168070 | 0 | None | -1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 418 | 5 | 0 | 5 | 4.7 | CCN(c1nc(C)cc(N2CCOCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| CHEMBL432496 | 168070 | 0 | None | -1 | 2 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 418 | 5 | 0 | 5 | 4.7 | CCN(c1nc(C)cc(N2CCOCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| 10766371 | 59362 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 459 | 11 | 0 | 7 | 5.8 | CCCCc1nc2c(N(CC)CCCC)nc(C)nc2n1-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL170791 | 59362 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 459 | 11 | 0 | 7 | 5.8 | CCCCc1nc2c(N(CC)CCCC)nc(C)nc2n1-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 10549990 | 168070 | 0 | None | 1 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 418 | 5 | 0 | 5 | 4.7 | CCN(c1nc(C)cc(N2CCOCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| CHEMBL432496 | 168070 | 0 | None | 1 | 2 | Rat | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 418 | 5 | 0 | 5 | 4.7 | CCN(c1nc(C)cc(N2CCOCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| 10048452 | 94029 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 8 | 1 | 6 | 5.5 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)cc(C)n2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248785 | 94029 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 8 | 1 | 6 | 5.5 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)cc(C)n2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 9980267 | 94443 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 8 | 1 | 6 | 5.6 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC(C)C | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL251200 | 94443 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 432 | 8 | 1 | 6 | 5.6 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC(C)C | 10.1016/j.bmcl.2007.09.008 | |||
| 10133826 | 193335 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 371 | 9 | 0 | 5 | 5.0 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL524617 | 193335 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 371 | 9 | 0 | 5 | 5.0 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 11178282 | 106424 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 408 | 10 | 0 | 6 | 5.3 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3085417 | 106424 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 408 | 10 | 0 | 6 | 5.3 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3139571 | 106424 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 408 | 10 | 0 | 6 | 5.3 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 44337305 | 5307 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 358 | 7 | 0 | 4 | 4.8 | CCCN(c1nc(-c2ccc(Cl)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL106675 | 5307 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 358 | 7 | 0 | 4 | 4.8 | CCCN(c1nc(-c2ccc(Cl)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 44392681 | 64525 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 339 | 6 | 1 | 4 | 4.9 | CCC(CC)Nc1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL181439 | 64525 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 339 | 6 | 1 | 4 | 4.9 | CCC(CC)Nc1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 20780282 | 63783 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 380 | 6 | 0 | 4 | 4.5 | CCCN(CC1CC1)C(=O)c1c(C)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL180178 | 63783 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 380 | 6 | 0 | 4 | 4.5 | CCCN(CC1CC1)C(=O)c1c(C)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780038 | 65609 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 436 | 7 | 0 | 4 | 5.3 | CCCN(CCC(F)(F)F)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL183348 | 65609 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 436 | 7 | 0 | 4 | 5.3 | CCCN(CCC(F)(F)F)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780036 | 65986 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 444 | 8 | 0 | 4 | 5.6 | CCCN(CCc1ccccc1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL183639 | 65986 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 444 | 8 | 0 | 4 | 5.6 | CCCN(CCc1ccccc1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 44306534 | 203468 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 371 | 8 | 0 | 6 | 4.3 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1CCCC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL65979 | 203468 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 371 | 8 | 0 | 6 | 4.3 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1CCCC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 44337502 | 5389 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 378 | 9 | 0 | 4 | 5.5 | C=CCn1nc(N(CCC)C(C2CC2)C2CC2)nc1-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL107091 | 5389 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 378 | 9 | 0 | 4 | 5.5 | C=CCn1nc(N(CCC)C(C2CC2)C2CC2)nc1-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(01)00657-6 | |||
| 44307772 | 169433 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 313 | 4 | 1 | 5 | 3.6 | CC(=O)/C(=N\Nc1ccccc1C#N)Oc1ccc(Cl)cc1 | 10.1021/jm025512y | |||
| CHEMBL442559 | 169433 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 313 | 4 | 1 | 5 | 3.6 | CC(=O)/C(=N\Nc1ccccc1C#N)Oc1ccc(Cl)cc1 | 10.1021/jm025512y | |||
| 10782556 | 59287 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 328 | 2 | 0 | 2 | 5.2 | Cc1ccc2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL170487 | 59287 | 0 | None | - | 1 | Rat | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 328 | 2 | 0 | 2 | 5.2 | Cc1ccc2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 44266524 | 162583 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 4.8 | CCN(c1nc(C)cc(-c2ccccn2)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL416882 | 162583 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 4.8 | CCN(c1nc(C)cc(-c2ccccn2)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| 44443632 | 94481 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 404 | 7 | 1 | 6 | 4.8 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL251397 | 94481 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 404 | 7 | 1 | 6 | 4.8 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC | 10.1016/j.bmcl.2007.09.008 | |||
| 18449326 | 63982 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 397 | 9 | 1 | 5 | 4.6 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(COC)COC | 10.1021/jm200365y | |||
| CHEMBL1807022 | 63982 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 397 | 9 | 1 | 5 | 4.6 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(COC)COC | 10.1021/jm200365y | |||
| 10892583 | 203430 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 321 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1C(F)(F)F | 10.1021/jm025512y | |||
| CHEMBL65721 | 203430 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 321 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1C(F)(F)F | 10.1021/jm025512y | |||
| 3623188 | 203971 | 1 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1cccc(Cl)c1)NNc1ccc(C)cc1 | 10.1021/jm025512y | |||
| CHEMBL69431 | 203971 | 1 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 301 | 4 | 2 | 3 | 3.9 | CC(=O)/C(=N\c1cccc(Cl)c1)NNc1ccc(C)cc1 | 10.1021/jm025512y | |||
| 44266453 | 98267 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 4.8 | CCN(c1nc(C)cc(-c2cccnc2)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL274579 | 98267 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 428 | 6 | 0 | 6 | 4.8 | CCN(c1nc(C)cc(-c2cccnc2)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| 12967650 | 19923 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 431 | 8 | 1 | 4 | 6.8 | CCCN(Cc1sc(Nc2c(C)cc(C)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL130265 | 19923 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 431 | 8 | 1 | 4 | 6.8 | CCCN(Cc1sc(Nc2c(C)cc(C)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 11246568 | 133612 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 399 | 6 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(Cl)cn3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL371348 | 133612 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 399 | 6 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(Cl)cn3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 15965420 | 66935 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 468 | 7 | 0 | 4 | 6.8 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL186628 | 66935 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 468 | 7 | 0 | 4 | 6.8 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10808132 | 57436 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 355 | 8 | 0 | 5 | 4.9 | CCCCN(CC)c1nc(C)nc(N(CC)c2c(C)cc(C)cc2C)n1 | 10.1021/jm980222w | |||
| CHEMBL165473 | 57436 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 355 | 8 | 0 | 5 | 4.9 | CCCCN(CC)c1nc(C)nc(N(CC)c2c(C)cc(C)cc2C)n1 | 10.1021/jm980222w | |||
| 44392766 | 65331 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3N(C)C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL182915 | 65331 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3N(C)C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 20780080 | 145098 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 427 | 7 | 0 | 5 | 5.5 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(CC4CC4)CC4CC4)c(C)nc23)c(C)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL391169 | 145098 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 427 | 7 | 0 | 5 | 5.5 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(CC4CC4)CC4CC4)c(C)nc23)c(C)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 10298158 | 64608 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 457 | 7 | 1 | 4 | 7.1 | CCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181718 | 64608 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 457 | 7 | 1 | 4 | 7.1 | CCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 18691327 | 98191 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 427 | 5 | 0 | 3 | 6.6 | CCN(c1nc(C)cc(-c2ccccc2F)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL274081 | 98191 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 427 | 5 | 0 | 3 | 6.6 | CCN(c1nc(C)cc(-c2ccccc2F)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10789842 | 58127 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 453 | 9 | 0 | 9 | 2.7 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980224g | |||
| CHEMBL167717 | 58127 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 453 | 9 | 0 | 9 | 2.7 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980224g | |||
| 9945957 | 63945 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 341 | 8 | 1 | 4 | 5.2 | CCc1nc(-c2ccc(C)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806733 | 63945 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 341 | 8 | 1 | 4 | 5.2 | CCc1nc(-c2ccc(C)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 11797773 | 58662 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 449 | 11 | 0 | 9 | 3.3 | COCCCN(CCOC)c1nc(C)nc2c1ncn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL168459 | 58662 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 449 | 11 | 0 | 9 | 3.3 | COCCCN(CCOC)c1nc(C)nc2c1ncn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 9805117 | 64988 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 478 | 7 | 0 | 6 | 7.0 | CCCCN(CC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL18230 | 64988 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 478 | 7 | 0 | 6 | 7.0 | CCCCN(CC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| 44341455 | 165140 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL422784 | 165140 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 20780283 | 7328 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 408 | 7 | 0 | 4 | 5.2 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1086163 | 7328 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 408 | 7 | 0 | 4 | 5.2 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 10528499 | 120390 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 4.1 | CCCC(Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br)C(=O)N(C)C | 10.1021/jm980224g | |||
| CHEMBL353393 | 120390 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 473 | 7 | 1 | 7 | 4.1 | CCCC(Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br)C(=O)N(C)C | 10.1021/jm980224g | |||
| 18691332 | 208115 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 424 | 5 | 1 | 4 | 6.1 | CCN(c1nc(C)cc(-c2ccccc2N)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL9795 | 208115 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 424 | 5 | 1 | 4 | 6.1 | CCN(c1nc(C)cc(-c2ccccc2N)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 44443599 | 153880 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 362 | 6 | 1 | 5 | 5.4 | Cc1ccnc(Oc2nc(C)c(NC(c3ccccc3)C(C)C)nc2C)c1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL398300 | 153880 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 362 | 6 | 1 | 5 | 5.4 | Cc1ccnc(Oc2nc(C)c(NC(c3ccccc3)C(C)C)nc2C)c1 | 10.1016/j.bmcl.2007.09.008 | |||
| 10646364 | 57529 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 430 | 6 | 0 | 4 | 5.9 | CCN(CC)c1cc(C)nc(N(CC)c2c(Cl)cc(Br)cc2Cl)n1 | 10.1021/jm980222w | |||
| CHEMBL166238 | 57529 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 430 | 6 | 0 | 4 | 5.9 | CCN(CC)c1cc(C)nc(N(CC)c2c(Cl)cc(Br)cc2Cl)n1 | 10.1021/jm980222w | |||
| 11797409 | 57839 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 440 | 7 | 0 | 6 | 4.0 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(S(C)(=O)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167171 | 57839 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 440 | 7 | 0 | 6 | 4.0 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(S(C)(=O)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| 10501643 | 57866 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 408 | 7 | 0 | 5 | 5.3 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(SC)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167195 | 57866 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 408 | 7 | 0 | 5 | 5.3 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(SC)cc2Br)n1 | 10.1021/jm980222w | |||
| 44347223 | 15255 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 352 | 7 | 0 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3cccc(OC)c3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL121183 | 15255 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 352 | 7 | 0 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3cccc(OC)c3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 44341736 | 10213 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 362 | 4 | 0 | 4 | 5.1 | CCCN(C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL116003 | 10213 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 362 | 4 | 0 | 4 | 5.1 | CCCN(C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 15490815 | 4542 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 487 | 5 | 0 | 3 | 7.3 | CCN(c1nc(C)cc(-c2ccccc2Br)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10237 | 4542 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 487 | 5 | 0 | 3 | 7.3 | CCN(c1nc(C)cc(-c2ccccc2Br)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 20780276 | 123935 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 5.6 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(Cl)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL362815 | 123935 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 5.6 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(Cl)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| 44307879 | 102271 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 349 | 4 | 1 | 5 | 4.5 | CCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL303272 | 102271 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 349 | 4 | 1 | 5 | 4.5 | CCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 11282946 | 63366 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 440 | 11 | 0 | 6 | 5.8 | CCCCC(c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL179540 | 63366 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 440 | 11 | 0 | 6 | 5.8 | CCCCC(c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(OC)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 11351594 | 124763 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 458 | 8 | 0 | 7 | 5.2 | CCCN(Cc1cccc(OC)c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL364214 | 124763 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 458 | 8 | 0 | 7 | 5.2 | CCCN(Cc1cccc(OC)c1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10667729 | 59078 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 384 | 8 | 0 | 8 | 2.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL169576 | 59078 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 384 | 8 | 0 | 8 | 2.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 44266439 | 208380 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 466 | 5 | 0 | 4 | 7.1 | CCN(c1nc(C)cc(-c2c(C)cc(C)nc2C)n1)c1c(C)cc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL9956 | 208380 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 466 | 5 | 0 | 4 | 7.1 | CCN(c1nc(C)cc(-c2c(C)cc(C)nc2C)n1)c1c(C)cc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 20780041 | 125296 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 7.2 | FC(F)(F)c1nc2n(-c3ccc(Cl)cc3Cl)c3ccccc3n2c1CN(CC1CC1)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL364537 | 125296 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 7.2 | FC(F)(F)c1nc2n(-c3ccc(Cl)cc3Cl)c3ccccc3n2c1CN(CC1CC1)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 3533 | 1206 | 24 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1016/j.bmcl.2004.02.053 | |||
| 5282340 | 1206 | 24 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL291657 | 1206 | 24 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 10.1016/j.bmcl.2004.02.053 | |||
| 44305973 | 100549 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 433 | 10 | 0 | 6 | 5.5 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)[C@@H](c1ccccc1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL291419 | 100549 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 433 | 10 | 0 | 6 | 5.5 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)[C@@H](c1ccccc1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 18672262 | 62636 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 473 | 8 | 1 | 4 | 7.7 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC(C)C | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL178375 | 62636 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 473 | 8 | 1 | 4 | 7.7 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC(C)C | 10.1016/j.bmcl.2004.10.055 | |||
| 11751505 | 124658 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 458 | 7 | 0 | 6 | 5.2 | CCCN(CCC)c1c(Br)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL364168 | 124658 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 458 | 7 | 0 | 6 | 5.2 | CCCN(CCC)c1c(Br)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10316753 | 60491 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 364 | 7 | 1 | 3 | 5.2 | CCCN(c1n[nH]c(-c2ccc(Cl)cc2Cl)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL175536 | 60491 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 364 | 7 | 1 | 3 | 5.2 | CCCN(c1n[nH]c(-c2ccc(Cl)cc2Cl)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 10692645 | 59097 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 404 | 6 | 1 | 7 | 3.5 | COCCNc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169693 | 59097 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 404 | 6 | 1 | 7 | 3.5 | COCCNc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44443602 | 94037 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 376 | 8 | 1 | 5 | 5.7 | CCc1nc(Oc2ncccc2C)c(CC)nc1NC(CC)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248816 | 94037 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 376 | 8 | 1 | 5 | 5.7 | CCc1nc(Oc2ncccc2C)c(CC)nc1NC(CC)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 44460263 | 205325 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 378 | 7 | 1 | 3 | 5.7 | Cc1ccc(N[C@@H](C(=O)CCc2ccncc2)c2ccccc2C)c(Cl)c1 | 10.1021/jm049974i | |||
| CHEMBL79502 | 205325 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 378 | 7 | 1 | 3 | 5.7 | Cc1ccc(N[C@@H](C(=O)CCc2ccncc2)c2ccccc2C)c(Cl)c1 | 10.1021/jm049974i | |||
| 21916075 | 7582 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 406 | 3 | 0 | 4 | 5.4 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CCCCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087805 | 7582 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 406 | 3 | 0 | 4 | 5.4 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CCCCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 10801589 | 161962 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 264 | 2 | 0 | 2 | 4.8 | Cc1cc(C)c2ccn(-c3ccc(C(C)C)cc3)c2n1 | 10.1021/jm980223o | |||
| CHEMBL415752 | 161962 | 0 | None | - | 1 | Rat | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 264 | 2 | 0 | 2 | 4.8 | Cc1cc(C)c2ccn(-c3ccc(C(C)C)cc3)c2n1 | 10.1021/jm980223o | |||
| 20780184 | 67097 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 7.3 | CCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187362 | 67097 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 7.3 | CCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 11452262 | 73382 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 4.9 | COc1cccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL201470 | 73382 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 396 | 5 | 1 | 5 | 4.9 | COc1cccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 10596146 | 57608 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 383 | 9 | 0 | 6 | 4.1 | CCN(c1nc(C)nc(N(CCOC)CC2CC2)n1)c1c(C)cc(C)cc1C | 10.1021/jm980222w | |||
| CHEMBL166807 | 57608 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 383 | 9 | 0 | 6 | 4.1 | CCN(c1nc(C)nc(N(CCOC)CC2CC2)n1)c1c(C)cc(C)cc1C | 10.1021/jm980222w | |||
| 10504356 | 120732 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 464 | 11 | 0 | 6 | 4.9 | CCN(c1nc(C)cc(N(CCOC)CCOC)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| CHEMBL354859 | 120732 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 464 | 11 | 0 | 6 | 4.9 | CCN(c1nc(C)cc(N(CCOC)CCOC)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| 44392767 | 66274 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL184694 | 66274 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 367 | 7 | 0 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10807869 | 58775 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 351 | 6 | 0 | 5 | 4.7 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL168731 | 58775 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 351 | 6 | 0 | 5 | 4.7 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 44307653 | 102156 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 363 | 5 | 1 | 5 | 4.9 | CCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL302589 | 102156 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 363 | 5 | 1 | 5 | 4.9 | CCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 10119101 | 132408 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 525 | 8 | 1 | 4 | 8.4 | CCCN(Cc1ccc(F)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL369734 | 132408 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 525 | 8 | 1 | 4 | 8.4 | CCCN(Cc1ccc(F)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11639847 | 127513 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 396 | 5 | 0 | 5 | 5.1 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3OC)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL366179 | 127513 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 396 | 5 | 0 | 5 | 5.1 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3OC)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 10788201 | 58999 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 418 | 6 | 2 | 7 | 3.6 | CCC(CO)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169035 | 58999 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 418 | 6 | 2 | 7 | 3.6 | CCC(CO)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10573217 | 120495 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 402 | 5 | 0 | 6 | 4.3 | CCN(CC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL354398 | 120495 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 402 | 5 | 0 | 6 | 4.3 | CCN(CC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 20780155 | 67365 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 518 | 8 | 0 | 4 | 7.7 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL188623 | 67365 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 518 | 8 | 0 | 4 | 7.7 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 44305986 | 102125 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 425 | 9 | 0 | 7 | 5.1 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1(c2cccs2)CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL302396 | 102125 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 425 | 9 | 0 | 7 | 5.1 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1(c2cccs2)CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 11236826 | 140991 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 473 | 7 | 1 | 6 | 5.9 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3ccccn3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL382347 | 140991 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 473 | 7 | 1 | 6 | 5.9 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3ccccn3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44443592 | 154992 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 362 | 7 | 1 | 5 | 5.3 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(C)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL401327 | 154992 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 362 | 7 | 1 | 5 | 5.3 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(C)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 10668655 | 24806 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2cc(Cl)c(Cl)cc2Cl)nc(C)n1 | 10.1021/jm960149e | |||
| CHEMBL134475 | 24806 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2cc(Cl)c(Cl)cc2Cl)nc(C)n1 | 10.1021/jm960149e | |||
| 10573027 | 205032 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2c(Cl)cc(Cl)cc2Cl)nc(C)n1 | 10.1021/jm9900117 | |||
| CHEMBL77006 | 205032 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2c(Cl)cc(Cl)cc2Cl)nc(C)n1 | 10.1021/jm9900117 | |||
| 44386385 | 60068 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 382 | 6 | 0 | 7 | 3.4 | CCCN(CCC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)nc1C | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL173780 | 60068 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 382 | 6 | 0 | 7 | 3.4 | CCCN(CCC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)nc1C | 10.1016/s0960-894x(99)00108-0 | |||
| 20780137 | 67400 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 482 | 7 | 0 | 4 | 7.2 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CCC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL188813 | 67400 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 482 | 7 | 0 | 4 | 7.2 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CCC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10667355 | 57455 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 377 | 5 | 0 | 4 | 5.1 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(C(C)C)cc1OC | 10.1021/jm980222w | |||
| CHEMBL165589 | 57455 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 377 | 5 | 0 | 4 | 5.1 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(C(C)C)cc1OC | 10.1021/jm980222w | |||
| 10813479 | 57485 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 450 | 8 | 0 | 5 | 6.4 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(C(C)C)cc2SC)n1 | 10.1021/jm980222w | |||
| CHEMBL165873 | 57485 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 450 | 8 | 0 | 5 | 6.4 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(C(C)C)cc2SC)n1 | 10.1021/jm980222w | |||
| 44392761 | 122344 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 385 | 10 | 0 | 6 | 4.0 | CCCN(CC1CC1)c1cc(Cc2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL359925 | 122344 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 385 | 10 | 0 | 6 | 4.0 | CCCN(CC1CC1)c1cc(Cc2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 9865133 | 163867 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 388 | 6 | 1 | 3 | 5.8 | CCCN(CC1CC1)c1cc(C)[nH]c2c(-c3ccc(Cl)cc3Cl)nnc1-2 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL420681 | 163867 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 388 | 6 | 1 | 3 | 5.8 | CCCN(CC1CC1)c1cc(C)[nH]c2c(-c3ccc(Cl)cc3Cl)nnc1-2 | 10.1016/s0960-894x(03)00621-8 | |||
| 20780016 | 65176 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 498 | 6 | 0 | 4 | 5.4 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL182482 | 65176 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 498 | 6 | 0 | 4 | 5.4 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| 53310277 | 63984 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 403 | 8 | 0 | 3 | 6.2 | CCc1nc(N(CC2CC2)CC2CC2)c(CC)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807024 | 63984 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 403 | 8 | 0 | 3 | 6.2 | CCc1nc(N(CC2CC2)CC2CC2)c(CC)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 20780089 | 167773 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 399 | 7 | 0 | 5 | 5.1 | C=CCN(CC=C)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL430391 | 167773 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 399 | 7 | 0 | 5 | 5.1 | C=CCN(CC=C)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 44446727 | 94835 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(OC)cc2C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253700 | 94835 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(OC)cc2C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 10163122 | 64833 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 483 | 8 | 1 | 4 | 7.5 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN(CC1CC1)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181980 | 64833 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 483 | 8 | 1 | 4 | 7.5 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN(CC1CC1)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 11350066 | 168273 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 398 | 8 | 0 | 5 | 5.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(CC)c1ccccc1 | 10.1021/jm049339c | |||
| CHEMBL433940 | 168273 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 398 | 8 | 0 | 5 | 5.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(CC)c1ccccc1 | 10.1021/jm049339c | |||
| 11394728 | 5674 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 374 | 8 | 0 | 5 | 4.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL107786 | 5674 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 374 | 8 | 0 | 5 | 4.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 44385520 | 130206 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 523 | 8 | 0 | 7 | 5.0 | COCCN(Cc1ccccc1)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL367920 | 130206 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 523 | 8 | 0 | 7 | 5.0 | COCCN(Cc1ccccc1)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 44318102 | 206057 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 399 | 10 | 0 | 6 | 4.3 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CC2CC2)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL85363 | 206057 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 399 | 10 | 0 | 6 | 4.3 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CC2CC2)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 21916125 | 6707 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 7.3 | CCCN(Cc1cccc(F)c1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083613 | 6707 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 7.3 | CCCN(Cc1cccc(F)c1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 11211248 | 66169 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 382 | 7 | 1 | 7 | 3.6 | CCC(COC)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL184284 | 66169 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 382 | 7 | 1 | 7 | 3.6 | CCC(COC)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10292638 | 118066 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 371 | 7 | 1 | 4 | 5.4 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(C)cc(C)cc2C)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL340469 | 118066 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 371 | 7 | 1 | 4 | 5.4 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(C)cc(C)cc2C)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| 11427630 | 63010 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 334 | 7 | 0 | 5 | 3.8 | CCCN(CC1CC1)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL178725 | 63010 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 334 | 7 | 0 | 5 | 3.8 | CCCN(CC1CC1)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 44337533 | 167869 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 326 | 6 | 0 | 4 | 4.4 | CCCN(CCC)c1nc(-c2ccc(Cl)cc2Cl)n(C)n1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL431067 | 167869 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 326 | 6 | 0 | 4 | 4.4 | CCCN(CCC)c1nc(-c2ccc(Cl)cc2Cl)n(C)n1 | 10.1016/s0960-894x(01)00657-6 | |||
| 44446736 | 94630 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 433 | 10 | 0 | 4 | 6.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN(C)C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL252302 | 94630 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 433 | 10 | 0 | 4 | 6.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN(C)C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44443627 | 154027 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 422 | 9 | 1 | 6 | 4.9 | CCc1nc(Oc2ccccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL398425 | 154027 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 422 | 9 | 1 | 6 | 4.9 | CCc1nc(Oc2ccccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| 10599448 | 58835 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 444 | 7 | 0 | 6 | 4.4 | CCN(CCN(C)C)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168846 | 58835 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 444 | 7 | 0 | 6 | 4.4 | CCN(CCN(C)C)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 11351416 | 73914 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 450 | 5 | 1 | 5 | 5.8 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OC(F)(F)F)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL201966 | 73914 | 0 | None | - | 1 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 450 | 5 | 1 | 5 | 5.8 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OC(F)(F)F)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 10835160 | 57437 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 405 | 7 | 0 | 5 | 4.6 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(N(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL165475 | 57437 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 405 | 7 | 0 | 5 | 4.6 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(N(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10621342 | 120441 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 405 | 7 | 0 | 5 | 5.1 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL353890 | 120441 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 405 | 7 | 0 | 5 | 5.1 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 53309695 | 64000 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 5.7 | CCC(CC)Nc1nc(C)c(-c2ccc(Cl)cc2Cl)nc1C | 10.1021/jm200365y | |||
| CHEMBL1807040 | 64000 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 337 | 5 | 1 | 3 | 5.7 | CCC(CC)Nc1nc(C)c(-c2ccc(Cl)cc2Cl)nc1C | 10.1021/jm200365y | |||
| 21916306 | 7677 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 488 | 6 | 0 | 4 | 6.5 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CC2CCC2)CC(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1088624 | 7677 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 488 | 6 | 0 | 4 | 6.5 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CC2CCC2)CC(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 10618927 | 59046 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 366 | 5 | 2 | 5 | 4.5 | CCC(CO)Nc1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL169418 | 59046 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 366 | 5 | 2 | 5 | 4.5 | CCC(CO)Nc1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 10784215 | 59772 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 352 | 6 | 0 | 6 | 4.1 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL172571 | 59772 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 352 | 6 | 0 | 6 | 4.1 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 44341476 | 10069 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 6.3 | CCCCN(CCCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL115313 | 10069 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 6.3 | CCCCN(CCCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 10764399 | 59066 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 416 | 7 | 1 | 7 | 4.1 | COCC(Cc1ccccc1)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL169538 | 59066 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 416 | 7 | 1 | 7 | 4.1 | COCC(Cc1ccccc1)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 135958361 | 57188 | 0 | None | 3 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 428 | 3 | 4 | 7 | 2.4 | NCCNC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=N[C@H]1CCCC[C@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| CHEMBL164931 | 57188 | 0 | None | 3 | 2 | Rat | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 428 | 3 | 4 | 7 | 2.4 | NCCNC(=O)c1c2c(c3c(O)c4ccccc4c4ncnc1c34)=N[C@H]1CCCC[C@H]1N2 | 10.1016/s0960-894x(99)00075-x | |||
| 20780021 | 63922 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 512 | 7 | 0 | 4 | 5.9 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL180613 | 63922 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 512 | 7 | 0 | 4 | 5.9 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2005.05.117 | |||
| 20780256 | 64299 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 518 | 7 | 0 | 4 | 6.8 | CCc1nc2n(c1C(=O)N(CCC(F)(F)F)Cc1ccc(Cl)cc1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL181053 | 64299 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 518 | 7 | 0 | 4 | 6.8 | CCc1nc2n(c1C(=O)N(CCC(F)(F)F)Cc1ccc(Cl)cc1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780055 | 93952 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 444 | 5 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)Cc4cccnc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL248367 | 93952 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 444 | 5 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)Cc4cccnc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 44443577 | 93987 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 346 | 8 | 2 | 4 | 5.6 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1ccc(Cl)cc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248588 | 93987 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 346 | 8 | 2 | 4 | 5.6 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1ccc(Cl)cc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 3568686 | 203065 | 8 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 287 | 4 | 2 | 3 | 3.8 | CC(=O)/C(=N\Nc1ccccc1)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| CHEMBL63664 | 203065 | 8 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 287 | 4 | 2 | 3 | 3.8 | CC(=O)/C(=N\Nc1ccccc1)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| 44587453 | 189107 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 359 | 9 | 0 | 6 | 4.1 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL510224 | 189107 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 359 | 9 | 0 | 6 | 4.1 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 20780170 | 123852 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 490 | 6 | 0 | 4 | 7.2 | CCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL362567 | 123852 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 490 | 6 | 0 | 4 | 7.2 | CCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 44352478 | 20871 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 505 | 8 | 1 | 4 | 7.9 | CCCN(Cc1sc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL131046 | 20871 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 505 | 8 | 1 | 4 | 7.9 | CCCN(Cc1sc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44352464 | 21444 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 539 | 8 | 1 | 4 | 7.4 | CCCN(Cc1sc(Nc2c(Br)cc(C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL131533 | 21444 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 539 | 8 | 1 | 4 | 7.4 | CCCN(Cc1sc(Nc2c(Br)cc(C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 20780173 | 127171 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 454 | 6 | 0 | 4 | 6.5 | CCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL365715 | 127171 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 454 | 6 | 0 | 4 | 6.5 | CCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10526864 | 57562 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 434 | 8 | 0 | 6 | 4.8 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(C(C)=O)cc2OC)n1 | 10.1021/jm980222w | |||
| CHEMBL166504 | 57562 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 434 | 8 | 0 | 6 | 4.8 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(C(C)=O)cc2OC)n1 | 10.1021/jm980222w | |||
| 10740490 | 178683 | 0 | None | - | 1 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 413 | 3 | 0 | 4 | 5.1 | Cc1cc(N2CCOCC2)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL46798 | 178683 | 0 | None | - | 1 | Rat | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 413 | 3 | 0 | 4 | 5.1 | Cc1cc(N2CCOCC2)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 21916258 | 6705 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 522 | 7 | 0 | 4 | 7.8 | CCCN(Cc1ccc(Cl)cc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083611 | 6705 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 522 | 7 | 0 | 4 | 7.8 | CCCN(Cc1ccc(Cl)cc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780133 | 93687 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 471 | 7 | 0 | 5 | 6.7 | CCCN(Cc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL246944 | 93687 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 471 | 7 | 0 | 5 | 6.7 | CCCN(Cc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780060 | 93760 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 419 | 7 | 0 | 5 | 5.4 | C=CCN(CC=C)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247358 | 93760 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 419 | 7 | 0 | 5 | 5.4 | C=CCN(CC=C)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 44446721 | 155507 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 362 | 7 | 0 | 3 | 6.2 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL404171 | 155507 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 362 | 7 | 0 | 3 | 6.2 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2C)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 12967653 | 64729 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 521 | 9 | 1 | 4 | 8.3 | CCCN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181884 | 64729 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 521 | 9 | 1 | 4 | 8.3 | CCCN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11394728 | 5674 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 374 | 8 | 0 | 5 | 4.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| CHEMBL107786 | 5674 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 374 | 8 | 0 | 5 | 4.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| 11798947 | 59134 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 480 | 10 | 0 | 10 | 2.4 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL169861 | 59134 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 480 | 10 | 0 | 10 | 2.4 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 44388401 | 62997 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 394 | 11 | 0 | 6 | 5.3 | CCCCC(CC)N(OCCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL178667 | 62997 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 394 | 11 | 0 | 6 | 5.3 | CCCCC(CC)N(OCCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 10180472 | 21944 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 419 | 7 | 1 | 4 | 6.4 | CCCCN(CC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL132055 | 21944 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 419 | 7 | 1 | 4 | 6.4 | CCCCN(CC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| 20780057 | 152162 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 458 | 6 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)CCc4ccccn4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL396821 | 152162 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 458 | 6 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)CCc4ccccn4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 10598041 | 120312 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 416 | 7 | 0 | 6 | 4.7 | CCCCN(CC)c1ncnc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL352784 | 120312 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 416 | 7 | 0 | 6 | 4.7 | CCCCN(CC)c1ncnc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10811877 | 165708 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 416 | 5 | 0 | 4 | 5.8 | CCN(c1nc(C)cc(N2CCCCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| CHEMBL424562 | 165708 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 416 | 5 | 0 | 4 | 5.8 | CCN(c1nc(C)cc(N2CCCCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| 10665582 | 120409 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 350 | 5 | 1 | 4 | 5.5 | CCCCNc1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL353638 | 120409 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 350 | 5 | 1 | 4 | 5.5 | CCCCNc1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 44347190 | 15282 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 384 | 8 | 1 | 7 | 3.2 | CCCN(CCO)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL121301 | 15282 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 384 | 8 | 1 | 7 | 3.2 | CCCN(CCO)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 10548172 | 59128 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 385 | 3 | 0 | 5 | 4.3 | COc1cc(Br)c(-n2cc(C#N)c3c(C)cc(C)nc32)c(OC)c1 | 10.1021/jm980223o | |||
| CHEMBL169838 | 59128 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 385 | 3 | 0 | 5 | 4.3 | COc1cc(Br)c(-n2cc(C#N)c3c(C)cc(C)nc32)c(OC)c1 | 10.1021/jm980223o | |||
| 44308157 | 203862 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 419 | 8 | 0 | 5 | 6.1 | CCCCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL68697 | 203862 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 419 | 8 | 0 | 5 | 6.1 | CCCCCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 20780274 | 62993 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 7 | 0 | 4 | 4.8 | CCCCN(CC)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL178617 | 62993 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 382 | 7 | 0 | 4 | 4.8 | CCCCN(CC)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 10164483 | 122752 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 508 | 8 | 1 | 5 | 7.7 | CCCN(Cc1cccnc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL360458 | 122752 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 508 | 8 | 1 | 5 | 7.7 | CCCN(Cc1cccnc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 10183075 | 131450 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 459 | 8 | 1 | 4 | 7.5 | CCCCN(CC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL369109 | 131450 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 459 | 8 | 1 | 4 | 7.5 | CCCCN(CC)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 44352437 | 21362 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 489 | 9 | 1 | 4 | 7.4 | CCCN(Cc1sc(Nc2ccc(C(C)C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL131422 | 21362 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 489 | 9 | 1 | 4 | 7.4 | CCCN(Cc1sc(Nc2ccc(C(C)C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44441102 | 152165 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 409 | 6 | 1 | 5 | 5.5 | CCCC(C)NCc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL396822 | 152165 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 409 | 6 | 1 | 5 | 5.5 | CCCC(C)NCc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 44389083 | 62635 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 429 | 6 | 2 | 4 | 6.4 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CNCC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL178374 | 62635 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 429 | 6 | 2 | 4 | 6.4 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CNCC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 10914632 | 162686 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 335 | 4 | 2 | 3 | 4.3 | CC(=O)/C(=N\c1cccc(C(F)(F)F)c1)NNc1ccccc1C | 10.1021/jm025512y | |||
| CHEMBL417037 | 162686 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 335 | 4 | 2 | 3 | 4.3 | CC(=O)/C(=N\c1cccc(C(F)(F)F)c1)NNc1ccccc1C | 10.1021/jm025512y | |||
| 44397564 | 67653 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 550 | 6 | 0 | 4 | 7.5 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC(F)(F)F)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL190638 | 67653 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 550 | 6 | 0 | 4 | 7.5 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC(F)(F)F)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10549983 | 58874 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 418 | 7 | 1 | 7 | 3.9 | COCCCNc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168883 | 58874 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 418 | 7 | 1 | 7 | 3.9 | COCCCNc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 11022531 | 203788 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 287 | 4 | 2 | 3 | 3.6 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| CHEMBL68238 | 203788 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 287 | 4 | 2 | 3 | 3.6 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| CHEMBL413591 | 213076 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N1)[C@@H](C)CC)C(N)=O | 10.1021/jm034180+ | |||||
| 10765122 | 58162 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 430 | 9 | 0 | 6 | 4.3 | C=CCN(CC=C)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL168131 | 58162 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 430 | 9 | 0 | 6 | 4.3 | C=CCN(CC=C)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 44386432 | 59589 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 7 | 0 | 5 | 5.5 | CCCCN(CC)c1cc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL171893 | 59589 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 7 | 0 | 5 | 5.5 | CCCCN(CC)c1cc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 9955329 | 207830 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 448 | 8 | 0 | 8 | 3.9 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL9633 | 207830 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 448 | 8 | 0 | 8 | 3.9 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 44340885 | 10159 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00661-2 | |||||
| CHEMBL115836 | 10159 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1016/s0960-894x(00)00661-2 | |||||
| 44341765 | 9791 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 374 | 7 | 0 | 2 | 7.2 | CCCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL113653 | 9791 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 374 | 7 | 0 | 2 | 7.2 | CCCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 44342075 | 167873 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 360 | 6 | 0 | 2 | 6.8 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL431076 | 167873 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 360 | 6 | 0 | 2 | 6.8 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 44307478 | 102630 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.7 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| CHEMBL304272 | 102630 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.7 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| 44307474 | 102638 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 377 | 5 | 0 | 5 | 4.9 | CCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| CHEMBL304335 | 102638 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 377 | 5 | 0 | 5 | 4.9 | CCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/j.bmc.2017.10.012 | |||
| CHEMBL4299313 | 213565 | 0 | None | -2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)C(C)(C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(CCCC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(=O)CCOCCOCCOCCOCCOCCOCCN)[C@@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2015.10.010 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2015.10.010 | |||
| 44307478 | 102630 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.7 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL304272 | 102630 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.7 | COCCN(CCOC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44307474 | 102638 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 377 | 5 | 0 | 5 | 4.9 | CCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL304335 | 102638 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 377 | 5 | 0 | 5 | 4.9 | CCCN(CC)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44307892 | 203477 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 379 | 7 | 0 | 5 | 5.4 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(CC)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66054 | 203477 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 379 | 7 | 0 | 5 | 5.4 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(CC)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 9885480 | 203512 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 365 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66275 | 203512 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 365 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2008.07.063 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2008.07.063 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2008.07.063 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL407570 | 212668 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(C)=O)C(=O)N[C@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1)[C@@H](C)CC)C(N)=O | 10.1021/jm034180+ | |||||
| 177990 | 426 | 23 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm050384+ | |||
| 3489 | 426 | 23 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm050384+ | |||
| CHEMBL296641 | 426 | 23 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm050384+ | |||
| 10694630 | 59161 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 444 | 8 | 1 | 6 | 5.8 | CCCCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169952 | 59161 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 444 | 8 | 1 | 6 | 5.8 | CCCCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 9912938 | 4463 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 477 | 5 | 0 | 3 | 7.5 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10175 | 4463 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 477 | 5 | 0 | 3 | 7.5 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 122193723 | 123964 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.0 | CCCN(CCC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628743 | 123964 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 458 | 7 | 1 | 4 | 6.0 | CCCN(CCC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 177990 | 426 | 23 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm050070m | |||
| 3489 | 426 | 23 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm050070m | |||
| CHEMBL296641 | 426 | 23 | None | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 10.1021/jm050070m | |||
| 11025 | 2740 | 7 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 10.1021/jm049085v | |||
| 11713007 | 2740 | 7 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 10.1021/jm049085v | |||
| CHEMBL380800 | 2740 | 7 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 10.1021/jm049085v | |||
| 44392707 | 63758 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 407 | 7 | 0 | 6 | 4.6 | CCCN(CCOC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL180142 | 63758 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 407 | 7 | 0 | 6 | 4.6 | CCCN(CCOC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44392688 | 66315 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL184930 | 66315 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 391 | 6 | 0 | 5 | 5.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10622522 | 59449 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 429 | 7 | 0 | 5 | 5.6 | CCCCN(CC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL171202 | 59449 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 429 | 7 | 0 | 5 | 5.6 | CCCCN(CC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44342014 | 9543 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 392 | 6 | 0 | 5 | 4.7 | CCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112290 | 9543 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 392 | 6 | 0 | 5 | 4.7 | CCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 44341754 | 10034 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 408 | 6 | 0 | 2 | 7.6 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115099 | 10034 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 408 | 6 | 0 | 2 | 7.6 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 11774042 | 203352 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL65078 | 203352 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 402 | 6 | 0 | 4 | 5.9 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 9960282 | 64324 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 595 | 8 | 1 | 4 | 9.5 | FC(F)(F)CCN(Cc1ccc(Cl)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181134 | 64324 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 595 | 8 | 1 | 4 | 9.5 | FC(F)(F)CCN(Cc1ccc(Cl)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 9952376 | 9873 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL114193 | 9873 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 9952376 | 9873 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL114193 | 9873 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 9843355 | 11230 | 2 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| CHEMBL1178813 | 11230 | 2 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| CHEMBL44169 | 11230 | 2 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 389 | 7 | 1 | 7 | 4.0 | COCC(COC)n1nnc2c(Nc3c(C)cc(C)cc3Cl)nc(C)cc21 | 10.1021/jm990590f | |||
| 9865624 | 15544 | 12 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL121896 | 15544 | 12 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 11384238 | 66850 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 5.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL186203 | 66850 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 406 | 6 | 1 | 4 | 5.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1Cl | 10.1016/j.bmcl.2015.10.010 | |||
| 122193716 | 123954 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 478 | 6 | 1 | 4 | 5.0 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(I)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628732 | 123954 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 478 | 6 | 1 | 4 | 5.0 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(I)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| 9865624 | 15544 | 12 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL121896 | 15544 | 12 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 398 | 9 | 0 | 7 | 3.9 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1021/jm040058e | |||
| 11305029 | 66929 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 432 | 6 | 0 | 6 | 4.9 | CCN(Cc1ccccc1F)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL186592 | 66929 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 432 | 6 | 0 | 6 | 4.9 | CCN(Cc1ccccc1F)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10789622 | 120739 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 447 | 8 | 0 | 7 | 4.5 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL354940 | 120739 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 447 | 8 | 0 | 7 | 4.5 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 10835789 | 165322 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 417 | 8 | 0 | 7 | 4.7 | CCCCN(CC)c1nc(C)nc2c1nc(C)n2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL423444 | 165322 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 417 | 8 | 0 | 7 | 4.7 | CCCCN(CC)c1nc(C)nc2c1nc(C)n2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 10835759 | 168530 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 416 | 6 | 0 | 5 | 5.6 | CCC(CC)Oc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL435468 | 168530 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 416 | 6 | 0 | 5 | 5.6 | CCC(CC)Oc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44347236 | 113310 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 347 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(C#N)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL331539 | 113310 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 347 | 6 | 0 | 5 | 4.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(C#N)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 10363370 | 119875 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 5.8 | CCN(CCCCF)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL348967 | 119875 | 0 | None | - | 1 | Rat | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 5.8 | CCN(CCCCF)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL4299313 | 213565 | 0 | None | -2 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)C(C)(C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(CCCC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(=O)CCOCCOCCOCCOCCOCCOCCN)[C@@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm040058e | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm040058e | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm040058e | |||
| 11189666 | 71195 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 395 | 6 | 0 | 3 | 6.6 | CCCC(CCC)N1CCc2cn(-c3ccc(C)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL195631 | 71195 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 395 | 6 | 0 | 3 | 6.6 | CCCC(CCC)N1CCc2cn(-c3ccc(C)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 44381516 | 59049 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 443 | 8 | 1 | 5 | 6.4 | CCCC(CCC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169430 | 59049 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 443 | 8 | 1 | 5 | 6.4 | CCCC(CCC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44347217 | 96630 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 352 | 7 | 0 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL263492 | 96630 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 352 | 7 | 0 | 5 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2003.08.055 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2003.08.055 | |||
| 9934089 | 5007 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 9 | 0 | 8 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL10504 | 5007 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 9 | 0 | 8 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341813 | 9603 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.1 | Cc1cc(N(CC(C)C)CC2CC2)c2c(n1)c(-c1ccc(Cl)cc1Cl)nn2C | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112560 | 9603 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.1 | Cc1cc(N(CC(C)C)CC2CC2)c2c(n1)c(-c1ccc(Cl)cc1Cl)nn2C | 10.1016/s0960-894x(03)00622-x | |||
| 9934089 | 5007 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 9 | 0 | 8 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| CHEMBL10504 | 5007 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 462 | 9 | 0 | 8 | 3.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2005.05.117 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/j.bmcl.2005.05.117 | |||
| 18449330 | 63981 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 389 | 7 | 1 | 3 | 6.2 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(C1CC1)C1CC1 | 10.1021/jm200365y | |||
| CHEMBL1807021 | 63981 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 389 | 7 | 1 | 3 | 6.2 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(C1CC1)C1CC1 | 10.1021/jm200365y | |||
| 10188470 | 131449 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 9.0 | Fc1cccc(CN(CCC(F)(F)F)Cc2sc(Nc3c(Cl)cc(Cl)cc3Cl)nc2C(F)(F)F)c1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL369107 | 131449 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 9.0 | Fc1cccc(CN(CCC(F)(F)F)Cc2sc(Nc3c(Cl)cc(Cl)cc3Cl)nc2C(F)(F)F)c1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL427807 | 213385 | 0 | None | -1 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(N)=O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O | 10.1021/jm990590f | |||||
| 44341664 | 10025 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 434 | 6 | 0 | 2 | 7.9 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115030 | 10025 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 434 | 6 | 0 | 2 | 7.9 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 3520 | 3267 | 54 | None | -1 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm200365y | |||
| 9821250 | 3267 | 54 | None | -1 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm200365y | |||
| CHEMBL309138 | 3267 | 54 | None | -1 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm200365y | |||
| 10550438 | 205106 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 426 | 8 | 1 | 4 | 6.7 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1CC | 10.1021/jm960149e | |||
| CHEMBL77716 | 205106 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 426 | 8 | 1 | 4 | 6.7 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1CC | 10.1021/jm960149e | |||
| 10550438 | 205106 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 426 | 8 | 1 | 4 | 6.7 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1CC | 10.1021/jm9900117 | |||
| CHEMBL77716 | 205106 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 426 | 8 | 1 | 4 | 6.7 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1CC | 10.1021/jm9900117 | |||
| 44392702 | 156860 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 403 | 6 | 0 | 5 | 5.3 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL407168 | 156860 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 403 | 6 | 0 | 5 | 5.3 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10670904 | 120750 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 442 | 7 | 0 | 4 | 6.6 | CCCCN(CC)c1cc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL355049 | 120750 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 442 | 7 | 0 | 4 | 6.6 | CCCCN(CC)c1cc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44347139 | 114948 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 368 | 7 | 1 | 6 | 4.6 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL334237 | 114948 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 368 | 7 | 1 | 6 | 4.6 | CCC(CC)Nc1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 46872036 | 123955 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 6 | 1 | 4 | 4.7 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628733 | 123955 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 6 | 1 | 4 | 4.7 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| 11628147 | 70560 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 434 | 4 | 0 | 4 | 6.1 | CC[C@H]1Cn2nc(-c3ccc(C(F)(F)F)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL194836 | 70560 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 434 | 4 | 0 | 4 | 6.1 | CC[C@H]1Cn2nc(-c3ccc(C(F)(F)F)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11605928 | 71896 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 396 | 5 | 0 | 5 | 5.1 | CC[C@H]1Cn2nc(-c3ccc(OC)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL197134 | 71896 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 396 | 5 | 0 | 5 | 5.1 | CC[C@H]1Cn2nc(-c3ccc(OC)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11560698 | 135280 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 414 | 5 | 0 | 4 | 6.1 | CCC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL372653 | 135280 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 414 | 5 | 0 | 4 | 6.1 | CCC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11598576 | 141348 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 388 | 4 | 0 | 4 | 5.7 | CCC(CC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm049085v | |||
| CHEMBL383602 | 141348 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 388 | 4 | 0 | 4 | 5.7 | CCC(CC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm049085v | |||
| 11795560 | 57688 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 5.7 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL166890 | 57688 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 5.7 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 44375438 | 56560 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 408 | 7 | 0 | 4 | 5.8 | Cc1cc(C)c(-n2c(C)c(C)c3c(N(CCCF)CC4CC4)nc(C)nc32)c(C)c1 | 10.1016/s0960-894x(00)00071-8 | |||
| CHEMBL164042 | 56560 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 408 | 7 | 0 | 4 | 5.8 | Cc1cc(C)c(-n2c(C)c(C)c3c(N(CCCF)CC4CC4)nc(C)nc32)c(C)c1 | 10.1016/s0960-894x(00)00071-8 | |||
| 10048451 | 153832 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 432 | 9 | 1 | 6 | 5.6 | CCCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL398258 | 153832 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 432 | 9 | 1 | 6 | 5.6 | CCCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 44446740 | 155609 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 475 | 10 | 0 | 5 | 6.2 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCOCC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL404560 | 155609 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 475 | 10 | 0 | 5 | 6.2 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCOCC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 10573027 | 205032 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2c(Cl)cc(Cl)cc2Cl)nc(C)n1 | 10.1021/jm960149e | |||
| CHEMBL77006 | 205032 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2c(Cl)cc(Cl)cc2Cl)nc(C)n1 | 10.1021/jm960149e | |||
| 10573027 | 205032 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2c(Cl)cc(Cl)cc2Cl)nc(C)n1 | 10.1021/jm9900117 | |||
| CHEMBL77006 | 205032 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(Nc2c(Cl)cc(Cl)cc2Cl)nc(C)n1 | 10.1021/jm9900117 | |||
| 11152649 | 68521 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 361 | 6 | 0 | 3 | 6.0 | CCCC(CCC)N1CCc2cn(-c3ccc(C)cc3)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL191755 | 68521 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 361 | 6 | 0 | 3 | 6.0 | CCCC(CCC)N1CCc2cn(-c3ccc(C)cc3)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 20780290 | 63921 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 4.3 | C=CCN(CC=C)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL180610 | 63921 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 4.3 | C=CCN(CC=C)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780257 | 64287 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 464 | 7 | 0 | 4 | 6.2 | CCCN(Cc1ccc(Cl)cc1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL181002 | 64287 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 464 | 7 | 0 | 4 | 6.2 | CCCN(Cc1ccc(Cl)cc1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 11798634 | 57594 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 470 | 7 | 0 | 5 | 5.3 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(Br)cc2OC)n1 | 10.1021/jm980222w | |||
| CHEMBL166776 | 57594 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 470 | 7 | 0 | 5 | 5.3 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(Br)cc2OC)n1 | 10.1021/jm980222w | |||
| 11792683 | 58099 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 357 | 8 | 0 | 6 | 3.7 | CCN(CCOC)c1nc(C)nc(N(CC)c2c(C)cc(C)cc2C)n1 | 10.1021/jm980222w | |||
| CHEMBL167464 | 58099 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 357 | 8 | 0 | 6 | 3.7 | CCN(CCOC)c1nc(C)nc(N(CC)c2c(C)cc(C)cc2C)n1 | 10.1021/jm980222w | |||
| 44392760 | 65242 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 391 | 9 | 0 | 4 | 5.3 | C=CCc1c(C(=O)c2c(C)cc(C)cc2C)nc(C)nc1N(CCC)CC1CC1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182706 | 65242 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 391 | 9 | 0 | 4 | 5.3 | C=CCc1c(C(=O)c2c(C)cc(C)cc2C)nc(C)nc1N(CCC)CC1CC1 | 10.1016/j.bmcl.2004.05.072 | |||
| 176157 | 2738 | 28 | None | -9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/s0960-894x(00)00661-2 | |||
| 3512 | 2738 | 28 | None | -9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/s0960-894x(00)00661-2 | |||
| CHEMBL45281 | 2738 | 28 | None | -9 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 10.1016/s0960-894x(00)00661-2 | |||
| 21916078 | 7678 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 420 | 6 | 0 | 4 | 5.6 | CCN(Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1088625 | 7678 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 420 | 6 | 0 | 4 | 5.6 | CCN(Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2010.01.127 | |||
| 44386496 | 62578 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 499 | 10 | 0 | 6 | 6.4 | CCCCN(CC)c1nc(C)nc2c1nc(OCC1CC1)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL178272 | 62578 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 499 | 10 | 0 | 6 | 6.4 | CCCCN(CC)c1nc(C)nc2c1nc(OCC1CC1)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10648379 | 59077 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 479 | 10 | 0 | 9 | 3.0 | COCCN(CCOC)c1nc(C)nc2c1ncn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL169571 | 59077 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 479 | 10 | 0 | 9 | 3.0 | COCCN(CCOC)c1nc(C)nc2c1ncn2-c1c(Br)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 11501973 | 96846 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 4 | 0 | 4 | 5.7 | CCCN1c2cc(C)nc3c(-c4ccc(Cl)cc4Cl)nn(c23)C[C@@H]1CC | 10.1021/jm049085v | |||
| CHEMBL265282 | 96846 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 388 | 4 | 0 | 4 | 5.7 | CCCN1c2cc(C)nc3c(-c4ccc(Cl)cc4Cl)nn(c23)C[C@@H]1CC | 10.1021/jm049085v | |||
| 22324325 | 205873 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 373 | 9 | 0 | 6 | 3.9 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL83789 | 205873 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 373 | 9 | 0 | 6 | 3.9 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 21916104 | 6418 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 426 | 6 | 0 | 4 | 6.0 | CCCCN(C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082368 | 6418 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 426 | 6 | 0 | 4 | 6.0 | CCCCN(C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 16416344 | 203378 | 14 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 376 | 2 | 0 | 5 | 4.2 | Cc1cc(N2CCOCC2)n2nc(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL65308 | 203378 | 14 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 376 | 2 | 0 | 5 | 4.2 | Cc1cc(N2CCOCC2)n2nc(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(98)00372-2 | |||
| 44337472 | 108951 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 366 | 8 | 0 | 4 | 5.3 | CCCN(c1nc(-c2c(C)cc(C)cc2C)n(CC)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL321155 | 108951 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 366 | 8 | 0 | 4 | 5.3 | CCCN(c1nc(-c2c(C)cc(C)cc2C)n(CC)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 10228046 | 21439 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 485 | 7 | 1 | 4 | 7.1 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL131530 | 21439 | 0 | None | - | 1 | Human | 4.5 | pKi | = | 4.5 | Binding | ChEMBL | 485 | 7 | 1 | 4 | 7.1 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2003.08.055 | |||
| 44460259 | 205635 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccccc1[C@H](Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL81760 | 205635 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccccc1[C@H](Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 9828535 | 165561 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980222w | |||
| CHEMBL424204 | 165561 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980222w | |||
| CHEMBL43216 | 165561 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980222w | |||
| 44341728 | 9983 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 6.0 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(C)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL114821 | 9983 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 396 | 7 | 0 | 4 | 6.0 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(C)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 44341763 | 163434 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 6.4 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL419761 | 163434 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 6.4 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 9821153 | 9476 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 378 | 5 | 0 | 5 | 4.3 | COCCN(C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL111960 | 9476 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 378 | 5 | 0 | 5 | 4.3 | COCCN(C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 21916241 | 6489 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 456 | 8 | 0 | 5 | 5.6 | CCCN(CCOC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082685 | 6489 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 456 | 8 | 0 | 5 | 5.6 | CCCN(CCOC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 11225236 | 141370 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 472 | 7 | 1 | 5 | 6.5 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3ccccc3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL383773 | 141370 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 472 | 7 | 1 | 5 | 6.5 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3ccccc3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 21916145 | 7500 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 434 | 7 | 0 | 4 | 6.0 | CCCN(Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087164 | 7500 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 434 | 7 | 0 | 4 | 6.0 | CCCN(Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2010.01.127 | |||
| 44446742 | 94679 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 489 | 10 | 1 | 5 | 6.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCCC(O)C2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL252688 | 94679 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 489 | 10 | 1 | 5 | 6.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCCC(O)C2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 9828535 | 165561 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm990590f | |||
| CHEMBL424204 | 165561 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm990590f | |||
| CHEMBL43216 | 165561 | 0 | None | 1 | 2 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm990590f | |||
| 10671608 | 58757 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 458 | 9 | 0 | 6 | 5.8 | CCCCN(CCCC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168646 | 58757 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 458 | 9 | 0 | 6 | 5.8 | CCCCN(CCCC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 11247120 | 10291 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL116167 | 10291 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 6.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 44341738 | 10041 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 332 | 6 | 0 | 2 | 6.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(C)cc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115154 | 10041 | 1 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 332 | 6 | 0 | 2 | 6.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(C)cc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 44341729 | 10406 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.1 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL116280 | 10406 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.1 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 46891011 | 6437 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 438 | 3 | 0 | 4 | 6.0 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCC(C)CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082444 | 6437 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 438 | 3 | 0 | 4 | 6.0 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCC(C)CC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780059 | 166602 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 458 | 6 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)CCc4ccncc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL428044 | 166602 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 458 | 6 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)CCc4ccncc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 44337516 | 7587 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 338 | 7 | 1 | 3 | 4.8 | CCCN(c1n[nH]c(-c2c(C)cc(C)cc2C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL108784 | 7587 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 338 | 7 | 1 | 3 | 4.8 | CCCN(c1n[nH]c(-c2c(C)cc(C)cc2C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 44317667 | 104413 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 406 | 8 | 1 | 3 | 6.5 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C(C)C)c(Cl)c1 | 10.1021/jm049974i | |||
| CHEMBL310343 | 104413 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 406 | 8 | 1 | 3 | 6.5 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C(C)C)c(Cl)c1 | 10.1021/jm049974i | |||
| 10572455 | 57690 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 389 | 7 | 1 | 5 | 4.8 | C=CCNc1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL166897 | 57690 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 389 | 7 | 1 | 5 | 4.8 | C=CCNc1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 20780009 | 6626 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 466 | 6 | 0 | 4 | 6.0 | CCCN(CC1CC1)C(=O)c1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083299 | 6626 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 466 | 6 | 0 | 4 | 6.0 | CCCN(CC1CC1)C(=O)c1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 44587490 | 188120 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 361 | 7 | 0 | 4 | 5.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1Cl | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL498319 | 188120 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 361 | 7 | 0 | 4 | 5.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1Cl | 10.1016/j.bmcl.2008.07.063 | |||
| 44337293 | 5311 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 344 | 7 | 0 | 4 | 4.5 | CCCN(c1nc(-c2ccc(Cl)cc2)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL106728 | 5311 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 344 | 7 | 0 | 4 | 4.5 | CCCN(c1nc(-c2ccc(Cl)cc2)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 10791657 | 58725 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 504 | 9 | 0 | 9 | 3.3 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(OC(F)(F)F)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168536 | 58725 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 504 | 9 | 0 | 9 | 3.3 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(OC(F)(F)F)cc1Br | 10.1021/jm980224g | |||
| 10765120 | 58263 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 430 | 7 | 0 | 7 | 4.1 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(C(C)=O)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168252 | 58263 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 430 | 7 | 0 | 7 | 4.1 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(C(C)=O)cc1Br | 10.1021/jm980224g | |||
| 44460600 | 105127 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 412 | 8 | 1 | 3 | 6.3 | CCc1ccccc1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL311431 | 105127 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 412 | 8 | 1 | 3 | 6.3 | CCc1ccccc1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 46881383 | 7164 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 408 | 6 | 0 | 4 | 5.3 | CCCN(CC1CCC1)C(=O)c1c(C)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1085431 | 7164 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 408 | 6 | 0 | 4 | 5.3 | CCCN(CC1CCC1)C(=O)c1c(C)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 10640801 | 58782 | 1 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 339 | 2 | 0 | 3 | 3.5 | Cc1cc(C)nc(N(C)c2ccc(I)cc2)n1 | 10.1021/jm980222w | |||
| CHEMBL168764 | 58782 | 1 | None | - | 1 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 339 | 2 | 0 | 3 | 3.5 | Cc1cc(C)nc(N(C)c2ccc(I)cc2)n1 | 10.1021/jm980222w | |||
| 44397565 | 122636 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 580 | 9 | 0 | 4 | 8.5 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCc4ccccc4)CCc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL360389 | 122636 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 580 | 9 | 0 | 4 | 8.5 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCc4ccccc4)CCc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 44318056 | 205250 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2Cl)c(Cl)c1 | 10.1021/jm049974i | |||
| CHEMBL78884 | 205250 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2Cl)c(Cl)c1 | 10.1021/jm049974i | |||
| 44443609 | 94155 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 420 | 10 | 1 | 6 | 5.7 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(COC(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL249430 | 94155 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 420 | 10 | 1 | 6 | 5.7 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(COC(C)C)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 44460599 | 168122 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 6.4 | Cc1cccc(C)c1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL432928 | 168122 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 6.4 | Cc1cccc(C)c1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 44443578 | 154849 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 327 | 8 | 2 | 5 | 4.6 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1cccc(C)n1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL400531 | 154849 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 327 | 8 | 2 | 5 | 4.6 | CCc1nc(NC(CC)CC)c(CC)nc1Nc1cccc(C)n1 | 10.1016/j.bmcl.2007.09.008 | |||
| 20780184 | 67097 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 7.3 | CCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187362 | 67097 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 7.3 | CCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 20780065 | 166375 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 558 | 7 | 0 | 4 | 7.6 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CC4)CC(F)(F)C(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL427527 | 166375 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 558 | 7 | 0 | 4 | 7.6 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CC4)CC(F)(F)C(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 44341855 | 114808 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 467 | 8 | 0 | 5 | 6.5 | CCCCN(CCc1ccncc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL334061 | 114808 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 467 | 8 | 0 | 5 | 6.5 | CCCCN(CCc1ccncc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 10502734 | 120446 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 429 | 3 | 0 | 3 | 6.8 | Cc1cc(-c2ccccc2)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL353916 | 120446 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 429 | 3 | 0 | 3 | 6.8 | Cc1cc(-c2ccccc2)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 20780265 | 6549 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 560 | 7 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4ccc(F)cc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082963 | 6549 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 560 | 7 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4ccc(F)cc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11307122 | 73657 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 532 | 9 | 1 | 7 | 6.5 | COc1cc(COc2ccc(S(=O)(=O)c3ccc(C)nc3Nc3c(C)cc(C)cc3C)cc2)cc(OC)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL201798 | 73657 | 0 | None | - | 1 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 532 | 9 | 1 | 7 | 6.5 | COc1cc(COc2ccc(S(=O)(=O)c3ccc(C)nc3Nc3c(C)cc(C)cc3C)cc2)cc(OC)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44341861 | 9600 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 384 | 8 | 0 | 4 | 6.0 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112549 | 9600 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 384 | 8 | 0 | 4 | 6.0 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 20780288 | 5589 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 4.9 | Cc1cc(C)c(N2CCCn3c2nc(C)c3C(=O)N(CC2CC2)CC2CC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1077158 | 5589 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 4.9 | Cc1cc(C)c(N2CCCn3c2nc(C)c3C(=O)N(CC2CC2)CC2CC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 44337533 | 167869 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 326 | 6 | 0 | 4 | 4.4 | CCCN(CCC)c1nc(-c2ccc(Cl)cc2Cl)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL431067 | 167869 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 326 | 6 | 0 | 4 | 4.4 | CCCN(CCC)c1nc(-c2ccc(Cl)cc2Cl)n(C)n1 | 10.1021/jm049339c | |||
| 44337577 | 5344 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 390 | 6 | 0 | 5 | 5.3 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(C)n1)c1ccccc1OC | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL106874 | 5344 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 390 | 6 | 0 | 5 | 5.3 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(C)n1)c1ccccc1OC | 10.1016/s0960-894x(01)00657-6 | |||
| 44386313 | 120826 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 514 | 8 | 0 | 7 | 5.5 | CCCCN(CC)c1nc(C)nc2c1nc(N1CCOCC1)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL355803 | 120826 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 514 | 8 | 0 | 7 | 5.5 | CCCCN(CC)c1nc(C)nc2c1nc(N1CCOCC1)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10550837 | 57828 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 434 | 7 | 2 | 8 | 2.2 | Cc1nc(N(CCO)CCO)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| CHEMBL167024 | 57828 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 434 | 7 | 2 | 8 | 2.2 | Cc1nc(N(CCO)CCO)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| 10041172 | 162463 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 311 | 4 | 2 | 3 | 3.6 | C#Cc1cccc(/N=C(/NNc2ccccc2Cl)C(C)=O)c1 | 10.1021/jm025512y | |||
| CHEMBL416693 | 162463 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 311 | 4 | 2 | 3 | 3.6 | C#Cc1cccc(/N=C(/NNc2ccccc2Cl)C(C)=O)c1 | 10.1021/jm025512y | |||
| 10688248 | 58809 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 335 | 4 | 0 | 4 | 4.0 | CCN(c1nc(C)cc(C)n1)c1ccc(OC)cc1Br | 10.1021/jm980222w | |||
| CHEMBL168824 | 58809 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 335 | 4 | 0 | 4 | 4.0 | CCN(c1nc(C)cc(C)n1)c1ccc(OC)cc1Br | 10.1021/jm980222w | |||
| 44341697 | 9946 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL114649 | 9946 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 10319873 | 94265 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL250282 | 94265 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 21916156 | 6895 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 7.3 | CCCN(Cc1ccc(F)cc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084297 | 6895 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 7.3 | CCCN(Cc1ccc(F)cc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916243 | 6966 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.7 | CCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084564 | 6966 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.7 | CCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916231 | 7411 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 542 | 7 | 0 | 4 | 7.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCc4ccccc4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086522 | 7411 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 542 | 7 | 0 | 4 | 7.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCc4ccccc4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11395654 | 78327 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCC[C@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2094064 | 78327 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCC[C@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2109726 | 78327 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCC[C@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| 44352370 | 18883 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 455 | 8 | 1 | 4 | 7.0 | CCCN(Cc1oc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL128310 | 18883 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 455 | 8 | 1 | 4 | 7.0 | CCCN(Cc1oc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 18691315 | 98243 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 453 | 6 | 1 | 4 | 6.2 | CCN(c1nc(C)cc(-c2ccccc2C(=O)O)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL274439 | 98243 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 453 | 6 | 1 | 4 | 6.2 | CCN(c1nc(C)cc(-c2ccccc2C(=O)O)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10268909 | 193556 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 341 | 7 | 0 | 4 | 5.0 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2C)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL526829 | 193556 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 341 | 7 | 0 | 4 | 5.0 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2C)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 20780126 | 168251 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 482 | 6 | 0 | 4 | 6.5 | CCCN(CC1CC1)C(=O)c1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL433763 | 168251 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 482 | 6 | 0 | 4 | 6.5 | CCCN(CC1CC1)C(=O)c1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 10686839 | 58144 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 315 | 5 | 0 | 4 | 5.1 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1SC | 10.1021/jm980222w | |||
| CHEMBL167871 | 58144 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 315 | 5 | 0 | 4 | 5.1 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1SC | 10.1021/jm980222w | |||
| 10787443 | 59035 | 0 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 404 | 3 | 0 | 2 | 6.9 | Cc1cc(-c2ccccc2)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL169359 | 59035 | 0 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 404 | 3 | 0 | 2 | 6.9 | Cc1cc(-c2ccccc2)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 20780122 | 93840 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 423 | 7 | 0 | 5 | 5.9 | CCCCN(CC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247755 | 93840 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 423 | 7 | 0 | 5 | 5.9 | CCCCN(CC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780177 | 147004 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 421 | 6 | 0 | 5 | 5.5 | CCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL392654 | 147004 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 421 | 6 | 0 | 5 | 5.5 | CCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 44446722 | 94805 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 376 | 8 | 0 | 3 | 6.4 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2CC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253491 | 94805 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 376 | 8 | 0 | 3 | 6.4 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2CC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL2372911 | 210312 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | None | None | None | CCCC[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](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm034180+ | |||||
| 10838946 | 59064 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 494 | 8 | 1 | 7 | 5.1 | COCC(Cc1ccccc1)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169528 | 59064 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 494 | 8 | 1 | 7 | 5.1 | COCC(Cc1ccccc1)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 12967647 | 18941 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 431 | 7 | 1 | 4 | 6.4 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL128625 | 18941 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 431 | 7 | 1 | 4 | 6.4 | CCCN(CC1CC1)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| 20780124 | 67413 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 428 | 6 | 0 | 4 | 5.8 | CCCN(CC1CC1)C(=O)c1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL188849 | 67413 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 428 | 6 | 0 | 4 | 5.8 | CCCN(CC1CC1)C(=O)c1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 44392802 | 122179 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 10 | 1 | 4 | 5.2 | CCCN(CC1CC1)c1cc(C(O)c2c(CC)cc(CC)cc2CC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL359745 | 122179 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 10 | 1 | 4 | 5.2 | CCCN(CC1CC1)c1cc(C(O)c2c(CC)cc(CC)cc2CC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 20780186 | 93872 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 5 | 0 | 5 | 5.1 | CCN(CC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247957 | 93872 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 395 | 5 | 0 | 5 | 5.1 | CCN(CC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780149 | 67306 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.2 | CCCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL188358 | 67306 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 482 | 8 | 0 | 4 | 7.2 | CCCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 10737736 | 58745 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 367 | 2 | 0 | 3 | 5.4 | Cc1cc(C)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL168590 | 58745 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 367 | 2 | 0 | 3 | 5.4 | Cc1cc(C)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 21916261 | 7504 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 404 | 3 | 0 | 4 | 5.1 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CC=CCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087172 | 7504 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 404 | 3 | 0 | 4 | 5.1 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CC=CCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 10545026 | 57890 | 1 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 339 | 2 | 0 | 3 | 3.5 | Cc1cc(C)nc(N(C)c2ccccc2I)n1 | 10.1021/jm980222w | |||
| CHEMBL167217 | 57890 | 1 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 339 | 2 | 0 | 3 | 3.5 | Cc1cc(C)nc(N(C)c2ccccc2I)n1 | 10.1021/jm980222w | |||
| 53309547 | 63997 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 393 | 9 | 1 | 3 | 7.0 | CCCCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807037 | 63997 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 393 | 9 | 1 | 3 | 7.0 | CCCCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 15490819 | 98149 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 438 | 6 | 1 | 4 | 6.5 | CCN(c1nc(C)cc(-c2ccccc2NC)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL273745 | 98149 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 438 | 6 | 1 | 4 | 6.5 | CCN(c1nc(C)cc(-c2ccccc2NC)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 44341718 | 97384 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 446 | 9 | 0 | 4 | 7.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C(C)C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL269690 | 97384 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 446 | 9 | 0 | 4 | 7.7 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C(C)C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 10165732 | 64310 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 537 | 9 | 1 | 5 | 8.3 | CCCN(Cc1ccc(OC)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181084 | 64310 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 537 | 9 | 1 | 5 | 8.3 | CCCN(Cc1ccc(OC)cc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 20780140 | 124064 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 494 | 7 | 0 | 4 | 7.2 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3ccc(Cl)cc3Cl)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL363218 | 124064 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 494 | 7 | 0 | 4 | 7.2 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3ccc(Cl)cc3Cl)c3ccccc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 44460572 | 104762 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccccc1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL310773 | 104762 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 398 | 7 | 1 | 3 | 6.1 | Cc1ccccc1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 22324329 | 104137 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 373 | 9 | 0 | 6 | 3.9 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL309440 | 104137 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 373 | 9 | 0 | 6 | 3.9 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 11122528 | 65228 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 413 | 10 | 0 | 7 | 4.0 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(OC)cc(OC)cc2OC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182643 | 65228 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 413 | 10 | 0 | 7 | 4.0 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(OC)cc(OC)cc2OC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 44392773 | 66657 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 349 | 7 | 0 | 4 | 4.4 | C=CCN(CC=C)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL185329 | 66657 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 349 | 7 | 0 | 4 | 4.4 | C=CCN(CC=C)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 10786842 | 57520 | 1 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 395 | 4 | 0 | 3 | 5.0 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1I | 10.1021/jm980223o | |||
| CHEMBL166162 | 57520 | 1 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 395 | 4 | 0 | 3 | 5.0 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1I | 10.1021/jm980223o | |||
| 10786842 | 57520 | 1 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 395 | 4 | 0 | 3 | 5.0 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1I | 10.1021/jm980222w | |||
| CHEMBL166162 | 57520 | 1 | None | - | 1 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 395 | 4 | 0 | 3 | 5.0 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1I | 10.1021/jm980222w | |||
| 44308172 | 162687 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 377 | 6 | 1 | 5 | 5.2 | CCCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL417039 | 162687 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 377 | 6 | 1 | 5 | 5.2 | CCCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 21916214 | 7580 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 524 | 7 | 0 | 4 | 7.0 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CCc2ccccc2)CC(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087803 | 7580 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 524 | 7 | 0 | 4 | 7.0 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CCc2ccccc2)CC(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 10301060 | 64865 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 507 | 8 | 1 | 4 | 8.3 | CCCN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL182133 | 64865 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 507 | 8 | 1 | 4 | 8.3 | CCCN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 10527943 | 59047 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 459 | 8 | 1 | 7 | 4.5 | CCCC(CN(C)C)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169421 | 59047 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 459 | 8 | 1 | 7 | 4.5 | CCCC(CN(C)C)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44392747 | 66321 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 367 | 5 | 0 | 5 | 3.9 | COC[C@@H]1CCCN1c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL184963 | 66321 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 367 | 5 | 0 | 5 | 3.9 | COC[C@@H]1CCCN1c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 44341857 | 110420 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 459 | 7 | 0 | 5 | 6.0 | CCCCN(CC1CCCN1C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL324497 | 110420 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 459 | 7 | 0 | 5 | 6.0 | CCCCN(CC1CCCN1C)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 44443593 | 94333 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 406 | 10 | 1 | 6 | 5.3 | CCOCC(Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL250618 | 94333 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 406 | 10 | 1 | 6 | 5.3 | CCOCC(Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 11727011 | 203703 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 321 | 4 | 2 | 3 | 4.2 | CC(=O)/C(=N\c1ccc(Cl)cc1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| CHEMBL67570 | 203703 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 321 | 4 | 2 | 3 | 4.2 | CC(=O)/C(=N\c1ccc(Cl)cc1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| 44317976 | 104764 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 415 | 6 | 2 | 4 | 6.1 | COc1ccc(C(=O)C(Nc2ccc(Cl)cc2Cl)c2ccccc2C)cc1O | 10.1021/jm049974i | |||
| CHEMBL310783 | 104764 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 415 | 6 | 2 | 4 | 6.1 | COc1ccc(C(=O)C(Nc2ccc(Cl)cc2Cl)c2ccccc2C)cc1O | 10.1021/jm049974i | |||
| 44318168 | 206015 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 389 | 9 | 0 | 5 | 4.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CCF)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL84974 | 206015 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 389 | 9 | 0 | 5 | 4.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CCF)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 11235365 | 66285 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 414 | 7 | 0 | 6 | 5.1 | CCCN(CCC)c1c(Cl)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL184740 | 66285 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 414 | 7 | 0 | 6 | 5.1 | CCCN(CCC)c1c(Cl)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10672294 | 59104 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 477 | 10 | 0 | 8 | 4.2 | CCOCC(COCC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169751 | 59104 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 477 | 10 | 0 | 8 | 4.2 | CCOCC(COCC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10166079 | 123113 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 547 | 7 | 1 | 4 | 8.4 | FC(F)(F)CN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL361108 | 123113 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 547 | 7 | 1 | 4 | 8.4 | FC(F)(F)CN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 10833915 | 120745 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 384 | 9 | 0 | 8 | 2.7 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1 | 10.1021/jm980224g | |||
| CHEMBL355008 | 120745 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 384 | 9 | 0 | 8 | 2.7 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1 | 10.1021/jm980224g | |||
| 11282674 | 73917 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 463 | 9 | 1 | 6 | 6.0 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCCCCC#N)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL201982 | 73917 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 463 | 9 | 1 | 6 | 6.0 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCCCCC#N)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 11677548 | 135178 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 374 | 3 | 0 | 4 | 5.2 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2CC(C)C | 10.1021/jm049085v | |||
| CHEMBL371981 | 135178 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 374 | 3 | 0 | 4 | 5.2 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2CC(C)C | 10.1021/jm049085v | |||
| 44443580 | 94111 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 353 | 6 | 2 | 5 | 5.1 | CCC(CC)Nc1nc(C)c(Nc2ncc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL249191 | 94111 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 353 | 6 | 2 | 5 | 5.1 | CCC(CC)Nc1nc(C)c(Nc2ncc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| 44318106 | 106133 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 385 | 9 | 0 | 5 | 4.7 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL313479 | 106133 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 385 | 9 | 0 | 5 | 4.7 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 10790606 | 58098 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 471 | 9 | 0 | 6 | 5.2 | C=CCN(CC=C)c1nc(C)nc(N(CC)c2ccc(OC(F)(F)F)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167463 | 58098 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 471 | 9 | 0 | 6 | 5.2 | C=CCN(CC=C)c1nc(C)nc(N(CC)c2ccc(OC(F)(F)F)cc2Br)n1 | 10.1021/jm980222w | |||
| 10741479 | 58826 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 433 | 9 | 0 | 5 | 5.9 | CCCN(CCC)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL168844 | 58826 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 433 | 9 | 0 | 5 | 5.9 | CCCN(CCC)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10502738 | 165705 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 429 | 9 | 0 | 5 | 5.4 | C=CCN(CC=C)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL424555 | 165705 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 429 | 9 | 0 | 5 | 5.4 | C=CCN(CC=C)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10808915 | 120813 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.8 | CCCC(CCC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL355689 | 120813 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.8 | CCCC(CCC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 44341815 | 9458 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 448 | 10 | 0 | 5 | 6.3 | CCCCCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL111838 | 9458 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 448 | 10 | 0 | 5 | 6.3 | CCCCCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 11417694 | 67453 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL189089 | 67453 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 382 | 7 | 1 | 5 | 4.4 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(OC)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| 44307724 | 102179 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 371 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3C)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL302742 | 102179 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 371 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1nc(C)nc2c(-c3ccc(Cl)cc3C)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 11178741 | 106382 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 426 | 10 | 0 | 5 | 6.3 | CCCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3085414 | 106382 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 426 | 10 | 0 | 5 | 6.3 | CCCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3139324 | 106382 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 426 | 10 | 0 | 5 | 6.3 | CCCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 9868427 | 63840 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 450 | 5 | 0 | 6 | 6.3 | CCN(CC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL18029 | 63840 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 450 | 5 | 0 | 6 | 6.3 | CCN(CC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| 9956594 | 98124 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 474 | 7 | 0 | 6 | 5.7 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL273559 | 98124 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 474 | 7 | 0 | 6 | 5.7 | CCCN(CC1CC1)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| 44341491 | 9490 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 376 | 5 | 0 | 4 | 5.5 | CCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112031 | 9490 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 376 | 5 | 0 | 4 | 5.5 | CCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 9868427 | 63840 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 450 | 5 | 0 | 6 | 6.3 | CCN(CC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| CHEMBL18029 | 63840 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 450 | 5 | 0 | 6 | 6.3 | CCN(CC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| 22249094 | 63940 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 365 | 7 | 1 | 3 | 6.2 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806728 | 63940 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 365 | 7 | 1 | 3 | 6.2 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 10223332 | 63948 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 411 | 9 | 1 | 5 | 5.8 | CCc1nc(-c2ccc(OC)cc2OC(F)(F)F)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806736 | 63948 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 411 | 9 | 1 | 5 | 5.8 | CCc1nc(-c2ccc(OC)cc2OC(F)(F)F)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 9801390 | 109735 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 6.4 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL322969 | 109735 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 404 | 7 | 0 | 4 | 6.4 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(CC)c12 | 10.1016/s0960-894x(03)00621-8 | |||
| 46871760 | 6810 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 472 | 7 | 0 | 4 | 6.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3Cl)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083921 | 6810 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 472 | 7 | 0 | 4 | 6.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3Cl)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| 122193717 | 123956 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 472 | 6 | 1 | 4 | 6.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628734 | 123956 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 472 | 6 | 1 | 4 | 6.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 53310133 | 63944 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 385 | 10 | 1 | 5 | 5.7 | CCc1nc(-c2ccc(OC(C)C)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806732 | 63944 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 385 | 10 | 1 | 5 | 5.7 | CCc1nc(-c2ccc(OC(C)C)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 9951076 | 67411 | 2 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL188844 | 67411 | 2 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL2165204 | 67411 | 2 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 366 | 7 | 0 | 6 | 4.1 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3)c(C)nn12 | 10.1021/jm040058e | |||
| 11177298 | 122982 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 408 | 9 | 0 | 6 | 5.2 | CCCCN(CCCC)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL360851 | 122982 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 408 | 9 | 0 | 6 | 5.2 | CCCCN(CCCC)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 11224781 | 124523 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 415 | 6 | 0 | 3 | 7.0 | CCCC(CCC)N1CCc2cn(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL364016 | 124523 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 415 | 6 | 0 | 3 | 7.0 | CCCC(CCC)N1CCc2cn(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 10717500 | 120251 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 429 | 7 | 0 | 5 | 5.6 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL352340 | 120251 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 429 | 7 | 0 | 5 | 5.6 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10551312 | 120419 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 444 | 8 | 0 | 7 | 4.0 | C=CCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL353732 | 120419 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 444 | 8 | 0 | 7 | 4.0 | C=CCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 22249116 | 64001 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 353 | 6 | 1 | 4 | 5.4 | CCC(CC)Nc1nc(C)c(-c2ccc(Cl)cc2Cl)nc1OC | 10.1021/jm200365y | |||
| CHEMBL1807041 | 64001 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 353 | 6 | 1 | 4 | 5.4 | CCC(CC)Nc1nc(C)c(-c2ccc(Cl)cc2Cl)nc1OC | 10.1021/jm200365y | |||
| 44384802 | 59935 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 381 | 6 | 0 | 6 | 4.0 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL173196 | 59935 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 381 | 6 | 0 | 6 | 4.0 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| 9931098 | 58767 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 404 | 8 | 0 | 8 | 3.8 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL168676 | 58767 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 404 | 8 | 0 | 8 | 3.8 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 10717499 | 129399 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 429 | 7 | 1 | 5 | 6.0 | CCCC(CC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL367110 | 129399 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 429 | 7 | 1 | 5 | 6.0 | CCCC(CC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 9908466 | 114804 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL334039 | 114804 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 44341739 | 113501 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 392 | 6 | 1 | 5 | 4.5 | CCCN(CCO)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL332040 | 113501 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 392 | 6 | 1 | 5 | 4.5 | CCCN(CCO)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 44341737 | 114095 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 388 | 5 | 0 | 4 | 5.5 | CCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL332721 | 114095 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 388 | 5 | 0 | 4 | 5.5 | CCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 46872038 | 123957 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 5.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628735 | 123957 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 5.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Br)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| 46872037 | 123958 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 5.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628736 | 123958 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 430 | 6 | 1 | 4 | 5.2 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 122193718 | 123959 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 5.1 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C)cc1Cl | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628737 | 123959 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 5.1 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C)cc1Cl | 10.1016/j.bmcl.2015.10.010 | |||
| 10200724 | 63975 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 395 | 8 | 1 | 4 | 5.9 | CCc1nc(-c2ccc(OC)cc2C(F)(F)F)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806956 | 63975 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 395 | 8 | 1 | 4 | 5.9 | CCc1nc(-c2ccc(OC)cc2C(F)(F)F)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 22248884 | 64006 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 397 | 8 | 1 | 5 | 5.3 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(C(F)(F)F)cc1OC | 10.1021/jm200365y | |||
| CHEMBL1807050 | 64006 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 397 | 8 | 1 | 5 | 5.3 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(C(F)(F)F)cc1OC | 10.1021/jm200365y | |||
| CHEMBL2372650 | 210279 | 0 | None | 2 | 2 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(N)=O | 10.1021/jm990590f | |||||
| 10375 | 2739 | 18 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm050384+ | |||
| 9888194 | 2739 | 18 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm050384+ | |||
| CHEMBL188907 | 2739 | 18 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm050384+ | |||
| 10552437 | 59110 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 472 | 10 | 1 | 6 | 6.6 | CCCCC(CCCC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169781 | 59110 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 472 | 10 | 1 | 6 | 6.6 | CCCCC(CCCC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341875 | 168085 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 400 | 6 | 0 | 2 | 7.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL432607 | 168085 | 1 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 400 | 6 | 0 | 2 | 7.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 21916240 | 7071 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 438 | 7 | 0 | 4 | 6.1 | C=CCN(CCC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084999 | 7071 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 438 | 7 | 0 | 4 | 6.1 | C=CCN(CCC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 9912040 | 120769 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 458 | 8 | 0 | 7 | 4.3 | COCCN(CC1CC1)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL355329 | 120769 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 458 | 8 | 0 | 7 | 4.3 | COCCN(CC1CC1)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 15490820 | 168726 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 477 | 5 | 0 | 4 | 6.6 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(C(C)=O)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL436978 | 168726 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 477 | 5 | 0 | 4 | 6.6 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(C(C)=O)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 23595014 | 64011 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 385 | 8 | 1 | 5 | 5.3 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)F)cc2Cl)nc1OC | 10.1021/jm200365y | |||
| CHEMBL1807055 | 64011 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 385 | 8 | 1 | 5 | 5.3 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)F)cc2Cl)nc1OC | 10.1021/jm200365y | |||
| 10695347 | 59070 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 461 | 9 | 0 | 7 | 4.1 | COCCN(CCOC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169561 | 59070 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 461 | 9 | 0 | 7 | 4.1 | COCCN(CCOC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10741252 | 120254 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 429 | 10 | 0 | 8 | 4.1 | COCCN(CCOC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1SC | 10.1021/jm980224g | |||
| CHEMBL352353 | 120254 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 429 | 10 | 0 | 8 | 4.1 | COCCN(CCOC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1SC | 10.1021/jm980224g | |||
| 44341901 | 10071 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 414 | 9 | 0 | 5 | 6.0 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(OC)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL115349 | 10071 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 414 | 9 | 0 | 5 | 6.0 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(OC)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 10303689 | 123828 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 9.0 | Fc1ccc(CN(CCC(F)(F)F)Cc2sc(Nc3c(Cl)cc(Cl)cc3Cl)nc2C(F)(F)F)cc1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL362448 | 123828 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 579 | 8 | 1 | 4 | 9.0 | Fc1ccc(CN(CCC(F)(F)F)Cc2sc(Nc3c(Cl)cc(Cl)cc3Cl)nc2C(F)(F)F)cc1 | 10.1016/j.bmcl.2004.10.055 | |||
| 11429341 | 67362 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 394 | 8 | 1 | 6 | 5.2 | CCCC(CCC)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL188609 | 67362 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 394 | 8 | 1 | 6 | 5.2 | CCCC(CCC)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44392678 | 64646 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(NC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL181812 | 64646 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.4 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(NC)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44392749 | 66708 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 352 | 6 | 1 | 6 | 3.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3N)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL185570 | 66708 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 352 | 6 | 1 | 6 | 3.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3N)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 11153953 | 10144 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 404 | 8 | 1 | 3 | 6.6 | CCCCN(CCCC)c1cc(C)[nH]c2c(-c3ccc(Cl)cc3Cl)nnc1-2 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL115759 | 10144 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 404 | 8 | 1 | 3 | 6.6 | CCCCN(CCCC)c1cc(C)[nH]c2c(-c3ccc(Cl)cc3Cl)nnc1-2 | 10.1016/s0960-894x(03)00621-8 | |||
| 44305256 | 102357 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 376 | 6 | 0 | 4 | 5.6 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cnn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL303789 | 102357 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 376 | 6 | 0 | 4 | 5.6 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cnn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 11749772 | 68647 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 394 | 5 | 0 | 5 | 4.6 | CCC(COC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL191903 | 68647 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 394 | 5 | 0 | 5 | 4.6 | CCC(COC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 44318123 | 205693 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 403 | 11 | 0 | 7 | 3.5 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CCOC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL82275 | 205693 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 403 | 11 | 0 | 7 | 3.5 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CCOC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 22248970 | 63989 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 368 | 6 | 0 | 3 | 6.5 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1SC(C)CC | 10.1021/jm200365y | |||
| CHEMBL1807029 | 63989 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 368 | 6 | 0 | 3 | 6.5 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1SC(C)CC | 10.1021/jm200365y | |||
| 44443567 | 154987 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 300 | 6 | 1 | 5 | 4.2 | CCC(CC)Nc1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL401295 | 154987 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 300 | 6 | 1 | 5 | 4.2 | CCC(CC)Nc1nc(C)c(Oc2cc(C)ccn2)nc1C | 10.1016/j.bmcl.2007.09.008 | |||
| 20780131 | 67545 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 7.6 | CCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL189714 | 67545 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 504 | 7 | 0 | 4 | 7.6 | CCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 10645784 | 57481 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 419 | 8 | 1 | 5 | 5.8 | CCC(CC)Nc1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL165824 | 57481 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 419 | 8 | 1 | 5 | 5.8 | CCC(CC)Nc1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10553475 | 169495 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 500 | 10 | 0 | 8 | 5.2 | CCCCN(Cc1nnnn1C)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL443235 | 169495 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 500 | 10 | 0 | 8 | 5.2 | CCCCN(Cc1nnnn1C)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 20780279 | 122321 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 434 | 6 | 0 | 4 | 4.9 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL359832 | 122321 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 434 | 6 | 0 | 4 | 4.9 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780026 | 122347 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 454 | 6 | 0 | 4 | 5.3 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(C)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL359936 | 122347 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 454 | 6 | 0 | 4 | 5.3 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)F)CCN2c1c(C)cc(C)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| 44305246 | 102323 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 374 | 2 | 0 | 4 | 5.3 | Cc1cc(N2CCCCC2)n2nc(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL303593 | 102323 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 374 | 2 | 0 | 4 | 5.3 | Cc1cc(N2CCCCC2)n2nc(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(98)00372-2 | |||
| 20780161 | 93722 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 401 | 7 | 0 | 5 | 5.3 | C=CCN(CCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247152 | 93722 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 401 | 7 | 0 | 5 | 5.3 | C=CCN(CCC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 44446741 | 94650 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 489 | 10 | 1 | 5 | 6.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCC(O)CC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL252494 | 94650 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 489 | 10 | 1 | 5 | 6.3 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCC(O)CC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 20780154 | 67554 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 596 | 9 | 0 | 4 | 8.6 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3ccc(C(C)C)cc3Br)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL189798 | 67554 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 596 | 9 | 0 | 4 | 8.6 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3ccc(C(C)C)cc3Br)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 20780272 | 63839 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 430 | 7 | 0 | 4 | 5.6 | CCCN(Cc1ccccc1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL180284 | 63839 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 430 | 7 | 0 | 4 | 5.6 | CCCN(Cc1ccccc1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780061 | 93329 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 455 | 9 | 0 | 7 | 4.3 | COCCN(CCOC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL245298 | 93329 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 455 | 9 | 0 | 7 | 4.3 | COCCN(CCOC)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 11257259 | 68324 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 371 | 10 | 0 | 4 | 5.5 | CCCC(CCC)N1CCc2cn(CCCOC(C)C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL191650 | 68324 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 371 | 10 | 0 | 4 | 5.5 | CCCC(CCC)N1CCc2cn(CCCOC(C)C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 10946918 | 203678 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 312 | 4 | 2 | 4 | 3.6 | CC(=O)/C(=N\Nc1ccccc1C#N)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| CHEMBL67448 | 203678 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 312 | 4 | 2 | 4 | 3.6 | CC(=O)/C(=N\Nc1ccccc1C#N)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| 10500311 | 59771 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 385 | 8 | 0 | 9 | 1.9 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)nc1C | 10.1021/jm980224g | |||
| CHEMBL172570 | 59771 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 385 | 8 | 0 | 9 | 1.9 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)nc1C | 10.1021/jm980224g | |||
| 11045497 | 102391 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 321 | 4 | 2 | 3 | 4.4 | CC(=O)/C(=N\Nc1ccccc1Cl)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| CHEMBL303931 | 102391 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 321 | 4 | 2 | 3 | 4.4 | CC(=O)/C(=N\Nc1ccccc1Cl)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| 11502109 | 122349 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 394 | 7 | 0 | 4 | 4.8 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL359956 | 122349 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 394 | 7 | 0 | 4 | 4.8 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 44446723 | 94806 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 378 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253492 | 94806 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 378 | 8 | 0 | 4 | 5.9 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44389111 | 172437 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 525 | 8 | 1 | 4 | 8.4 | CCCN(Cc1ccccc1F)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL447836 | 172437 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 525 | 8 | 1 | 4 | 8.4 | CCCN(Cc1ccccc1F)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 44385503 | 61334 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 461 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL176721 | 61334 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 461 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 44341949 | 110790 | 1 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 318 | 6 | 0 | 2 | 5.8 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL326074 | 110790 | 1 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 318 | 6 | 0 | 2 | 5.8 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 10206448 | 64570 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 485 | 9 | 1 | 4 | 7.9 | CCCN(CCC1CC1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181566 | 64570 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 485 | 9 | 1 | 4 | 7.9 | CCCN(CCC1CC1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 20780033 | 64835 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 448 | 7 | 0 | 4 | 5.7 | CCCN(Cc1cccc(F)c1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL181989 | 64835 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 448 | 7 | 0 | 4 | 5.7 | CCCN(Cc1cccc(F)c1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780075 | 67240 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 558 | 7 | 0 | 4 | 8.2 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC(F)(F)F)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187975 | 67240 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 558 | 7 | 0 | 4 | 8.2 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC(F)(F)F)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 11155555 | 78343 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)[C@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL2093959 | 78343 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)[C@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL2110007 | 78343 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)[C@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| 10402860 | 103125 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 305 | 4 | 2 | 3 | 3.7 | CC(=O)/C(=N\c1cccc(F)c1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| CHEMBL307795 | 103125 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 305 | 4 | 2 | 3 | 3.7 | CC(=O)/C(=N\c1cccc(F)c1)NNc1ccccc1Cl | 10.1021/jm025512y | |||
| 11778680 | 203706 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 285 | 4 | 2 | 3 | 3.4 | CC(=O)/C(=N\c1cccc(F)c1)NNc1ccccc1C | 10.1021/jm025512y | |||
| CHEMBL67603 | 203706 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 285 | 4 | 2 | 3 | 3.4 | CC(=O)/C(=N\c1cccc(F)c1)NNc1ccccc1C | 10.1021/jm025512y | |||
| 44347421 | 16430 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 414 | 10 | 0 | 8 | 3.1 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL123197 | 16430 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 414 | 10 | 0 | 8 | 3.1 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(OC)cc3OC)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 9828535 | 165561 | 0 | None | -1 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980223o | |||
| CHEMBL424204 | 165561 | 0 | None | -1 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980223o | |||
| CHEMBL43216 | 165561 | 0 | None | -1 | 2 | Rat | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 437 | 6 | 0 | 8 | 3.0 | CCN(c1nc(C)nc(N2CCOCC2)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980223o | |||
| 21916338 | 6571 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 542 | 7 | 0 | 4 | 7.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083035 | 6571 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 542 | 7 | 0 | 4 | 7.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780150 | 145100 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 429 | 8 | 0 | 5 | 5.9 | CCCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL391170 | 145100 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 429 | 8 | 0 | 5 | 5.9 | CCCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 10164617 | 64472 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 511 | 7 | 1 | 4 | 7.6 | FC(F)(F)CN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181381 | 64472 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 511 | 7 | 1 | 4 | 7.6 | FC(F)(F)CN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 46890888 | 6526 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 475 | 6 | 0 | 5 | 5.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4ccccn4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082807 | 6526 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 475 | 6 | 0 | 5 | 5.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4ccccn4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 10477079 | 94441 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 417 | 8 | 1 | 5 | 5.8 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cccc(C)c2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL251199 | 94441 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 417 | 8 | 1 | 5 | 5.8 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cccc(C)c2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 44317800 | 205214 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 362 | 7 | 1 | 3 | 5.2 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C)c(F)c1 | 10.1021/jm049974i | |||
| CHEMBL78608 | 205214 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 362 | 7 | 1 | 3 | 5.2 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C)c(F)c1 | 10.1021/jm049974i | |||
| 9865434 | 68029 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccccc3OC)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL191395 | 68029 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.3 | CCCC(CCC)N1CCn2c(=O)n(-c3ccccc3OC)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 10526779 | 58129 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 432 | 9 | 1 | 4 | 6.7 | CCC(CC)CNc1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167738 | 58129 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 432 | 9 | 1 | 4 | 6.7 | CCC(CC)CNc1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10763375 | 115344 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 397 | 3 | 0 | 5 | 5.5 | Cc1nc(N(C)c2ccccc2)n2nc(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1021/jm9904351 | |||
| CHEMBL334935 | 115344 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 397 | 3 | 0 | 5 | 5.5 | Cc1nc(N(C)c2ccccc2)n2nc(C)c(-c3ccc(Cl)cc3Cl)c2n1 | 10.1021/jm9904351 | |||
| CHEMBL2372938 | 210319 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm034180+ | |||||
| 21916309 | 7273 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 530 | 7 | 0 | 4 | 7.1 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC(F)(F)C(F)(F)F | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1085989 | 7273 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 530 | 7 | 0 | 4 | 7.1 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC(F)(F)C(F)(F)F | 10.1016/j.bmcl.2010.04.094 | |||
| 11486120 | 62994 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 390 | 10 | 0 | 5 | 5.3 | CCCCC(CC)N(CC1CC1)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL178618 | 62994 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 390 | 10 | 0 | 5 | 5.3 | CCCCC(CC)N(CC1CC1)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 21916155 | 7506 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 424 | 3 | 0 | 5 | 4.9 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CCSCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087174 | 7506 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 424 | 3 | 0 | 5 | 4.9 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN2CCSCC2)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 10739049 | 57771 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 387 | 2 | 0 | 3 | 5.7 | Cc1cc(Cl)nc2c1c(C#N)cn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| CHEMBL166946 | 57771 | 0 | None | - | 1 | Rat | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 387 | 2 | 0 | 3 | 5.7 | Cc1cc(Cl)nc2c1c(C#N)cn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| 54586411 | 61652 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 387 | 5 | 1 | 5 | 4.6 | CCN(CCN)c1nc(C)nc2c1c1ccccc1n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.12.116 | |||
| CHEMBL1771267 | 61652 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 387 | 5 | 1 | 5 | 4.6 | CCN(CCN)c1nc(C)nc2c1c1ccccc1n2-c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.12.116 | |||
| CHEMBL2372900 | 210305 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm034180+ | |||||
| 9870876 | 64611 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 506 | 7 | 0 | 6 | 7.8 | CCC(C)N(c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br)C(C)CC | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL18173 | 64611 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 506 | 7 | 0 | 6 | 7.8 | CCC(C)N(c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br)C(C)CC | 10.1016/s0960-894x(99)00159-6 | |||
| 10316753 | 60491 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 364 | 7 | 1 | 3 | 5.2 | CCCN(c1n[nH]c(-c2ccc(Cl)cc2Cl)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| CHEMBL175536 | 60491 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 364 | 7 | 1 | 3 | 5.2 | CCCN(c1n[nH]c(-c2ccc(Cl)cc2Cl)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| 10025032 | 155238 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2ccc(C)cn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL402717 | 155238 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2ccc(C)cn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 20780068 | 124086 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 536 | 8 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC4CC4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL363281 | 124086 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 536 | 8 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC4CC4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10549751 | 120435 | 1 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 414 | 3 | 0 | 6 | 4.4 | Cc1nc(N2CCCCC2)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| CHEMBL353856 | 120435 | 1 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 414 | 3 | 0 | 6 | 4.4 | Cc1nc(N2CCCCC2)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980224g | |||
| 44341777 | 10208 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 416 | 7 | 0 | 4 | 6.4 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL115999 | 10208 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 416 | 7 | 0 | 4 | 6.4 | CCCN(CC1CC1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 10831554 | 58035 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 347 | 4 | 0 | 3 | 5.1 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| CHEMBL167264 | 58035 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 347 | 4 | 0 | 3 | 5.1 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| 10831554 | 58035 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 347 | 4 | 0 | 3 | 5.1 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| CHEMBL167264 | 58035 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 347 | 4 | 0 | 3 | 5.1 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm980222w | |||
| 10155816 | 63988 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 366 | 7 | 0 | 3 | 6.1 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1OC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807028 | 63988 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 366 | 7 | 0 | 3 | 6.1 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1OC(CC)CC | 10.1021/jm200365y | |||
| 18672272 | 62493 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 525 | 8 | 1 | 4 | 8.0 | FC(F)(F)CCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL178081 | 62493 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 525 | 8 | 1 | 4 | 8.0 | FC(F)(F)CCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 11247792 | 78344 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCC[C@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2093960 | 78344 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCC[C@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2110008 | 78344 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCC[C@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 11383383 | 123941 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 378 | 10 | 0 | 5 | 5.3 | CCCCC(CC)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL362847 | 123941 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 378 | 10 | 0 | 5 | 5.3 | CCCCC(CC)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 11154954 | 67976 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 442 | 7 | 0 | 7 | 3.7 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(S(C)(=O)=O)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL191188 | 67976 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 442 | 7 | 0 | 7 | 3.7 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(S(C)(=O)=O)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 23000016 | 9566 | 1 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 301 | 1 | 0 | 1 | 5.8 | Cc1cc(C)c2cccc(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL112389 | 9566 | 1 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 301 | 1 | 0 | 1 | 5.8 | Cc1cc(C)c2cccc(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(03)00684-x | |||
| 44306185 | 102803 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 367 | 9 | 0 | 5 | 4.6 | CCCN(c1nccc(-c2ccc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL305354 | 102803 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 367 | 9 | 0 | 5 | 4.6 | CCCN(c1nccc(-c2ccc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 44352436 | 116994 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 437 | 8 | 1 | 4 | 6.8 | CCCN(Cc1sc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL338780 | 116994 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 437 | 8 | 1 | 4 | 6.8 | CCCN(Cc1sc(Nc2ccc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44387214 | 60806 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 458 | 7 | 0 | 5 | 5.5 | CCCCN(CC)c1nc(C)cc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL176176 | 60806 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 458 | 7 | 0 | 5 | 5.5 | CCCCN(CC)c1nc(C)cc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 44443605 | 94074 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 378 | 8 | 2 | 6 | 4.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(CO)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL249012 | 94074 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 378 | 8 | 2 | 6 | 4.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(CO)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 44317728 | 105608 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 432 | 7 | 1 | 3 | 6.4 | Cc1ccccc1C(Nc1ccc(Cl)cc1C(F)(F)F)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL312239 | 105608 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 432 | 7 | 1 | 3 | 6.4 | Cc1ccccc1C(Nc1ccc(Cl)cc1C(F)(F)F)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 44318109 | 206004 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 385 | 8 | 0 | 5 | 5.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(C(C)C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL84892 | 206004 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 385 | 8 | 0 | 5 | 5.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(C(C)C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 10497535 | 59112 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 342 | 2 | 0 | 2 | 5.5 | Cc1cc(C)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL169784 | 59112 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 342 | 2 | 0 | 2 | 5.5 | Cc1cc(C)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 44384780 | 59777 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 461 | 7 | 0 | 7 | 3.8 | CCN(CCOC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL172606 | 59777 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 461 | 7 | 0 | 7 | 3.8 | CCN(CCOC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 22324333 | 105620 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 359 | 8 | 0 | 6 | 3.4 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL312336 | 105620 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 359 | 8 | 0 | 6 | 3.4 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 44392776 | 65271 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 373 | 5 | 0 | 4 | 5.4 | CCN(c1ccccc1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182825 | 65271 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 373 | 5 | 0 | 4 | 5.4 | CCN(c1ccccc1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 46891115 | 6809 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 7 | 0 | 4 | 5.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)ccn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083920 | 6809 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 7 | 0 | 4 | 5.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)ccn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11032842 | 204092 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 267 | 4 | 2 | 3 | 3.2 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1 | 10.1021/jm025512y | |||
| CHEMBL70195 | 204092 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 267 | 4 | 2 | 3 | 3.2 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1 | 10.1021/jm025512y | |||
| 44443642 | 167536 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cccc(C)n2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL430019 | 167536 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cccc(C)n2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 10623894 | 59130 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 461 | 10 | 0 | 9 | 2.8 | COCCN(CCOC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1S(C)(=O)=O | 10.1021/jm980224g | |||
| CHEMBL169841 | 59130 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 461 | 10 | 0 | 9 | 2.8 | COCCN(CCOC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1S(C)(=O)=O | 10.1021/jm980224g | |||
| 11796523 | 120374 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 422 | 8 | 0 | 6 | 4.6 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(OC)cc2OC)n1 | 10.1021/jm980222w | |||
| CHEMBL353296 | 120374 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 422 | 8 | 0 | 6 | 4.6 | CCN(CC)c1cc(C)nc(N(CC)c2c(Br)cc(OC)cc2OC)n1 | 10.1021/jm980222w | |||
| 44380639 | 120807 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 381 | 3 | 0 | 3 | 4.6 | Cc1cc(C)nc(N(C)c2ccc(C(C)C)cc2I)n1 | 10.1021/jm980223o | |||
| CHEMBL355624 | 120807 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 381 | 3 | 0 | 3 | 4.6 | Cc1cc(C)nc(N(C)c2ccc(C(C)C)cc2I)n1 | 10.1021/jm980223o | |||
| 20780051 | 93873 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 483 | 5 | 0 | 5 | 6.5 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCCC4Cc4ccccc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247958 | 93873 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 483 | 5 | 0 | 5 | 6.5 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCCC4Cc4ccccc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 21916263 | 5588 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 420 | 7 | 0 | 4 | 5.8 | C=CCN(CCC)Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1077156 | 5588 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 420 | 7 | 0 | 4 | 5.8 | C=CCN(CCC)Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 44381252 | 120482 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 493 | 10 | 0 | 10 | 2.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1N(C)C | 10.1021/jm980224g | |||
| CHEMBL354280 | 120482 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 493 | 10 | 0 | 10 | 2.5 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(Br)cc(OC)cc1N(C)C | 10.1021/jm980224g | |||
| 44381175 | 58871 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 495 | 8 | 0 | 8 | 4.5 | COCCN(Cc1cccnc1)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168858 | 58871 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 495 | 8 | 0 | 8 | 4.5 | COCCN(Cc1cccnc1)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 127033837 | 138628 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 3901 | 126 | 54 | 50 | -8.8 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)C1CCSSCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775831 | 138628 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 3901 | 126 | 54 | 50 | -8.8 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)C1CCSSCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL2372937 | 210318 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm034180+ | |||||
| 127034112 | 138609 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 4252 | 133 | 59 | 54 | -8.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)C1CCSSCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)NC(Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775707 | 138609 | 0 | None | -1 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 4252 | 133 | 59 | 54 | -8.7 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)C1CCSSCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)NC(Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)C(=O)N[C@H](Cc2ccc(NC(N)=O)cc2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 44392775 | 124647 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 399 | 10 | 0 | 6 | 4.6 | CCCN(CC1CC1)c1cc(C(C)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL364117 | 124647 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 399 | 10 | 0 | 6 | 4.6 | CCCN(CC1CC1)c1cc(C(C)c2c(OC)cc(OC)cc2OC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 46890768 | 6731 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 488 | 6 | 0 | 4 | 7.1 | CCN(Cc1ccccc1C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083720 | 6731 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 488 | 6 | 0 | 4 | 7.1 | CCN(Cc1ccccc1C)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 53310276 | 63983 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 380 | 7 | 1 | 4 | 4.9 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(C)CN(C)C | 10.1021/jm200365y | |||
| CHEMBL1807023 | 63983 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 380 | 7 | 1 | 4 | 4.9 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1NC(C)CN(C)C | 10.1021/jm200365y | |||
| 19063905 | 202969 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 399 | 7 | 0 | 3 | 5.6 | CCCN(c1ncc(C)c(-c2ccc(Br)cc2)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL63029 | 202969 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 399 | 7 | 0 | 3 | 5.6 | CCCN(c1ncc(C)c(-c2ccc(Br)cc2)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 21916094 | 6572 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 560 | 7 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4cccc(F)c4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083036 | 6572 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 560 | 7 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC(F)(F)F)Cc4cccc(F)c4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11387007 | 168838 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 530 | 8 | 1 | 7 | 6.3 | COC(=O)c1cccc(COc2ccc(S(=O)(=O)c3ccc(C)nc3Nc3c(C)cc(C)cc3C)cc2)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL437893 | 168838 | 1 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 530 | 8 | 1 | 7 | 6.3 | COC(=O)c1cccc(COc2ccc(S(=O)(=O)c3ccc(C)nc3Nc3c(C)cc(C)cc3C)cc2)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44446728 | 94836 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 362 | 7 | 0 | 3 | 6.2 | CCCN(CCC)c1cnc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253701 | 94836 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 362 | 7 | 0 | 3 | 6.2 | CCCN(CCC)c1cnc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 11175998 | 133618 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 364 | 4 | 0 | 4 | 5.0 | CCCCN1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL371367 | 133618 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 364 | 4 | 0 | 4 | 5.0 | CCCCN1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 10547488 | 103076 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 375 | 7 | 1 | 5 | 5.3 | CCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| CHEMBL307419 | 103076 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 375 | 7 | 1 | 5 | 5.3 | CCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| 10808133 | 163421 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 9 | 1 | 5 | 5.3 | CCCCN(CCCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| CHEMBL419636 | 163421 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 9 | 1 | 5 | 5.3 | CCCCN(CCCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| 10547488 | 103076 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 375 | 7 | 1 | 5 | 5.3 | CCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| CHEMBL307419 | 103076 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 375 | 7 | 1 | 5 | 5.3 | CCCN(Cc1ccccc1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| 10808133 | 163421 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 9 | 1 | 5 | 5.3 | CCCCN(CCCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| CHEMBL419636 | 163421 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 9 | 1 | 5 | 5.3 | CCCCN(CCCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| 9931738 | 61169 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 416 | 8 | 0 | 8 | 3.2 | COCCN(CCOC)c1nc(C)nc2c1sc(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL17656 | 61169 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 416 | 8 | 0 | 8 | 3.2 | COCCN(CCOC)c1nc(C)nc2c1sc(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| 10646276 | 57542 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 429 | 8 | 0 | 5 | 5.4 | C=CCN(c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1)C1CC1 | 10.1021/jm980222w | |||
| CHEMBL166345 | 57542 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 429 | 8 | 0 | 5 | 5.4 | C=CCN(c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1)C1CC1 | 10.1021/jm980222w | |||
| 10694122 | 57548 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 433 | 9 | 0 | 5 | 5.9 | CCCCN(CC)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL166388 | 57548 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 433 | 9 | 0 | 5 | 5.9 | CCCCN(CC)c1nc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10809708 | 57689 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 378 | 5 | 0 | 5 | 4.1 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(N(C)C)cc1OC | 10.1021/jm980222w | |||
| CHEMBL166895 | 57689 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 378 | 5 | 0 | 5 | 4.1 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(N(C)C)cc1OC | 10.1021/jm980222w | |||
| 11795557 | 57840 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 404 | 7 | 0 | 5 | 4.8 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL167177 | 57840 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 404 | 7 | 0 | 5 | 4.8 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| 10503074 | 58094 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 436 | 9 | 0 | 6 | 5.0 | CCCN(CC1CC1)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| CHEMBL167428 | 58094 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 436 | 9 | 0 | 6 | 5.0 | CCCN(CC1CC1)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| 11796930 | 120440 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 430 | 8 | 0 | 4 | 6.2 | CCCN(c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1)C1CC1 | 10.1021/jm980222w | |||
| CHEMBL353877 | 120440 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 430 | 8 | 0 | 4 | 6.2 | CCCN(c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1)C1CC1 | 10.1021/jm980222w | |||
| 10646531 | 120474 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 435 | 9 | 0 | 7 | 4.6 | CCCN(CCC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| CHEMBL354178 | 120474 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 435 | 9 | 0 | 7 | 4.6 | CCCN(CCC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| 10838302 | 120491 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 475 | 9 | 0 | 6 | 5.6 | CCCCN(CC)c1nc(C)nc(N(CC)c2ccc(OC(F)(F)F)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL354367 | 120491 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 475 | 9 | 0 | 6 | 5.6 | CCCCN(CC)c1nc(C)nc(N(CC)c2ccc(OC(F)(F)F)cc2Br)n1 | 10.1021/jm980222w | |||
| 10527467 | 120494 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 448 | 9 | 0 | 6 | 5.0 | CCN(c1nc(C)nc(N(CC2CC2)CC2CC2)n1)c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980222w | |||
| CHEMBL354395 | 120494 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 448 | 9 | 0 | 6 | 5.0 | CCN(c1nc(C)nc(N(CC2CC2)CC2CC2)n1)c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980222w | |||
| 10366978 | 101385 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 459 | 7 | 0 | 6 | 4.9 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL297170 | 101385 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 459 | 7 | 0 | 6 | 4.9 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 9935525 | 58626 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 494 | 8 | 0 | 7 | 5.1 | COCCN(Cc1ccccc1)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168449 | 58626 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 494 | 8 | 0 | 7 | 5.1 | COCCN(Cc1ccccc1)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 11759092 | 10036 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 321 | 1 | 0 | 1 | 6.2 | Cc1cc(Cl)c2cccc(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115119 | 10036 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 321 | 1 | 0 | 1 | 6.2 | Cc1cc(Cl)c2cccc(-c3ccc(Cl)cc3Cl)c2n1 | 10.1016/s0960-894x(03)00684-x | |||
| 9907170 | 178099 | 0 | None | 2 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 365 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980223o | |||
| CHEMBL46479 | 178099 | 0 | None | 2 | 2 | Rat | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 365 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(OC)cc1OC | 10.1021/jm980223o | |||
| 10366978 | 101385 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 459 | 7 | 0 | 6 | 4.9 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| CHEMBL297170 | 101385 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 459 | 7 | 0 | 6 | 4.9 | CCCCN(CC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| 9800614 | 100467 | 5 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm990590f | |||
| CHEMBL290762 | 100467 | 5 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm990590f | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/s0960-894x(02)00358-x | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1016/s0960-894x(02)00358-x | |||
| 9800614 | 100467 | 5 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL290762 | 100467 | 5 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 390 | 6 | 0 | 4 | 5.9 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 137659453 | 159121 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.0 | CCCCc1nn2c(N(CC)CCCC)cc(C)nc2c1-c1ccc(Cl)cc1Cl | 10.1016/j.ejmech.2016.11.019 | |||
| CHEMBL4097805 | 159121 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 7.0 | CCCCc1nn2c(N(CC)CCCC)cc(C)nc2c1-c1ccc(Cl)cc1Cl | 10.1016/j.ejmech.2016.11.019 | |||
| 44446730 | 155560 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 388 | 7 | 0 | 3 | 6.5 | CCCN(CC1CC1)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL404351 | 155560 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 388 | 7 | 0 | 3 | 6.5 | CCCN(CC1CC1)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 10375 | 2739 | 18 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm049085v | |||
| 9888194 | 2739 | 18 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm049085v | |||
| CHEMBL188907 | 2739 | 18 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 10.1021/jm049085v | |||
| 9933199 | 71506 | 1 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 444 | 8 | 0 | 4 | 7.3 | CCCCC(CCCC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm049085v | |||
| CHEMBL196270 | 71506 | 1 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 444 | 8 | 0 | 4 | 7.3 | CCCCC(CCCC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm049085v | |||
| 11718607 | 135222 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 414 | 4 | 0 | 4 | 6.0 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3C[C@H](C(C)C)N2CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL372319 | 135222 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 414 | 4 | 0 | 4 | 6.0 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3C[C@H](C(C)C)N2CC1CC1 | 10.1021/jm049085v | |||
| 9824168 | 67633 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 432 | 6 | 0 | 5 | 5.6 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL190488 | 67633 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 432 | 6 | 0 | 5 | 5.6 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 10837003 | 59798 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 443 | 8 | 1 | 5 | 6.4 | CCCCC(CC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL172684 | 59798 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 443 | 8 | 1 | 5 | 6.4 | CCCCC(CC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341862 | 9538 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 6.3 | CCCCN(CCCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112264 | 9538 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 6.3 | CCCCN(CCCC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 12086065 | 10835 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 406 | 7 | 0 | 5 | 5.1 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL117209 | 10835 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 406 | 7 | 0 | 5 | 5.1 | CCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 10693263 | 59079 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 416 | 6 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169577 | 59079 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 416 | 6 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10549179 | 120816 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 403 | 8 | 0 | 7 | 4.4 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| CHEMBL355721 | 120816 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 403 | 8 | 0 | 7 | 4.4 | CCCCN(CC)c1nc(C)nc2c1ncn2-c1c(Cl)cc(OC)cc1OC | 10.1021/jm980224g | |||
| 20780267 | 6818 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 492 | 6 | 0 | 4 | 6.5 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083933 | 6818 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 492 | 6 | 0 | 4 | 6.5 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11386550 | 78330 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)[C@@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL2094043 | 78330 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)[C@@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| CHEMBL2109791 | 78330 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 466 | 8 | 0 | 5 | 6.5 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)[C@@H](CC)c1ccc(C(F)(F)F)cc1 | 10.1021/jm049339c | |||
| 11383860 | 67023 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL187039 | 67023 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 394 | 7 | 0 | 6 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 11201203 | 127279 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 428 | 7 | 0 | 6 | 5.2 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL365841 | 127279 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 428 | 7 | 0 | 6 | 5.2 | CCCN(Cc1ccccc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 20780254 | 6826 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 466 | 7 | 0 | 4 | 6.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CCC1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083952 | 6826 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 466 | 7 | 0 | 4 | 6.7 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CCC1 | 10.1016/j.bmcl.2010.04.094 | |||
| 122193719 | 123960 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 5.1 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628738 | 123960 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 386 | 6 | 1 | 4 | 5.1 | CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(Cl)cc1C | 10.1016/j.bmcl.2015.10.010 | |||
| 11362799 | 71272 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 408 | 8 | 0 | 6 | 5.1 | CCCC(CCC)N1CCc2cn(-c3ccc(OC)nc3OC)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL195699 | 71272 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 408 | 8 | 0 | 6 | 5.1 | CCCC(CCC)N1CCc2cn(-c3ccc(OC)nc3OC)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL386892 | 212399 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1)[C@@H](C)CC)C(N)=O | 10.1021/jm034180+ | |||||
| 10178818 | 63946 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 395 | 8 | 1 | 4 | 5.9 | CCc1nc(-c2ccc(C(F)(F)F)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806734 | 63946 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 395 | 8 | 1 | 4 | 5.9 | CCc1nc(-c2ccc(C(F)(F)F)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 11372928 | 170270 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 398 | 7 | 0 | 6 | 4.5 | CCCN(CCC)c1c(F)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL444614 | 170270 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 398 | 7 | 0 | 6 | 4.5 | CCCN(CCC)c1c(F)c(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10205521 | 168504 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 471 | 7 | 0 | 6 | 4.9 | CCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL435345 | 168504 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 471 | 7 | 0 | 6 | 4.9 | CCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10593122 | 58763 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 338 | 5 | 1 | 6 | 4.0 | CCC(CC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL168664 | 58763 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 338 | 5 | 1 | 6 | 4.0 | CCC(CC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 44341636 | 9695 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL113097 | 9695 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 386 | 6 | 0 | 2 | 7.1 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 44341743 | 110583 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 5.6 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL325430 | 110583 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 418 | 8 | 0 | 4 | 5.6 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 11165678 | 78346 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2093962 | 78346 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2110010 | 78346 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| 18691320 | 4739 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 513 | 4 | 0 | 3 | 7.2 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(Br)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10373 | 4739 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 513 | 4 | 0 | 3 | 7.2 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1ccc(Br)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 18691324 | 97006 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 434 | 5 | 0 | 4 | 6.4 | CCN(c1nc(C)cc(-c2ccccc2C#N)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL266617 | 97006 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 434 | 5 | 0 | 4 | 6.4 | CCN(c1nc(C)cc(-c2ccccc2C#N)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10813902 | 58133 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 461 | 9 | 0 | 7 | 4.1 | COCCN(CCOC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL167777 | 58133 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 461 | 9 | 0 | 7 | 4.1 | COCCN(CCOC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 22249149 | 63995 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 367 | 7 | 1 | 4 | 5.6 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807035 | 63995 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 367 | 7 | 1 | 4 | 5.6 | CCc1nc(NC(CC)CC)c(OC)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 9969024 | 64012 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 363 | 8 | 1 | 5 | 5.1 | CCOc1ccc(-c2nc(OC)c(NC(CC)CC)nc2C)c(Cl)c1 | 10.1021/jm200365y | |||
| CHEMBL1807056 | 64012 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 363 | 8 | 1 | 5 | 5.1 | CCOc1ccc(-c2nc(OC)c(NC(CC)CC)nc2C)c(Cl)c1 | 10.1021/jm200365y | |||
| 21916308 | 93798 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 485 | 8 | 0 | 5 | 6.7 | CCCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247557 | 93798 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 485 | 8 | 0 | 5 | 6.7 | CCCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL4299287 | 213560 | 0 | None | -2 | 2 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | None | None | None | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H]1CCCCNC(=O)CC[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)C(C)(CC(C)C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(CCCC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(=O)O)NC(C)=O)[C@H](C)O)C(C)C)C(=O)N[C@H](Cc2ccc(NC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)C(=O)N[C@@H](Cc2ccc(NC(N)=O)cc2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C)(CC(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||||
| CHEMBL2372922 | 210313 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | None | None | None | CCCC[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](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC | 10.1021/jm034180+ | |||||
| 20780182 | 93839 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 435 | 7 | 0 | 5 | 5.9 | CCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL247753 | 93839 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 435 | 7 | 0 | 5 | 5.9 | CCN(CCC1CC1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 10166565 | 64323 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 561 | 8 | 1 | 4 | 8.5 | FC(F)(F)CN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181133 | 64323 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 561 | 8 | 1 | 4 | 8.5 | FC(F)(F)CN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11598824 | 71784 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 404 | 5 | 0 | 5 | 5.0 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CCOC | 10.1021/jm049085v | |||
| CHEMBL196740 | 71784 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 404 | 5 | 0 | 5 | 5.0 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CCOC | 10.1021/jm049085v | |||
| 11660986 | 140262 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 384 | 4 | 0 | 4 | 5.2 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL380563 | 140262 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 384 | 4 | 0 | 4 | 5.2 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 10157369 | 115257 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 391 | 5 | 1 | 4 | 5.6 | CCN(CC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL334778 | 115257 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 391 | 5 | 1 | 4 | 5.6 | CCN(CC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| 11610200 | 71731 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 360 | 2 | 0 | 4 | 4.9 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1C | 10.1021/jm049085v | |||
| CHEMBL196594 | 71731 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 360 | 2 | 0 | 4 | 4.9 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1C | 10.1021/jm049085v | |||
| 9928790 | 193555 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 359 | 9 | 0 | 6 | 4.1 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL526828 | 193555 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 359 | 9 | 0 | 6 | 4.1 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 11742775 | 154775 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2ncccc2C)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL400156 | 154775 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2ncccc2C)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 11067569 | 203623 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 332 | 5 | 2 | 5 | 3.5 | CC(=O)/C(=N\c1cccc(Cl)c1)NNc1ccccc1[N+](=O)[O-] | 10.1021/jm025512y | |||
| CHEMBL67121 | 203623 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 332 | 5 | 2 | 5 | 3.5 | CC(=O)/C(=N\c1cccc(Cl)c1)NNc1ccccc1[N+](=O)[O-] | 10.1021/jm025512y | |||
| 10786789 | 58500 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 393 | 5 | 0 | 4 | 5.9 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(C(C)C)cc1SC | 10.1021/jm980222w | |||
| CHEMBL168341 | 58500 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 393 | 5 | 0 | 4 | 5.9 | CCN(c1nc(C)cc(C)n1)c1c(Br)cc(C(C)C)cc1SC | 10.1021/jm980222w | |||
| 44443654 | 94067 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 437 | 9 | 1 | 7 | 4.6 | CCc1nc(Oc2cc(C)ncn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248996 | 94067 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 437 | 9 | 1 | 7 | 4.6 | CCc1nc(Oc2cc(C)ncn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCF | 10.1016/j.bmcl.2007.09.008 | |||
| 11474841 | 78345 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCC[C@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2093961 | 78345 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCC[C@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2110009 | 78345 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCC[C@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| 44352358 | 18746 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 429 | 10 | 1 | 6 | 5.5 | CCCN(Cc1sc(Nc2ccc(OC)cc2OC)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL127783 | 18746 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 429 | 10 | 1 | 6 | 5.5 | CCCN(Cc1sc(Nc2ccc(OC)cc2OC)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44392759 | 65241 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 393 | 7 | 0 | 4 | 5.5 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)c(C)c(C)c(C)c2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182705 | 65241 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 393 | 7 | 0 | 4 | 5.5 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)c(C)c(C)c(C)c2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 10299169 | 132411 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 473 | 6 | 1 | 5 | 6.5 | COC[C@@H]1CCCN1Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL369754 | 132411 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 473 | 6 | 1 | 5 | 6.5 | COC[C@@H]1CCCN1Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 10297799 | 18930 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 451 | 9 | 1 | 6 | 4.9 | COCCN(CCOC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL128566 | 18930 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 451 | 9 | 1 | 6 | 4.9 | COCCN(CCOC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| 44305179 | 203365 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 4.6 | CCCCN(CC)c1cc(C)nc2c(-c3ccccc3)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL65195 | 203365 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 4.6 | CCCCN(CC)c1cc(C)nc2c(-c3ccccc3)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 44460546 | 205337 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 416 | 7 | 1 | 3 | 6.2 | Cc1cc(F)ccc1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL79576 | 205337 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 416 | 7 | 1 | 3 | 6.2 | Cc1cc(F)ccc1C(Nc1ccc(Cl)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 44460368 | 205651 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 6.8 | CC(=O)Nc1cccc(C(=O)C(Nc2ccc(Cl)cc2Cl)c2ccccc2Br)c1 | 10.1021/jm049974i | |||
| CHEMBL81912 | 205651 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 490 | 6 | 2 | 3 | 6.8 | CC(=O)Nc1cccc(C(=O)C(Nc2ccc(Cl)cc2Cl)c2ccccc2Br)c1 | 10.1021/jm049974i | |||
| 44407864 | 75408 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 5.5 | Cc1cccc(S(=O)(=O)c2c(C)cc(C)nc2Nc2c(C)cc(C)cc2C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL204014 | 75408 | 0 | None | - | 1 | Rat | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 394 | 4 | 1 | 4 | 5.5 | Cc1cccc(S(=O)(=O)c2c(C)cc(C)nc2Nc2c(C)cc(C)cc2C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44341902 | 10168 | 1 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 348 | 7 | 0 | 3 | 5.8 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115928 | 10168 | 1 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 348 | 7 | 0 | 3 | 5.8 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(OC)cc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 11418006 | 75552 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 394 | 5 | 1 | 4 | 5.5 | CCc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL204481 | 75552 | 0 | None | - | 1 | Rat | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 394 | 5 | 1 | 4 | 5.5 | CCc1ccc(S(=O)(=O)c2ccc(C)nc2Nc2c(C)cc(C)cc2C)cc1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44446739 | 94649 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 488 | 10 | 0 | 5 | 6.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCN(C)CC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL252493 | 94649 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 488 | 10 | 0 | 5 | 6.1 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OCCN2CCN(C)CC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 11065415 | 203426 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 267 | 4 | 2 | 3 | 3.2 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1C | 10.1021/jm025512y | |||
| CHEMBL65708 | 203426 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 267 | 4 | 2 | 3 | 3.2 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1C | 10.1021/jm025512y | |||
| 11022343 | 203670 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 281 | 4 | 2 | 3 | 3.5 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1C | 10.1021/jm025512y | |||
| CHEMBL67394 | 203670 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 281 | 4 | 2 | 3 | 3.5 | CC(=O)/C(=N\c1cccc(C)c1)NNc1ccccc1C | 10.1021/jm025512y | |||
| 20780067 | 67888 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 522 | 6 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CCC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL191052 | 67888 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 522 | 6 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CCC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 21916146 | 6492 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 466 | 8 | 0 | 4 | 6.7 | CCCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082697 | 6492 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 466 | 8 | 0 | 4 | 6.7 | CCCN(CCC1CC1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 10410573 | 94380 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 432 | 9 | 1 | 6 | 5.5 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(CC)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL250814 | 94380 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 432 | 9 | 1 | 6 | 5.5 | CCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(CC)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 44587492 | 193629 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 385 | 10 | 0 | 5 | 5.5 | CCCOc1nc(-c2c(C)cc(C)cc2OC)nc(C)c1N(CCC)CCC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL527030 | 193629 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 385 | 10 | 0 | 5 | 5.5 | CCCOc1nc(-c2c(C)cc(C)cc2OC)nc(C)c1N(CCC)CCC | 10.1016/j.bmcl.2008.07.063 | |||
| 22324332 | 106977 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 359 | 8 | 0 | 6 | 3.4 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL315112 | 106977 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 359 | 8 | 0 | 6 | 3.4 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 44392739 | 64691 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 353 | 6 | 1 | 6 | 4.0 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(O)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL181860 | 64691 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 353 | 6 | 1 | 6 | 4.0 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(O)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44443595 | 172650 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 390 | 8 | 1 | 5 | 5.9 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(c1ccccc1)C(C)C | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL449657 | 172650 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 390 | 8 | 1 | 5 | 5.9 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(c1ccccc1)C(C)C | 10.1016/j.bmcl.2007.09.008 | |||
| 11046479 | 103114 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 4 | 2 | 3 | 4.8 | CC(=O)/C(=N\Nc1ccccc1C(F)(F)F)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| CHEMBL307751 | 103114 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 4 | 2 | 3 | 4.8 | CC(=O)/C(=N\Nc1ccccc1C(F)(F)F)Nc1cccc(Cl)c1 | 10.1021/jm025512y | |||
| 20780105 | 68023 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 558 | 8 | 0 | 4 | 7.8 | CC(C)c1ccc(-n2c3ccccc3n3c(CN(CC4CC4)CC4CC4)c(C(F)(F)F)nc23)c(Br)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL191366 | 68023 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 558 | 8 | 0 | 4 | 7.8 | CC(C)c1ccc(-n2c3ccccc3n3c(CN(CC4CC4)CC4CC4)c(C(F)(F)F)nc23)c(Br)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10708209 | 57512 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 284 | 4 | 0 | 4 | 3.6 | CCN(c1nc(C)cc(C)n1)c1ccc(N(C)C)cc1C | 10.1021/jm980222w | |||
| CHEMBL166110 | 57512 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 284 | 4 | 0 | 4 | 3.6 | CCN(c1nc(C)cc(C)n1)c1ccc(N(C)C)cc1C | 10.1021/jm980222w | |||
| 22249007 | 63998 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 5.9 | CCc1nc(NC(CC)CC)c(C)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807038 | 63998 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 5.9 | CCc1nc(NC(CC)CC)c(C)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 18691311 | 5046 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 457 | 7 | 0 | 6 | 5.4 | CCN(c1nc(C)cc(-c2ccccc2OC)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10526 | 5046 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 457 | 7 | 0 | 6 | 5.4 | CCN(c1nc(C)cc(-c2ccccc2OC)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| 44392800 | 132404 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 7 | 1 | 5 | 3.5 | CCCN(CCO)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL369717 | 132404 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 355 | 7 | 1 | 5 | 3.5 | CCCN(CCO)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 22249074 | 63991 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 337 | 6 | 1 | 3 | 5.6 | CCc1nc(NC(CC)CC)cnc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807031 | 63991 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 337 | 6 | 1 | 3 | 5.6 | CCc1nc(NC(CC)CC)cnc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 44460272 | 205697 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 442 | 7 | 1 | 3 | 6.2 | Cc1ccc(N[C@@H](C(=O)CCc2ccncc2)c2ccccc2Br)c(Cl)c1 | 10.1021/jm049974i | |||
| CHEMBL82308 | 205697 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 442 | 7 | 1 | 3 | 6.2 | Cc1ccc(N[C@@H](C(=O)CCc2ccncc2)c2ccccc2Br)c(Cl)c1 | 10.1021/jm049974i | |||
| 44443630 | 154728 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@@H]1Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL399877 | 154728 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 418 | 8 | 1 | 6 | 5.2 | CCO[C@H]1Cc2ccccc2[C@@H]1Nc1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 44392691 | 66303 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 379 | 8 | 0 | 4 | 5.1 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1CC | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL184851 | 66303 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 379 | 8 | 0 | 4 | 5.1 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1CC | 10.1016/j.bmcl.2004.05.072 | |||
| 11156095 | 68974 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 5.7 | CCCC(CCC)N1CCc2cn(-c3ccccc3OC)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL192288 | 68974 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 377 | 7 | 0 | 4 | 5.7 | CCCC(CCC)N1CCc2cn(-c3ccccc3OC)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 10835652 | 119177 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 415 | 7 | 2 | 5 | 5.7 | CCc1cccc(CC)c1Nc1nc(C)nc(NCc2ccc(C(F)(F)F)cc2)n1 | 10.1021/jm960148m | |||
| CHEMBL343073 | 119177 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 415 | 7 | 2 | 5 | 5.7 | CCc1cccc(CC)c1Nc1nc(C)nc(NCc2ccc(C(F)(F)F)cc2)n1 | 10.1021/jm960148m | |||
| 44389084 | 122316 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 443 | 4 | 1 | 4 | 6.9 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CCCCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL359828 | 122316 | 0 | None | - | 1 | Human | 4.3 | pKi | = | 4.3 | Binding | ChEMBL | 443 | 4 | 1 | 4 | 6.9 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CCCCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 10164848 | 21478 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 517 | 10 | 0 | 4 | 7.8 | CCCN(Cc1sc(N(CC)c2ccc(C(C)C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL131571 | 21478 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 517 | 10 | 0 | 4 | 7.8 | CCCN(Cc1sc(N(CC)c2ccc(C(C)C)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 3495 | 1175 | 28 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(98)00372-2 | |||
| 5311055 | 1175 | 28 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL9946 | 1175 | 28 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 364 | 6 | 0 | 4 | 5.6 | CCCCN(c1nc(C)nc2c1c(C)cn2c1c(C)cc(cc1C)C)CC | 10.1016/s0960-894x(98)00372-2 | |||
| 136029158 | 205670 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 357 | 8 | 1 | 5 | 4.7 | CCCN(CCC)c1c(O)nc(-c2c(C)cc(C)cc2OC)nc1CC | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL82112 | 205670 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 357 | 8 | 1 | 5 | 4.7 | CCCN(CCC)c1c(O)nc(-c2c(C)cc(C)cc2OC)nc1CC | 10.1016/s0960-894x(03)00483-9 | |||
| 44392751 | 122056 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 397 | 10 | 0 | 6 | 4.5 | C=C(c1cc(N(CCC)CC2CC2)nc(C)n1)c1c(OC)cc(OC)cc1OC | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL359636 | 122056 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 397 | 10 | 0 | 6 | 4.5 | C=C(c1cc(N(CCC)CC2CC2)nc(C)n1)c1c(OC)cc(OC)cc1OC | 10.1016/j.bmcl.2004.05.072 | |||
| 10206904 | 122766 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 7.5 | CN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL360471 | 122766 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 493 | 7 | 1 | 4 | 7.5 | CN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 21916237 | 93360 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 441 | 8 | 1 | 7 | 4.0 | COCC(COC)NCc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL245506 | 93360 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 441 | 8 | 1 | 7 | 4.0 | COCC(COC)NCc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 44308134 | 203562 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 460 | 7 | 0 | 6 | 5.3 | CCCN(CCN1CCCCC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL66671 | 203562 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 460 | 7 | 0 | 6 | 5.3 | CCCN(CCN1CCCCC1)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44587452 | 188146 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 327 | 7 | 0 | 4 | 4.7 | CCCN(CCC)c1cnc(-c2c(C)cc(C)cc2OC)nc1C | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL498480 | 188146 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 327 | 7 | 0 | 4 | 4.7 | CCCN(CCC)c1cnc(-c2c(C)cc(C)cc2OC)nc1C | 10.1016/j.bmcl.2008.07.063 | |||
| 9797993 | 102980 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 339 | 7 | 1 | 5 | 4.5 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960149e | |||
| CHEMBL306618 | 102980 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 339 | 7 | 1 | 5 | 4.5 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960149e | |||
| 9797993 | 102980 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 339 | 7 | 1 | 5 | 4.5 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| CHEMBL306618 | 102980 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 339 | 7 | 1 | 5 | 4.5 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm960148m | |||
| 9797993 | 102980 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 339 | 7 | 1 | 5 | 4.5 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| CHEMBL306618 | 102980 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 339 | 7 | 1 | 5 | 4.5 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1 | 10.1021/jm9900117 | |||
| 18672241 | 64366 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 455 | 8 | 1 | 4 | 7.0 | C=CCN(CC=C)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181280 | 64366 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 455 | 8 | 1 | 4 | 7.0 | C=CCN(CC=C)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 20780125 | 123874 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 442 | 7 | 0 | 4 | 6.0 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL362706 | 123874 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 442 | 7 | 0 | 4 | 6.0 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 20780058 | 93328 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 458 | 6 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)CCc4cccnc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL245297 | 93328 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 458 | 6 | 0 | 6 | 5.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN(C)CCc4cccnc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 10062901 | 170244 | 1 | None | - | 1 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 291 | 2 | 0 | 3 | 3.6 | Cc1cc(C)nc(N(C)c2ccccc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL444577 | 170244 | 1 | None | - | 1 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 291 | 2 | 0 | 3 | 3.6 | Cc1cc(C)nc(N(C)c2ccccc2Br)n1 | 10.1021/jm980222w | |||
| 10783164 | 27058 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 337 | 9 | 1 | 5 | 4.2 | C=CCN(CC=C)c1nc(C)nc(Nc2c(CC)cccc2CC)n1 | 10.1021/jm960148m | |||
| CHEMBL136519 | 27058 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 337 | 9 | 1 | 5 | 4.2 | C=CCN(CC=C)c1nc(C)nc(Nc2c(CC)cccc2CC)n1 | 10.1021/jm960148m | |||
| 20780072 | 67226 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 476 | 5 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(C)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187924 | 67226 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 476 | 5 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(C)Cc4ccccc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 11268730 | 161844 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 370 | 4 | 0 | 5 | 4.2 | CCC(CC)N1CCn2c(=O)n(-c3ccc(Cl)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL414664 | 161844 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 370 | 4 | 0 | 5 | 4.2 | CCC(CC)N1CCn2c(=O)n(-c3ccc(Cl)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44392764 | 65199 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 353 | 7 | 0 | 4 | 4.9 | CCCN(CCC)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182504 | 65199 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 353 | 7 | 0 | 4 | 4.9 | CCCN(CCC)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 44443650 | 94031 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 446 | 9 | 1 | 6 | 5.9 | CCCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)cc(C)n2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL248803 | 94031 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 446 | 9 | 1 | 6 | 5.9 | CCCO[C@H]1Cc2ccccc2[C@H]1Nc1nc(CC)c(Oc2cc(C)cc(C)n2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 11364104 | 75605 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 6.5 | COc1cccc(COc2ccc(S(=O)(=O)c3ccc(C)nc3Nc3c(C)cc(C)cc3C)cc2)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL204690 | 75605 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 502 | 8 | 1 | 6 | 6.5 | COc1cccc(COc2ccc(S(=O)(=O)c3ccc(C)nc3Nc3c(C)cc(C)cc3C)cc2)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 21916273 | 6967 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 542 | 6 | 0 | 4 | 8.1 | CCN(Cc1ccc(Cl)c(Cl)c1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084565 | 6967 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 542 | 6 | 0 | 4 | 8.1 | CCN(Cc1ccc(Cl)c(Cl)c1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780049 | 148838 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 469 | 4 | 0 | 5 | 6.6 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCCC4c4ccccc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL394112 | 148838 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 469 | 4 | 0 | 5 | 6.6 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCCC4c4ccccc4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 46891010 | 6436 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 438 | 3 | 0 | 4 | 6.0 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCC(C)C4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082443 | 6436 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 438 | 3 | 0 | 4 | 6.0 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCCC(C)C4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916154 | 122577 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 432 | 7 | 0 | 4 | 6.3 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL360185 | 122577 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 432 | 7 | 0 | 4 | 6.3 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12)CC1CC1 | 10.1016/j.bmcl.2005.06.028 | |||
| 44341755 | 10154 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 412 | 9 | 0 | 4 | 6.8 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(C)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL115818 | 10154 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 412 | 9 | 0 | 4 | 6.8 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(C)cc3Cl)n(CC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 122193724 | 123889 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 448 | 5 | 0 | 4 | 4.8 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2CCF | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3627731 | 123889 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 448 | 5 | 0 | 4 | 4.8 | Cc1cc(N(C)C)c2c(n1)N(c1ccc(C(C)C)cc1Br)CC(=O)N2CCF | 10.1016/j.bmcl.2015.10.010 | |||
| 44443591 | 94332 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 376 | 8 | 1 | 5 | 5.7 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(CC)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL250617 | 94332 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 376 | 8 | 1 | 5 | 5.7 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1NC(CC)c1ccccc1 | 10.1016/j.bmcl.2007.09.008 | |||
| 10831985 | 120478 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.3 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL354256 | 120478 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 354 | 6 | 1 | 7 | 3.3 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 10788999 | 57505 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 435 | 9 | 0 | 7 | 4.6 | CCCCN(CC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| CHEMBL166056 | 57505 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 435 | 9 | 0 | 7 | 4.6 | CCCCN(CC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| 10764802 | 58717 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 424 | 9 | 0 | 6 | 5.0 | CCCN(CCC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| CHEMBL168497 | 58717 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 424 | 9 | 0 | 6 | 5.0 | CCCN(CCC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C(F)(F)F)n1 | 10.1021/jm980222w | |||
| 10549365 | 165695 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 7 | 0 | 6 | 4.0 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL424538 | 165695 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 7 | 0 | 6 | 4.0 | CCN(CC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10228129 | 7399 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 488 | 7 | 0 | 4 | 6.8 | CCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086504 | 7399 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 488 | 7 | 0 | 4 | 6.8 | CCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 21916331 | 147489 | 1 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 449 | 7 | 0 | 5 | 6.3 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL393044 | 147489 | 1 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 449 | 7 | 0 | 5 | 6.3 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 44446725 | 168953 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL438888 | 168953 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44446725 | 168953 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL438888 | 168953 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 376 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2008.07.063 | |||
| 44587455 | 188047 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 8 | 0 | 5 | 6.1 | CCCN(CCC)c1c(C)nc(-c2c(OC)cc(C(F)(F)F)cc2C(F)(F)F)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL497651 | 188047 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 465 | 8 | 0 | 5 | 6.1 | CCCN(CCC)c1c(C)nc(-c2c(OC)cc(C(F)(F)F)cc2C(F)(F)F)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 11166919 | 166308 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 417 | 5 | 0 | 4 | 6.1 | CCC(CC)N1CCc2cn(-c3ccc(OC(F)(F)F)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL427168 | 166308 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 417 | 5 | 0 | 4 | 6.1 | CCC(CC)N1CCc2cn(-c3ccc(OC(F)(F)F)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 44384801 | 132273 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 393 | 6 | 0 | 6 | 4.0 | CCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL369700 | 132273 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 393 | 6 | 0 | 6 | 4.0 | CCCN(CC1CC1)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| 11798114 | 58807 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 457 | 9 | 0 | 5 | 6.4 | CCCCN(CCCC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168823 | 58807 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 457 | 9 | 0 | 5 | 6.4 | CCCCN(CCCC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 9910700 | 59045 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169416 | 59045 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10295219 | 64013 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 413 | 9 | 1 | 6 | 5.2 | CCc1nc(-c2ccc(OC(F)(F)F)cc2OC)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807057 | 64013 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 413 | 9 | 1 | 6 | 5.2 | CCc1nc(-c2ccc(OC(F)(F)F)cc2OC)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 10303191 | 169275 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 561 | 8 | 1 | 4 | 8.8 | FC(F)(F)CCN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL441311 | 169275 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 561 | 8 | 1 | 4 | 8.8 | FC(F)(F)CCN(Cc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 44392781 | 129671 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 371 | 6 | 0 | 5 | 5.0 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL367371 | 129671 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 371 | 6 | 0 | 5 | 5.0 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(C)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10789145 | 33091 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 437 | 9 | 1 | 7 | 4.6 | CCOCC(COCC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| CHEMBL141692 | 33091 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 437 | 9 | 1 | 7 | 4.6 | CCOCC(COCC)Nc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1021/jm9904351 | |||
| 10142098 | 6491 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082696 | 6491 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 506 | 7 | 0 | 4 | 6.9 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(CCC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 11212114 | 106391 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 412 | 9 | 0 | 5 | 5.9 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3085416 | 106391 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 412 | 9 | 0 | 5 | 5.9 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL3139409 | 106391 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 412 | 9 | 0 | 5 | 5.9 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 11576870 | 70572 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 380 | 4 | 0 | 4 | 5.4 | CC[C@H]1Cn2nc(-c3ccc(C)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL194890 | 70572 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 380 | 4 | 0 | 4 | 5.4 | CC[C@H]1Cn2nc(-c3ccc(C)cc3Cl)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11634953 | 71917 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 402 | 5 | 0 | 4 | 6.1 | CCCCN1c2cc(C)nc3c(-c4ccc(Cl)cc4Cl)nn(c23)C[C@@H]1CC | 10.1021/jm049085v | |||
| CHEMBL197197 | 71917 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 402 | 5 | 0 | 4 | 6.1 | CCCCN1c2cc(C)nc3c(-c4ccc(Cl)cc4Cl)nn(c23)C[C@@H]1CC | 10.1021/jm049085v | |||
| 44305255 | 102754 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 416 | 4 | 0 | 4 | 6.5 | CCCC1CCCCN1c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL305092 | 102754 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 416 | 4 | 0 | 4 | 6.5 | CCCC1CCCCN1c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 21916296 | 147006 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 471 | 7 | 0 | 5 | 6.3 | CCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL392655 | 147006 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 471 | 7 | 0 | 5 | 6.3 | CCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 44342084 | 10026 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 5.2 | COCCN(CCOC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115032 | 10026 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 5.2 | COCCN(CCOC)c1cc(C)nc2c(-c3c(C)cc(C)cc3C)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 44396572 | 123388 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 444 | 8 | 1 | 7 | 4.5 | COCC(Cc1ccccc1)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL361670 | 123388 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 444 | 8 | 1 | 7 | 4.5 | COCC(Cc1ccccc1)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 11477320 | 70929 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 391 | 7 | 0 | 4 | 6.0 | CCCC(CCC)N1CCc2cn(-c3ccc(OC)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL195152 | 70929 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 391 | 7 | 0 | 4 | 6.0 | CCCC(CCC)N1CCc2cn(-c3ccc(OC)cc3C)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 9849255 | 195908 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 510 | 9 | 0 | 8 | 5.5 | COCCN(CCOC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL559127 | 195908 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 510 | 9 | 0 | 8 | 5.5 | COCCN(CCOC)c1nc(C)nc2c1sc(=S)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| 44392805 | 64877 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 463 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(I)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL182165 | 64877 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 463 | 6 | 0 | 5 | 4.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(I)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 44392643 | 64569 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 371 | 6 | 0 | 5 | 5.0 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(Cl)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL181548 | 64569 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 371 | 6 | 0 | 5 | 5.0 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(Cl)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 10672237 | 58711 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 475 | 9 | 0 | 7 | 4.4 | COCCN(CCOC)c1nc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL168476 | 58711 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 475 | 9 | 0 | 7 | 4.4 | COCCN(CCOC)c1nc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341816 | 9553 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 434 | 9 | 0 | 5 | 5.9 | CCCCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112336 | 9553 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 434 | 9 | 0 | 5 | 5.9 | CCCCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 11339333 | 63077 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 426 | 10 | 0 | 5 | 6.3 | CCCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL178836 | 63077 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 426 | 10 | 0 | 5 | 6.3 | CCCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 44388403 | 166184 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL426419 | 166184 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 406 | 10 | 0 | 5 | 5.9 | CCCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| 44352448 | 18964 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 411 | 8 | 1 | 4 | 6.5 | CCCN(Cc1sc(Nc2c(C)cc(C)cc2C)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL128713 | 18964 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 411 | 8 | 1 | 4 | 6.5 | CCCN(Cc1sc(Nc2c(C)cc(C)cc2C)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 11188634 | 125955 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 3.7 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OC)nc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL364892 | 125955 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 395 | 7 | 0 | 7 | 3.7 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(OC)nc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 10662222 | 58505 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 303 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1ccc(OC)cc1SC | 10.1021/jm980222w | |||
| CHEMBL168359 | 58505 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 303 | 5 | 0 | 5 | 4.0 | CCN(c1nc(C)cc(C)n1)c1ccc(OC)cc1SC | 10.1021/jm980222w | |||
| 9951620 | 9581 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 376 | 6 | 1 | 3 | 5.8 | CCCCN(CC)c1cc(C)[nH]c2c(-c3ccc(Cl)cc3Cl)nnc1-2 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL112478 | 9581 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 376 | 6 | 1 | 3 | 5.8 | CCCCN(CC)c1cc(C)[nH]c2c(-c3ccc(Cl)cc3Cl)nnc1-2 | 10.1016/s0960-894x(03)00621-8 | |||
| 44587454 | 193162 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 415 | 10 | 1 | 6 | 4.7 | CCCN(CCC)c1c(CC(C)(C)O)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL523074 | 193162 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 415 | 10 | 1 | 6 | 4.7 | CCCN(CCC)c1c(CC(C)(C)O)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 20780008 | 7349 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 412 | 6 | 0 | 4 | 5.3 | CCCN(CC1CC1)C(=O)c1c(C)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086259 | 7349 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 412 | 6 | 0 | 4 | 5.3 | CCCN(CC1CC1)C(=O)c1c(C)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780037 | 131793 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 422 | 6 | 0 | 4 | 4.9 | CCCN(CC(F)(F)F)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL369341 | 131793 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 422 | 6 | 0 | 4 | 4.9 | CCCN(CC(F)(F)F)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 44388393 | 60553 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL175902 | 60553 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCCC(c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| 21916323 | 7090 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 486 | 4 | 0 | 4 | 6.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCC(c5ccccc5)C4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1085088 | 7090 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 486 | 4 | 0 | 4 | 6.7 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCC(c5ccccc5)C4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 20780251 | 64368 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 394 | 7 | 0 | 4 | 4.8 | CCc1nc2n(c1C(=O)N(CC)CCC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL181287 | 64368 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 394 | 7 | 0 | 4 | 4.8 | CCc1nc2n(c1C(=O)N(CC)CCC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780070 | 127289 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 572 | 8 | 0 | 4 | 8.2 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCc4ccccc4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL365858 | 127289 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 572 | 8 | 0 | 4 | 8.2 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCc4ccccc4)CCC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 11077161 | 203490 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 291 | 4 | 2 | 3 | 3.2 | C#Cc1cccc(/N=C(/NNc2ccccc2C)C(C)=O)c1 | 10.1021/jm025512y | |||
| CHEMBL66157 | 203490 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 291 | 4 | 2 | 3 | 3.2 | C#Cc1cccc(/N=C(/NNc2ccccc2C)C(C)=O)c1 | 10.1021/jm025512y | |||
| 9865345 | 9459 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 392 | 6 | 2 | 5 | 4.8 | CCCC(CO)Nc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL111867 | 9459 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 392 | 6 | 2 | 5 | 4.8 | CCCC(CO)Nc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 44307655 | 203686 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 393 | 8 | 0 | 5 | 5.8 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)nn(CCC)c12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL67483 | 203686 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 393 | 8 | 0 | 5 | 5.8 | CCCN(CCC)c1nc(C)nc2c(-c3c(C)cc(C)cc3C)nn(CCC)c12 | 10.1016/s0960-894x(02)00358-x | |||
| 11222685 | 69007 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 378 | 4 | 0 | 4 | 5.4 | CCC(CC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL192335 | 69007 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 378 | 4 | 0 | 4 | 5.4 | CCC(CC)N1CCc2cn(-c3ccc(Cl)cc3C#N)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| 44462209 | 106189 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 409 | 10 | 0 | 6 | 4.5 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC(F)F)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL313823 | 106189 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 409 | 10 | 0 | 6 | 4.5 | CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC(F)F)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 10857993 | 203563 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 253 | 4 | 2 | 3 | 2.9 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1 | 10.1021/jm025512y | |||
| CHEMBL66698 | 203563 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 253 | 4 | 2 | 3 | 2.9 | CC(=O)/C(=N\c1ccccc1)NNc1ccccc1 | 10.1021/jm025512y | |||
| 44306462 | 203041 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 385 | 9 | 0 | 5 | 4.7 | CCCN(c1nccc(-c2c(F)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL63457 | 203041 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 385 | 9 | 0 | 5 | 4.7 | CCCN(c1nccc(-c2c(F)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 44306162 | 203507 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.9 | CCCN(c1ncc(C)c(-c2ccc(Br)cc2C)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL66249 | 203507 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 413 | 7 | 0 | 3 | 5.9 | CCCN(c1ncc(C)c(-c2ccc(Br)cc2C)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 10549990 | 168070 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 418 | 5 | 0 | 5 | 4.7 | CCN(c1nc(C)cc(N2CCOCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| CHEMBL432496 | 168070 | 0 | None | -1 | 2 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 418 | 5 | 0 | 5 | 4.7 | CCN(c1nc(C)cc(N2CCOCC2)n1)c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| 20780280 | 64346 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 484 | 7 | 0 | 4 | 5.6 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)C(F)(F)F)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL181227 | 64346 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 484 | 7 | 0 | 4 | 5.6 | CCc1nc2n(c1C(=O)N(CC1CC1)CC(F)(F)C(F)(F)F)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 21916183 | 7581 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 7 | 0 | 4 | 6.5 | CCCN(CCC(F)(F)F)Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087804 | 7581 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 7 | 0 | 4 | 6.5 | CCCN(CCC(F)(F)F)Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 11653680 | 71453 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 374 | 3 | 0 | 4 | 5.3 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC | 10.1021/jm049085v | |||
| CHEMBL196146 | 71453 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 374 | 3 | 0 | 4 | 5.3 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1CC | 10.1021/jm049085v | |||
| 9887524 | 166158 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 404 | 5 | 0 | 5 | 5.0 | CCC(COC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm049085v | |||
| CHEMBL426283 | 166158 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 404 | 5 | 0 | 5 | 5.0 | CCC(COC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32 | 10.1021/jm049085v | |||
| 44392758 | 65198 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 399 | 10 | 0 | 7 | 3.7 | CCCN(CC1CC1)c1cc(C)nc(C(=O)c2c(OC)cc(OC)cc2OC)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182500 | 65198 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 399 | 10 | 0 | 7 | 3.7 | CCCN(CC1CC1)c1cc(C)nc(C(=O)c2c(OC)cc(OC)cc2OC)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 10118581 | 63341 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 513 | 8 | 1 | 4 | 8.7 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CCCCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL179416 | 63341 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 513 | 8 | 1 | 4 | 8.7 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CCCCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 11374322 | 135717 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 449 | 8 | 1 | 6 | 5.6 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCCCC#N)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL372996 | 135717 | 0 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 449 | 8 | 1 | 6 | 5.6 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCCCC#N)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 10575478 | 168397 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 448 | 8 | 1 | 8 | 2.9 | COCCN(CCO)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL434689 | 168397 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 448 | 8 | 1 | 8 | 2.9 | COCCN(CCO)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341734 | 10218 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 446 | 10 | 0 | 4 | 7.5 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CCC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL116010 | 10218 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 446 | 10 | 0 | 4 | 7.5 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(CCC)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 44317977 | 205231 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 6.1 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C)c(C(F)(F)F)c1 | 10.1021/jm049974i | |||
| CHEMBL78721 | 205231 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 412 | 7 | 1 | 3 | 6.1 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C)c(C(F)(F)F)c1 | 10.1021/jm049974i | |||
| 11792386 | 57557 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 353 | 6 | 0 | 7 | 3.5 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)nc1C | 10.1021/jm980224g | |||
| CHEMBL166431 | 57557 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 353 | 6 | 0 | 7 | 3.5 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1c(C)cc(C)nc1C | 10.1021/jm980224g | |||
| 44307784 | 204080 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 293 | 4 | 1 | 5 | 3.3 | CC(=O)/C(=N\Nc1ccccc1C#N)Oc1cccc(C)c1 | 10.1021/jm025512y | |||
| CHEMBL70143 | 204080 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 293 | 4 | 1 | 5 | 3.3 | CC(=O)/C(=N\Nc1ccccc1C#N)Oc1cccc(C)c1 | 10.1021/jm025512y | |||
| 20780249 | 64657 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 462 | 8 | 0 | 4 | 5.7 | CCc1nc2n(c1C(=O)N(CCC1CC1)CCC(F)(F)F)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL181823 | 64657 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 462 | 8 | 0 | 4 | 5.7 | CCc1nc2n(c1C(=O)N(CCC1CC1)CCC(F)(F)F)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 11034476 | 203803 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 317 | 5 | 2 | 4 | 3.8 | COc1cccc(N/C(=N/Nc2ccccc2Cl)C(C)=O)c1 | 10.1021/jm025512y | |||
| CHEMBL68340 | 203803 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 317 | 5 | 2 | 4 | 3.8 | COc1cccc(N/C(=N/Nc2ccccc2Cl)C(C)=O)c1 | 10.1021/jm025512y | |||
| 20780069 | 67429 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 522 | 7 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL188945 | 67429 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 522 | 7 | 0 | 4 | 7.4 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 11759733 | 203676 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 345 | 4 | 2 | 3 | 3.9 | C#Cc1cccc(/N=C(/NNc2ccccc2C(F)(F)F)C(C)=O)c1 | 10.1021/jm025512y | |||
| CHEMBL67438 | 203676 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 345 | 4 | 2 | 3 | 3.9 | C#Cc1cccc(/N=C(/NNc2ccccc2C(F)(F)F)C(C)=O)c1 | 10.1021/jm025512y | |||
| 10528613 | 59011 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 10 | 0 | 8 | 3.9 | COCCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169195 | 59011 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 476 | 10 | 0 | 8 | 3.9 | COCCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 20780271 | 122029 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 484 | 7 | 0 | 4 | 6.1 | CCc1nc2n(c1C(=O)N(CCC(F)(F)F)Cc1ccccc1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL359499 | 122029 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 484 | 7 | 0 | 4 | 6.1 | CCc1nc2n(c1C(=O)N(CCC(F)(F)F)Cc1ccccc1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780285 | 123911 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 366 | 7 | 0 | 4 | 4.9 | CCCN(Cc1c(C)nc2n1CCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL362799 | 123911 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 366 | 7 | 0 | 4 | 4.9 | CCCN(Cc1c(C)nc2n1CCN2c1c(C)cc(C)cc1C)CC1CC1 | 10.1016/j.bmcl.2005.05.117 | |||
| 44266401 | 4921 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 477 | 6 | 1 | 6 | 5.7 | CCN(c1nc(C)cc(-c2ccccc2-c2nn[nH]n2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10464 | 4921 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 477 | 6 | 1 | 6 | 5.7 | CCN(c1nc(C)cc(-c2ccccc2-c2nn[nH]n2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 10204820 | 115365 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 459 | 9 | 0 | 4 | 7.2 | CCCN(Cc1sc(N(CC)c2c(C)cc(C)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL334976 | 115365 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 459 | 9 | 0 | 4 | 7.2 | CCCN(Cc1sc(N(CC)c2c(C)cc(C)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 10832559 | 120424 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 362 | 2 | 0 | 2 | 5.9 | Cc1cc(Cl)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL353774 | 120424 | 0 | None | - | 1 | Rat | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 362 | 2 | 0 | 2 | 5.9 | Cc1cc(Cl)c2ccn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 21916268 | 7178 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 438 | 6 | 0 | 4 | 6.1 | C=C(C)CN(CC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1085518 | 7178 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 438 | 6 | 0 | 4 | 6.1 | C=C(C)CN(CC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 44443643 | 94381 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 458 | 8 | 1 | 6 | 6.1 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC1CCCC1 | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL250815 | 94381 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 458 | 8 | 1 | 6 | 6.1 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC1CCCC1 | 10.1016/j.bmcl.2007.09.008 | |||
| 21916073 | 7679 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 484 | 8 | 0 | 4 | 6.8 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1088626 | 7679 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 484 | 8 | 0 | 4 | 6.8 | CCCN(CCc1ccccc1)Cc1c(C(F)(F)F)nc2n1CCCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2010.01.127 | |||
| 10113422 | 64320 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 427 | 4 | 1 | 4 | 6.2 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CC=CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181121 | 64320 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 427 | 4 | 1 | 4 | 6.2 | FC(F)(F)c1nc(Nc2c(Cl)cc(Cl)cc2Cl)sc1CN1CC=CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 20780167 | 124477 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 510 | 7 | 0 | 4 | 7.4 | CCCN(CCC(F)(F)F)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL364002 | 124477 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 510 | 7 | 0 | 4 | 7.4 | CCCN(CCC(F)(F)F)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 10664736 | 57511 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 338 | 4 | 0 | 4 | 4.3 | CCN(c1nc(C)cc(C)n1)c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980222w | |||
| CHEMBL166109 | 57511 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 338 | 4 | 0 | 4 | 4.3 | CCN(c1nc(C)cc(C)n1)c1ccc(N(C)C)cc1C(F)(F)F | 10.1021/jm980222w | |||
| 9803991 | 168684 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 453 | 7 | 0 | 5 | 6.5 | CCCCN(Cc1ccncc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL436564 | 168684 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 453 | 7 | 0 | 5 | 6.5 | CCCCN(Cc1ccncc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 20780287 | 62508 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 406 | 7 | 0 | 4 | 4.8 | CCc1nc2n(c1C(=O)N(CC1CC1)CC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL178165 | 62508 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 406 | 7 | 0 | 4 | 4.8 | CCc1nc2n(c1C(=O)N(CC1CC1)CC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 53309402 | 63990 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 364 | 7 | 0 | 2 | 6.6 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1CC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807030 | 63990 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 364 | 7 | 0 | 2 | 6.6 | CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1CC(CC)CC | 10.1021/jm200365y | |||
| 12982784 | 15498 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL121614 | 15498 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 322 | 6 | 0 | 4 | 4.6 | CCCN(CCC)c1cc(C)nc2c(-c3ccccc3)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 21916111 | 6490 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 440 | 7 | 0 | 4 | 6.3 | CCCN(CCC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082686 | 6490 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 440 | 7 | 0 | 4 | 6.3 | CCCN(CCC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 44305545 | 100705 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.5 | CCCCNc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL292484 | 100705 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 362 | 5 | 1 | 4 | 5.5 | CCCCNc1cc(C)nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 10739909 | 120577 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 402 | 6 | 1 | 6 | 4.6 | CCCCNc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL354579 | 120577 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 402 | 6 | 1 | 6 | 4.6 | CCCCNc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 11450550 | 130133 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 336 | 7 | 0 | 5 | 4.2 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C)CC | 10.1021/jm049339c | |||
| CHEMBL367789 | 130133 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 336 | 7 | 0 | 5 | 4.2 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C)CC | 10.1021/jm049339c | |||
| 10991736 | 203735 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 351 | 5 | 2 | 4 | 4.1 | COc1cccc(N/C(=N/Nc2ccccc2C(F)(F)F)C(C)=O)c1 | 10.1021/jm025512y | |||
| CHEMBL67785 | 203735 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 351 | 5 | 2 | 4 | 4.1 | COc1cccc(N/C(=N/Nc2ccccc2C(F)(F)F)C(C)=O)c1 | 10.1021/jm025512y | |||
| 44385629 | 61297 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 413 | 8 | 0 | 8 | 2.5 | COCCN(CCOC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL176707 | 61297 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 413 | 8 | 0 | 8 | 2.5 | COCCN(CCOC)c1nc(C)nc2c1n(C)c(=O)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00108-0 | |||
| 44462088 | 205909 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 371 | 8 | 0 | 5 | 4.3 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL84007 | 205909 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 371 | 8 | 0 | 5 | 4.3 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 10500067 | 57835 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 381 | 9 | 0 | 7 | 3.8 | CCCN(CCC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| CHEMBL167095 | 57835 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 381 | 9 | 0 | 7 | 3.8 | CCCN(CCC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| 10832987 | 58168 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 370 | 9 | 0 | 6 | 4.3 | CCCN(CCC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| CHEMBL168169 | 58168 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 370 | 9 | 0 | 6 | 4.3 | CCCN(CCC)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| 44341680 | 111042 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 432 | 8 | 0 | 4 | 7.0 | CCCCN(c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12)C(CC)CC | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL326284 | 111042 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 432 | 8 | 0 | 4 | 7.0 | CCCCN(c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12)C(CC)CC | 10.1016/s0960-894x(03)00622-x | |||
| 44446731 | 94868 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 400 | 7 | 0 | 3 | 6.5 | COc1cc(C)cc(C)c1-c1nc(C)c(N(CC2CC2)CC2CC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253914 | 94868 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 400 | 7 | 0 | 3 | 6.5 | COc1cc(C)cc(C)c1-c1nc(C)c(N(CC2CC2)CC2CC2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 20780066 | 66903 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 508 | 6 | 0 | 4 | 7.0 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL186479 | 66903 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 508 | 6 | 0 | 4 | 7.0 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CC4CC4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 10503714 | 57438 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 449 | 8 | 0 | 8 | 3.4 | COCC(COC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL165478 | 57438 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 449 | 8 | 0 | 8 | 3.4 | COCC(COC)Oc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 10740327 | 59003 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 410 | 8 | 0 | 6 | 4.4 | COCCN(CCOC)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL169083 | 59003 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 410 | 8 | 0 | 6 | 4.4 | COCCN(CCOC)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 10712065 | 59022 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 338 | 5 | 1 | 6 | 4.0 | CCCC(C)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL169280 | 59022 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 338 | 5 | 1 | 6 | 4.0 | CCCC(C)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL1077301 | 208491 | 0 | None | 12 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(N)=O | 10.1021/jm990590f | |||||
| 53310132 | 63942 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 411 | 9 | 1 | 5 | 5.8 | CCc1nc(-c2ccc(OC(F)(F)F)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806730 | 63942 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 411 | 9 | 1 | 5 | 5.8 | CCc1nc(-c2ccc(OC(F)(F)F)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 11751120 | 133624 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 6.2 | CCCC(CCC)N1CCc2cn(-c3ccc(C#N)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL371407 | 133624 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 406 | 6 | 0 | 4 | 6.2 | CCCC(CCC)N1CCc2cn(-c3ccc(C#N)cc3Cl)c3nc(C)cc1c23 | 10.1021/jm050070m | |||
| CHEMBL429560 | 213540 | 0 | None | -2 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(N)=O | 10.1021/jm990590f | |||||
| 122193725 | 123965 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 476 | 7 | 0 | 4 | 5.6 | CCN(CC)c1cc(C)nc2c1N(CCF)C(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| CHEMBL3628744 | 123965 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 476 | 7 | 0 | 4 | 5.6 | CCN(CC)c1cc(C)nc2c1N(CCF)C(=O)CN2c1ccc(C(C)C)cc1Br | 10.1016/j.bmcl.2015.10.010 | |||
| 18449319 | 63941 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 357 | 9 | 1 | 5 | 4.9 | CCc1nc(-c2ccc(OC)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806729 | 63941 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 357 | 9 | 1 | 5 | 4.9 | CCc1nc(-c2ccc(OC)cc2OC)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 11305354 | 123829 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCCC(c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL362453 | 123829 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 444 | 10 | 0 | 5 | 6.4 | CCCCC(c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1 | 10.1021/jm049339c | |||
| 11450996 | 122255 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 351 | 6 | 0 | 5 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3cnc(C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL359784 | 122255 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 351 | 6 | 0 | 5 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3cnc(C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 9957619 | 59163 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 498 | 8 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(Br)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169955 | 59163 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 498 | 8 | 0 | 8 | 3.1 | COCCN(CCOC)c1nc(C)nc2c1nnn2-c1ccc(Br)cc1Br | 10.1021/jm980224g | |||
| 9910700 | 59045 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169416 | 59045 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 9932463 | 165696 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 430 | 7 | 0 | 6 | 5.0 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL424539 | 165696 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 430 | 7 | 0 | 6 | 5.0 | CCCCN(CC)c1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44387042 | 166116 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 459 | 7 | 0 | 6 | 4.9 | CCCN(CCC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL426044 | 166116 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 459 | 7 | 0 | 6 | 4.9 | CCCN(CCC)c1nc(C)nc2c1n(C)c(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10690278 | 59167 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.8 | CCCCC(CC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| CHEMBL169979 | 59167 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 366 | 7 | 1 | 6 | 4.8 | CCCCC(CC)Nc1nc(C)nc2c1nnn2-c1c(C)cc(C)cc1C | 10.1021/jm980224g | |||
| 53310275 | 63976 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 355 | 8 | 1 | 5 | 4.6 | CCc1nc(-c2cnc(C)cc2N(C)C)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1806957 | 63976 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 355 | 8 | 1 | 5 | 4.6 | CCc1nc(-c2cnc(C)cc2N(C)C)c(CC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 44352447 | 118472 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 603 | 8 | 1 | 4 | 7.8 | CCCN(Cc1sc(Nc2c(Br)cc(Br)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL341313 | 118472 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 603 | 8 | 1 | 4 | 7.8 | CCCN(Cc1sc(Nc2c(Br)cc(Br)cc2Br)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44266496 | 98515 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 459 | 5 | 0 | 3 | 7.6 | CCN(c1nc(C)cc(-c2cccc3ccccc23)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL276184 | 98515 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 459 | 5 | 0 | 3 | 7.6 | CCN(c1nc(C)cc(-c2cccc3ccccc23)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 22249028 | 63943 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 371 | 10 | 1 | 5 | 5.3 | CCOc1ccc(-c2nc(CC)c(NC(CC)CC)nc2CC)c(OC)c1 | 10.1021/jm200365y | |||
| CHEMBL1806731 | 63943 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 371 | 10 | 1 | 5 | 5.3 | CCOc1ccc(-c2nc(CC)c(NC(CC)CC)nc2CC)c(OC)c1 | 10.1021/jm200365y | |||
| 16730517 | 93576 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 451 | 7 | 0 | 5 | 6.0 | CCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL246501 | 93576 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 451 | 7 | 0 | 5 | 6.0 | CCN(CCc1ccccc1)Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12 | 10.1016/j.bmcl.2007.01.008 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm050070m | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm050070m | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10.1021/jm050070m | |||
| 11710664 | 69674 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 380 | 4 | 0 | 4 | 5.4 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3C)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL193522 | 69674 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 380 | 4 | 0 | 4 | 5.4 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3C)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11560105 | 71560 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 386 | 3 | 0 | 4 | 5.3 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3C[C@H](C)N2CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL196307 | 71560 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 386 | 3 | 0 | 4 | 5.3 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3C[C@H](C)N2CC1CC1 | 10.1021/jm049085v | |||
| 11525846 | 71824 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 442 | 5 | 0 | 4 | 6.6 | CC[C@H]1Cn2nc(-c3ccc(C(C)C)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL196879 | 71824 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 442 | 5 | 0 | 4 | 6.6 | CC[C@H]1Cn2nc(-c3ccc(C(C)C)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11691278 | 133138 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 468 | 4 | 0 | 4 | 6.5 | CC[C@H]1Cn2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL370346 | 133138 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 468 | 4 | 0 | 4 | 6.5 | CC[C@H]1Cn2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 11524791 | 135226 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 430 | 5 | 0 | 5 | 5.4 | CC[C@H]1Cn2nc(-c3ccc(OC)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL372365 | 135226 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 430 | 5 | 0 | 5 | 5.4 | CC[C@H]1Cn2nc(-c3ccc(OC)cc3C(F)(F)F)c3nc(C)cc(c32)N1CC1CC1 | 10.1021/jm049085v | |||
| 44341809 | 10219 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 414 | 9 | 0 | 5 | 6.0 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(OC)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL116011 | 10219 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 414 | 9 | 0 | 5 | 6.0 | CCCCN(CCCC)c1cc(C)nc2c(-c3ccc(OC)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 10573028 | 31313 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)n1 | 10.1021/jm960149e | |||
| CHEMBL140175 | 31313 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 398 | 7 | 1 | 4 | 6.1 | CCCN(CC1CC1)c1cc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)n1 | 10.1021/jm960149e | |||
| 44267068 | 168928 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1428 | 40 | 17 | 18 | -1.7 | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)C(CCCCC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N1)C(C)C)[C@@H](C)CC)C(N)=O | 10.1021/jm034180+ | |||
| CHEMBL438724 | 168928 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 1428 | 40 | 17 | 18 | -1.7 | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)C(CCCCC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N1)C(C)C)[C@@H](C)CC)C(N)=O | 10.1021/jm034180+ | |||
| 44306535 | 162683 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 409 | 9 | 0 | 7 | 4.7 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1(c2ccoc2)CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL417033 | 162683 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 409 | 9 | 0 | 7 | 4.7 | CCCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C1(c2ccoc2)CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 20780050 | 93912 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 483 | 5 | 0 | 5 | 6.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCC(Cc5ccccc5)C4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL248162 | 93912 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 483 | 5 | 0 | 5 | 6.3 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCC(Cc5ccccc5)C4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780052 | 93913 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 497 | 6 | 0 | 5 | 6.7 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCC(CCc5ccccc5)C4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL248163 | 93913 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 497 | 6 | 0 | 5 | 6.7 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCC(CCc5ccccc5)C4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 20780120 | 67225 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 456 | 7 | 0 | 4 | 6.8 | CCCCN(CC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187923 | 67225 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 456 | 7 | 0 | 4 | 6.8 | CCCCN(CC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 22249115 | 63993 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 371 | 6 | 1 | 3 | 6.3 | CCc1nc(NC(CC)CC)c(Cl)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| CHEMBL1807033 | 63993 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 371 | 6 | 1 | 3 | 6.3 | CCc1nc(NC(CC)CC)c(Cl)nc1-c1ccc(Cl)cc1Cl | 10.1021/jm200365y | |||
| 44443570 | 154773 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 342 | 9 | 0 | 5 | 4.7 | CCCN(CCC)c1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL400154 | 154773 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 342 | 9 | 0 | 5 | 4.7 | CCCN(CCC)c1nc(CC)c(Oc2cc(C)ccn2)nc1CC | 10.1016/j.bmcl.2007.09.008 | |||
| 22324340 | 206066 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 355 | 7 | 0 | 4 | 4.8 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2C)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL85416 | 206066 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 355 | 7 | 0 | 4 | 4.8 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2C)n(CC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 44337493 | 109785 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 338 | 7 | 0 | 4 | 4.5 | CCCN(c1nc(-c2ccc(C)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL323257 | 109785 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 338 | 7 | 0 | 4 | 4.5 | CCCN(c1nc(-c2ccc(C)cc2C)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 22324337 | 164402 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 387 | 10 | 0 | 6 | 4.3 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CCC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL421334 | 164402 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 387 | 10 | 0 | 6 | 4.3 | CCCN(CCC)c1c(C)nc(-c2ccc(OC)cc2OC)n(CCC)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 10644018 | 57584 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 387 | 2 | 0 | 3 | 5.7 | Cc1cc(Cl)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| CHEMBL166732 | 57584 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 387 | 2 | 0 | 3 | 5.7 | Cc1cc(Cl)c2c(C#N)cn(-c3ccc(C(C)C)cc3Br)c2n1 | 10.1021/jm980223o | |||
| 44352454 | 116862 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 431 | 8 | 1 | 4 | 6.8 | CCCN(Cc1sc(Nc2c(C)cc(Cl)cc2C)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL338154 | 116862 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 431 | 8 | 1 | 4 | 6.8 | CCCN(Cc1sc(Nc2c(C)cc(Cl)cc2C)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 20780281 | 168253 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 448 | 7 | 0 | 4 | 5.3 | CCc1nc2n(c1C(=O)N(CCC(F)(F)F)CC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL433768 | 168253 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 448 | 7 | 0 | 4 | 5.3 | CCc1nc2n(c1C(=O)N(CCC(F)(F)F)CC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 10277887 | 64308 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 485 | 8 | 1 | 4 | 7.9 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181075 | 64308 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 485 | 8 | 1 | 4 | 7.9 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CCC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 44317964 | 104156 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 428 | 7 | 1 | 3 | 5.9 | O=C(CCc1ccncc1)C(Nc1ccccc1Cl)c1ccccc1Br | 10.1021/jm049974i | |||
| CHEMBL309546 | 104156 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 428 | 7 | 1 | 3 | 5.9 | O=C(CCc1ccncc1)C(Nc1ccccc1Cl)c1ccccc1Br | 10.1021/jm049974i | |||
| 20780269 | 130669 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 380 | 7 | 0 | 4 | 4.6 | C=CCN(CCC)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL368245 | 130669 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 380 | 7 | 0 | 4 | 4.6 | C=CCN(CCC)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780071 | 125805 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 558 | 7 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCc4ccccc4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL364809 | 125805 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 558 | 7 | 0 | 4 | 7.8 | Cc1cc(C)c(-n2c3ccccc3n3c(CN(CCc4ccccc4)CC(F)(F)F)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2005.06.028 | |||
| 20780139 | 67455 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 496 | 6 | 0 | 4 | 7.0 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC(F)(F)F | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL189115 | 67455 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 496 | 6 | 0 | 4 | 7.0 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC(F)(F)F | 10.1016/j.bmcl.2005.06.028 | |||
| 20780138 | 122358 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 546 | 7 | 0 | 4 | 7.6 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC(F)(F)C(F)(F)F | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL360000 | 122358 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 546 | 7 | 0 | 4 | 7.6 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12)CC(F)(F)C(F)(F)F | 10.1016/j.bmcl.2005.06.028 | |||
| 20780278 | 66084 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 434 | 7 | 0 | 4 | 5.5 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(Cl)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL183824 | 66084 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 434 | 7 | 0 | 4 | 5.5 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(Cl)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| 11375414 | 75589 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.3 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3cccc(C#N)c3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL204657 | 75589 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 497 | 7 | 1 | 6 | 6.3 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)c2ccc(OCc3cccc(C#N)c3)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44317759 | 205580 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 390 | 8 | 1 | 3 | 6.0 | C=Cc1ccccc1C(Nc1ccc(C)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| CHEMBL81376 | 205580 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 390 | 8 | 1 | 3 | 6.0 | C=Cc1ccccc1C(Nc1ccc(C)cc1Cl)C(=O)CCc1ccncc1 | 10.1021/jm049974i | |||
| 44587373 | 187990 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 385 | 10 | 0 | 5 | 5.4 | CCCc1nc(-c2c(C)cc(C)cc2OC)nc(OC)c1N(CCC)CCC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL497287 | 187990 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 385 | 10 | 0 | 5 | 5.4 | CCCc1nc(-c2c(C)cc(C)cc2OC)nc(OC)c1N(CCC)CCC | 10.1016/j.bmcl.2008.07.063 | |||
| 21916339 | 7282 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 422 | 3 | 0 | 4 | 5.5 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CC=CCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086015 | 7282 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 422 | 3 | 0 | 4 | 5.5 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CC=CCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 46890890 | 6999 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 475 | 6 | 0 | 5 | 5.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4ccncc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1084722 | 6999 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 475 | 6 | 0 | 5 | 5.8 | Cc1cc(C)c(-n2c(Cl)cn3c(CN(C)CCc4ccncc4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 44307855 | 203662 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 357 | 6 | 0 | 5 | 4.6 | CCCN(CCC)c1nc(C)nc2c(-c3ccccc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| CHEMBL67360 | 203662 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 357 | 6 | 0 | 5 | 4.6 | CCCN(CCC)c1nc(C)nc2c(-c3ccccc3Cl)n(C)nc12 | 10.1016/s0960-894x(02)00358-x | |||
| 44305202 | 202856 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.3 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL62533 | 202856 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.3 | CCCCN(CC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 20780250 | 63359 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 408 | 8 | 0 | 4 | 5.2 | CCCN(CCC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL179499 | 63359 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 408 | 8 | 0 | 4 | 5.2 | CCCN(CCC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 18672270 | 123328 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 497 | 8 | 1 | 5 | 7.9 | CCCN(Cc1ccco1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL361647 | 123328 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 497 | 8 | 1 | 5 | 7.9 | CCCN(Cc1ccco1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 20780117 | 67771 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 518 | 8 | 0 | 4 | 8.0 | CCCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL190823 | 67771 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 518 | 8 | 0 | 4 | 8.0 | CCCCN(Cc1ccccc1)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 44307783 | 204079 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 5 | 1 | 6 | 3.0 | COc1cccc(O/C(=N/Nc2ccccc2C#N)C(C)=O)c1 | 10.1021/jm025512y | |||
| CHEMBL70142 | 204079 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 309 | 5 | 1 | 6 | 3.0 | COc1cccc(O/C(=N/Nc2ccccc2C#N)C(C)=O)c1 | 10.1021/jm025512y | |||
| 44392723 | 123708 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.8 | COCCN(CCOC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL362203 | 123708 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 423 | 8 | 0 | 7 | 3.8 | COCCN(CCOC)c1cc(C)nc2c(-c3ncc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 21916321 | 7322 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 440 | 7 | 0 | 4 | 6.3 | CCCCN(CC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086142 | 7322 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 440 | 7 | 0 | 4 | 6.3 | CCCCN(CC)Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12 | 10.1016/j.bmcl.2010.04.094 | |||
| 18691321 | 208114 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 452 | 6 | 0 | 4 | 6.6 | CCN(c1nc(C)cc(-c2ccccc2N(C)C)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL9794 | 208114 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 452 | 6 | 0 | 4 | 6.6 | CCN(c1nc(C)cc(-c2ccccc2N(C)C)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 44392801 | 122524 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 353 | 7 | 1 | 4 | 4.4 | CCCN(CC1CC1)c1cc(C(O)c2c(C)cc(C)cc2C)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL360128 | 122524 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 353 | 7 | 1 | 4 | 4.4 | CCCN(CC1CC1)c1cc(C(O)c2c(C)cc(C)cc2C)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 10666432 | 120860 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 362 | 2 | 0 | 2 | 5.9 | Cc1cc(Cl)nc2c1ccn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| CHEMBL355882 | 120860 | 0 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 362 | 2 | 0 | 2 | 5.9 | Cc1cc(Cl)nc2c1ccn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980223o | |||
| 12967652 | 64591 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 507 | 8 | 1 | 4 | 7.9 | CCN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL181662 | 64591 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 507 | 8 | 1 | 4 | 7.9 | CCN(CCc1ccccc1)Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F | 10.1016/j.bmcl.2004.10.055 | |||
| 11703243 | 124141 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 360 | 2 | 0 | 4 | 4.9 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2C(C)C | 10.1021/jm049085v | |||
| CHEMBL363394 | 124141 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 360 | 2 | 0 | 4 | 4.9 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2C(C)C | 10.1021/jm049085v | |||
| 11706059 | 124334 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 388 | 3 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1C(C)C | 10.1021/jm049085v | |||
| CHEMBL363616 | 124334 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 388 | 3 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1C(C)C | 10.1021/jm049085v | |||
| 11516283 | 133627 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 372 | 3 | 0 | 4 | 4.9 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2CC1CC1 | 10.1021/jm049085v | |||
| CHEMBL371453 | 133627 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 372 | 3 | 0 | 4 | 4.9 | Cc1cc2c3c(n1)c(-c1ccc(Cl)cc1Cl)nn3CCN2CC1CC1 | 10.1021/jm049085v | |||
| 11602680 | 71822 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 346 | 2 | 1 | 4 | 4.9 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1 | 10.1021/jm049085v | |||
| CHEMBL196873 | 71822 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 346 | 2 | 1 | 4 | 4.9 | CC[C@H]1Cn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc(c32)N1 | 10.1021/jm049085v | |||
| 11474047 | 125524 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 366 | 5 | 0 | 6 | 3.5 | CCC(CC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL364680 | 125524 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 366 | 5 | 0 | 6 | 3.5 | CCC(CC)N1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 10622647 | 120800 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 9 | 0 | 5 | 5.5 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL355544 | 120800 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 9 | 0 | 5 | 5.5 | CCCCN(CC)c1cc(C)nc(N(CC)c2ccc(C(C)=O)cc2Br)n1 | 10.1021/jm980222w | |||
| 10548743 | 164983 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 395 | 10 | 0 | 7 | 4.2 | CCCCN(CCC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| CHEMBL422555 | 164983 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 395 | 10 | 0 | 7 | 4.2 | CCCCN(CCC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| 10571912 | 169452 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 381 | 9 | 0 | 7 | 3.8 | CCCCN(CC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| CHEMBL442773 | 169452 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 381 | 9 | 0 | 7 | 3.8 | CCCCN(CC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 | 10.1021/jm980222w | |||
| 44381468 | 120442 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 5.2 | CCC(CCOC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL353891 | 120442 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 445 | 8 | 1 | 6 | 5.2 | CCC(CCOC)Nc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 23068426 | 64004 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 367 | 7 | 1 | 4 | 5.6 | CCc1nc(-c2ccc(Cl)cc2Cl)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807048 | 64004 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 367 | 7 | 1 | 4 | 5.6 | CCc1nc(-c2ccc(Cl)cc2Cl)c(OC)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 9891049 | 7501 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.1 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CC2CC2)CC(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| CHEMBL1087165 | 7501 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 474 | 6 | 0 | 4 | 6.1 | Cc1cc(C)c(N2CCCn3c2nc(C(F)(F)F)c3CN(CC2CC2)CC(F)(F)F)c(C)c1 | 10.1016/j.bmcl.2010.01.127 | |||
| 44446726 | 94834 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 476 | 11 | 0 | 3 | 7.5 | CCCN(CCC)c1c(C)nc(-c2c(CC(F)F)cc(CC(F)F)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253699 | 94834 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 476 | 11 | 0 | 3 | 7.5 | CCCN(CCC)c1c(C)nc(-c2c(CC(F)F)cc(CC(F)F)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44587456 | 188048 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 344 | 7 | 0 | 5 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL497652 | 188048 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 344 | 7 | 0 | 5 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 127033836 | 138627 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 3848 | 124 | 56 | 50 | -13.2 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| CHEMBL3775830 | 138627 | 0 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 3848 | 124 | 56 | 50 | -13.2 | CCCCC(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(CCCC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C)C(=O)N[C@H](C(N)=O)[C@@H](C)CC | 10.1021/acs.jmedchem.5b00926 | |||
| 44341814 | 110664 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 422 | 8 | 0 | 6 | 4.4 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL325918 | 110664 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 422 | 8 | 0 | 6 | 4.4 | COCCN(CCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 21916322 | 152819 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 429 | 7 | 0 | 5 | 5.9 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL397389 | 152819 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 429 | 7 | 0 | 5 | 5.9 | CCCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CCC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 21916270 | 6394 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 480 | 6 | 0 | 4 | 6.5 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC(F)(F)F | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1082302 | 6394 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 480 | 6 | 0 | 4 | 6.5 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC(F)(F)F | 10.1016/j.bmcl.2010.04.094 | |||
| 44266431 | 4477 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 485 | 6 | 0 | 3 | 8.2 | CCN(c1nc(C)cc(-c2ccccc2-c2ccccc2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10189 | 4477 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 485 | 6 | 0 | 3 | 8.2 | CCN(c1nc(C)cc(-c2ccccc2-c2ccccc2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 22249051 | 64002 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 369 | 7 | 1 | 5 | 5.1 | CCC(CC)Nc1nc(OC)c(-c2ccc(Cl)cc2Cl)nc1OC | 10.1021/jm200365y | |||
| CHEMBL1807042 | 64002 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 369 | 7 | 1 | 5 | 5.1 | CCC(CC)Nc1nc(OC)c(-c2ccc(Cl)cc2Cl)nc1OC | 10.1021/jm200365y | |||
| 20780048 | 148579 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 469 | 4 | 0 | 5 | 6.2 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCC(c5ccccc5)C4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL393901 | 148579 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 469 | 4 | 0 | 5 | 6.2 | Cc1cc(C)c(-n2c3ncccc3n3c(CN4CCC(c5ccccc5)C4)c(C)nc23)c(Cl)c1 | 10.1016/j.bmcl.2007.01.008 | |||
| 9824147 | 162719 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 8 | 0 | 8 | 4.5 | COCCN(CCOC)c1nc(C)nc2c1sc(=S)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL417091 | 162719 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 8 | 0 | 8 | 4.5 | COCCN(CCOC)c1nc(C)nc2c1sc(=S)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| 9869432 | 18846 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.5 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL128100 | 18846 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.5 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2003.08.055 | |||
| 44347436 | 16376 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 450 | 7 | 0 | 5 | 5.4 | CCCN(CC1CC1)c1cc([S+](C)[O-])nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| CHEMBL122960 | 16376 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 450 | 7 | 0 | 5 | 5.4 | CCCN(CC1CC1)c1cc([S+](C)[O-])nc2c(-c3ccc(Cl)cc3Cl)c(C)nn12 | 10.1016/j.bmcl.2004.05.019 | |||
| 15490817 | 98558 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 495 | 6 | 0 | 5 | 6.4 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL276599 | 98558 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 495 | 6 | 0 | 5 | 6.4 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| 22249156 | 63999 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 5.9 | CCc1nc(-c2ccc(Cl)cc2Cl)c(C)nc1NC(CC)CC | 10.1021/jm200365y | |||
| CHEMBL1807039 | 63999 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 351 | 6 | 1 | 3 | 5.9 | CCc1nc(-c2ccc(Cl)cc2Cl)c(C)nc1NC(CC)CC | 10.1021/jm200365y | |||
| 9869432 | 18846 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.5 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL128100 | 18846 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 471 | 8 | 1 | 4 | 7.5 | CCCN(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)CC1CC1 | 10.1016/j.bmcl.2004.10.055 | |||
| 11235359 | 66288 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 414 | 6 | 0 | 6 | 5.3 | CCCN(c1ccccc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL184752 | 66288 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 414 | 6 | 0 | 6 | 5.3 | CCCN(c1ccccc1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44341733 | 9917 | 1 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 352 | 6 | 0 | 2 | 6.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL114419 | 9917 | 1 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 352 | 6 | 0 | 2 | 6.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)cccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 44341456 | 110685 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 496 | 9 | 0 | 5 | 7.1 | CCCCN(CCc1ccc(OC)cc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL325996 | 110685 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 496 | 9 | 0 | 5 | 7.1 | CCCCN(CCc1ccc(OC)cc1)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 11383809 | 5371 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 5.7 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(CC)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| CHEMBL106972 | 5371 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 5.7 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(CC)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| 11383809 | 5371 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 5.7 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(CC)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL106972 | 5371 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 392 | 8 | 0 | 4 | 5.7 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(CC)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 9998456 | 27431 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 357 | 9 | 1 | 7 | 3.6 | CCCN(CC1CC1)c1nc(C)nc(Nc2ccc(OC)cc2OC)n1 | 10.1021/jm960148m | |||
| CHEMBL136828 | 27431 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 357 | 9 | 1 | 7 | 3.6 | CCCN(CC1CC1)c1nc(C)nc(Nc2ccc(OC)cc2OC)n1 | 10.1021/jm960148m | |||
| 44315525 | 104190 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 387 | 10 | 1 | 8 | 3.6 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(OC)cc(OC)cc2OC)n1 | 10.1021/jm9900117 | |||
| CHEMBL309789 | 104190 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 387 | 10 | 1 | 8 | 3.6 | CCCN(CC1CC1)c1nc(C)nc(Nc2c(OC)cc(OC)cc2OC)n1 | 10.1021/jm9900117 | |||
| CHEMBL413613 | 213078 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1)[C@@H](C)CC)C(N)=O | 10.1021/jm034180+ | |||||
| 44341463 | 110419 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.2 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| CHEMBL324495 | 110419 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 356 | 6 | 0 | 4 | 5.2 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)n(C)nc12 | 10.1016/s0960-894x(03)00621-8 | |||
| 44392734 | 65264 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 337 | 7 | 0 | 4 | 4.3 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2ccccc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL182803 | 65264 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 337 | 7 | 0 | 4 | 4.3 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2ccccc2C)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 44392787 | 131791 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 383 | 9 | 0 | 6 | 4.0 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2ccc(OC)cc2OC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL369333 | 131791 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 383 | 9 | 0 | 6 | 4.0 | CCCN(CC1CC1)c1nc(C)nc(C(=O)c2ccc(OC)cc2OC)c1C | 10.1016/j.bmcl.2004.05.072 | |||
| 44443645 | 154759 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 434 | 9 | 2 | 7 | 4.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCO | 10.1016/j.bmcl.2007.09.008 | |||
| CHEMBL400082 | 154759 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 434 | 9 | 2 | 7 | 4.2 | CCc1nc(Oc2cc(C)ccn2)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OCCO | 10.1016/j.bmcl.2007.09.008 | |||
| 10295681 | 18867 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 419 | 7 | 1 | 4 | 6.4 | CCCN(CCC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| CHEMBL128201 | 18867 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 419 | 7 | 1 | 4 | 6.4 | CCCN(CCC)C(=O)c1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C | 10.1016/j.bmcl.2003.08.055 | |||
| 10622505 | 59061 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 429 | 8 | 0 | 7 | 4.3 | CCCCN(CC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1S(C)(=O)=O | 10.1021/jm980224g | |||
| CHEMBL169521 | 59061 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 429 | 8 | 0 | 7 | 4.3 | CCCCN(CC)c1cc(C)nc2c1nnn2-c1ccc(C(C)C)cc1S(C)(=O)=O | 10.1021/jm980224g | |||
| 11453549 | 70569 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 442 | 10 | 0 | 6 | 5.9 | CCCC(c1ccccc1)N(CCC)c1nc(-c2cc(OC)c(OC)cc2Cl)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL194877 | 70569 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 442 | 10 | 0 | 6 | 5.9 | CCCC(c1ccccc1)N(CCC)c1nc(-c2cc(OC)c(OC)cc2Cl)n(C)n1 | 10.1021/jm049339c | |||
| 44266513 | 4222 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 485 | 6 | 0 | 3 | 8.2 | CCN(c1nc(C)cc(-c2cccc(-c3ccccc3)c2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10032 | 4222 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 485 | 6 | 0 | 3 | 8.2 | CCN(c1nc(C)cc(-c2cccc(-c3ccccc3)c2)n1)c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00132-8 | |||
| 11291132 | 65217 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 352 | 6 | 1 | 6 | 3.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL182595 | 65217 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 352 | 6 | 1 | 6 | 3.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N)cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 11291132 | 65217 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 352 | 6 | 1 | 6 | 3.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL182595 | 65217 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 352 | 6 | 1 | 6 | 3.9 | CCCN(CCC)c1cc(C)nc2c(-c3ncc(N)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 44407873 | 98236 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 414 | 5 | 1 | 4 | 5.7 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)Cc2ccc(Cl)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| CHEMBL274388 | 98236 | 0 | None | - | 1 | Rat | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 414 | 5 | 1 | 4 | 5.7 | Cc1cc(C)c(Nc2nc(C)ccc2S(=O)(=O)Cc2ccc(Cl)cc2)c(C)c1 | 10.1016/j.bmcl.2005.10.097 | |||
| 44306205 | 203055 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 395 | 10 | 0 | 5 | 5.1 | CCCN(c1ncc(CC)c(-c2ccc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| CHEMBL63585 | 203055 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 395 | 10 | 0 | 5 | 5.1 | CCCN(c1ncc(CC)c(-c2ccc(OC)cc2OC)n1)C(C1CC1)C1CC1 | 10.1016/j.bmcl.2004.02.053 | |||
| 10958953 | 203551 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 346 | 5 | 1 | 5 | 3.7 | CC(=O)/C(=N\Nc1ccccc1[N+](=O)[O-])N(C)c1cccc(Cl)c1 | 10.1021/jm025512y | |||
| CHEMBL66602 | 203551 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 346 | 5 | 1 | 5 | 3.7 | CC(=O)/C(=N\Nc1ccccc1[N+](=O)[O-])N(C)c1cccc(Cl)c1 | 10.1021/jm025512y | |||
| 44392724 | 123112 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 357 | 6 | 0 | 5 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cn3)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL361099 | 123112 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 357 | 6 | 0 | 5 | 4.7 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cn3)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 11348744 | 127177 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 352 | 5 | 0 | 6 | 3.1 | CCCCN1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL365745 | 127177 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 352 | 5 | 0 | 6 | 3.1 | CCCCN1CCn2c(=O)n(-c3ccc(OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 44385524 | 166114 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 445 | 7 | 1 | 6 | 5.3 | CCCCN(CC)c1nc(C)nc2c1nc(O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| CHEMBL426026 | 166114 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 445 | 7 | 1 | 6 | 5.3 | CCCCN(CC)c1nc(C)nc2c1nc(O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00108-0 | |||
| 10717634 | 4492 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCN(CCC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL10203 | 4492 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCN(CCC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10026532 | 97282 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 444 | 9 | 0 | 4 | 6.5 | CCCN(CC1CC1)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL268993 | 97282 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 444 | 9 | 0 | 4 | 6.5 | CCCN(CC1CC1)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 10576982 | 120452 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 488 | 6 | 0 | 4 | 5.2 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(I)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL353973 | 120452 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 488 | 6 | 0 | 4 | 5.2 | CCN(CC)c1cc(C)nc(N(CC)c2ccc(I)cc2Br)n1 | 10.1021/jm980222w | |||
| 44341714 | 10109 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 382 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(OC)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| CHEMBL115566 | 10109 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 382 | 7 | 0 | 3 | 6.5 | CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3)c(OC)ccc12 | 10.1016/s0960-894x(03)00684-x | |||
| 10138067 | 6637 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 438 | 6 | 0 | 4 | 6.0 | CCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1083319 | 6637 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 438 | 6 | 0 | 4 | 6.0 | CCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| 10717634 | 4492 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCN(CCC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10203 | 4492 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 432 | 9 | 0 | 4 | 6.5 | CCCN(CCC)c1cc(C)nc(N(CC)c2ccc(C(C)C)cc2Br)n1 | 10.1016/s0960-894x(99)00132-8 | |||
| 44446729 | 94867 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 390 | 8 | 0 | 3 | 6.7 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253913 | 94867 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 390 | 8 | 0 | 3 | 6.7 | CCCN(CCC)c1c(CC)nc(-c2c(C)cc(C)cc2OC)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 24971237 | 188049 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 380 | 8 | 0 | 6 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL497653 | 188049 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 380 | 8 | 0 | 6 | 4.7 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(Cl)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 44587457 | 188166 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 396 | 9 | 0 | 6 | 5.0 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(C(F)F)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL498667 | 188166 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 396 | 9 | 0 | 6 | 5.0 | CCC(CC)Oc1c(C)nc(-c2c(OC)cc(C(F)F)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 11338351 | 78331 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2094044 | 78331 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| CHEMBL2109792 | 78331 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 392 | 9 | 0 | 5 | 5.6 | CCC[C@@H](c1ccccc1)N(CCC)c1nc(-c2ccc(OC)cc2C)n(C)n1 | 10.1021/jm049339c | |||
| 9886113 | 9223 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 5.2 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| CHEMBL110609 | 9223 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 5.2 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(C)n1)C(C1CC1)C1CC1 | 10.1016/s0960-894x(01)00657-6 | |||
| 11773483 | 65573 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| CHEMBL183148 | 65573 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1016/j.bmcl.2004.05.056 | |||
| 20780255 | 7389 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 452 | 7 | 0 | 4 | 6.3 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086468 | 7389 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 452 | 7 | 0 | 4 | 6.3 | CCCN(Cc1c(C(F)(F)F)nc2n(-c3c(C)cc(C)cc3C)c(Cl)cn12)CC1CC1 | 10.1016/j.bmcl.2010.04.094 | |||
| 15490818 | 4942 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 461 | 6 | 0 | 5 | 6.0 | CCN(c1nc(C)cc(-c2ccccc2Cl)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10473 | 4942 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 461 | 6 | 0 | 5 | 6.0 | CCN(c1nc(C)cc(-c2ccccc2Cl)n1)c1c(Br)cc(OC)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| 11773483 | 65573 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL183148 | 65573 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 382 | 7 | 0 | 7 | 4.3 | CCCN(CCC)c1cc(C)nc2c(-c3ncc([N+](=O)[O-])cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 9929418 | 161768 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 372 | 4 | 0 | 6 | 5.3 | CCN(CC)c1nc(C)nc2c1sc(=S)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL413968 | 161768 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 372 | 4 | 0 | 6 | 5.3 | CCN(CC)c1nc(C)nc2c1sc(=S)n2-c1c(C)cc(C)cc1C | 10.1016/s0960-894x(99)00159-6 | |||
| 10836468 | 120265 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 431 | 7 | 0 | 6 | 4.5 | CCN(CCOC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL352438 | 120265 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 431 | 7 | 0 | 6 | 4.5 | CCN(CCOC)c1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 9886113 | 9223 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 5.2 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(C)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| CHEMBL110609 | 9223 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 378 | 7 | 0 | 4 | 5.2 | CCCN(c1nc(-c2ccc(Cl)cc2Cl)n(C)n1)C(C1CC1)C1CC1 | 10.1021/jm049339c | |||
| 9803011 | 98852 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 434 | 5 | 0 | 6 | 4.9 | CCN(CC)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| CHEMBL278895 | 98852 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 434 | 5 | 0 | 6 | 4.9 | CCN(CC)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1016/s0960-894x(99)00159-6 | |||
| 9910700 | 59045 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169416 | 59045 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 432 | 7 | 1 | 7 | 4.2 | CCC(COC)Nc1nc(C)nc2c1nnn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 9803011 | 98852 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 434 | 5 | 0 | 6 | 4.9 | CCN(CC)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| CHEMBL278895 | 98852 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 434 | 5 | 0 | 6 | 4.9 | CCN(CC)c1nc(C)nc2c1sc(=O)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm990590f | |||
| 18691325 | 4191 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 508 | 6 | 0 | 5 | 6.5 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1c(Br)cc(N(C)C)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| CHEMBL10015 | 4191 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 508 | 6 | 0 | 5 | 6.5 | CCN(c1nc(C)cc(-c2ccccc2C(F)(F)F)n1)c1c(Br)cc(N(C)C)cc1OC | 10.1016/s0960-894x(99)00132-8 | |||
| 11326060 | 67017 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 366 | 6 | 1 | 6 | 4.4 | CCC(CC)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| CHEMBL186992 | 67017 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 366 | 6 | 1 | 6 | 4.4 | CCC(CC)Nc1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 | 10.1021/jm040058e | |||
| 10646423 | 59361 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 432 | 7 | 0 | 6 | 4.8 | CCC(COC)Oc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL170788 | 59361 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 432 | 7 | 0 | 6 | 4.8 | CCC(COC)Oc1nc(C)nc2c1ncn2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341805 | 110518 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 406 | 6 | 0 | 5 | 5.1 | COCCN(c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12)C(C)C | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL325051 | 110518 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 406 | 6 | 0 | 5 | 5.1 | COCCN(c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12)C(C)C | 10.1016/s0960-894x(03)00622-x | |||
| 10528542 | 59089 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 474 | 9 | 0 | 6 | 5.0 | COCCN(CCOC)c1cc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| CHEMBL169641 | 59089 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 474 | 9 | 0 | 6 | 5.0 | COCCN(CCOC)c1cc(C)nc2c1nc(C)n2-c1ccc(C(C)C)cc1Br | 10.1021/jm980224g | |||
| 44341835 | 9495 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 420 | 8 | 0 | 5 | 5.5 | CCCN(CCCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| CHEMBL112045 | 9495 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 420 | 8 | 0 | 5 | 5.5 | CCCN(CCCOC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)nn(C)c12 | 10.1016/s0960-894x(03)00622-x | |||
| 9822241 | 64009 | 8 | None | -9 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 399 | 8 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | |||
| CHEMBL1807053 | 64009 | 8 | None | -9 | 2 | Rat | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 399 | 8 | 1 | 6 | 5.0 | CCC(CC)Nc1nc(C)c(-c2ccc(OC(F)(F)F)cc2OC)nc1OC | 10.1021/jm200365y | |||
| 11546255 | 188117 | 0 | None | 12022 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 419 | 5 | 0 | 7 | 4.9 | CCC(CC)c1cc(C)nn2c(-c3sc(N4CCOCC4)nc3Cl)c(C)nc12 | 10.1016/j.ejmech.2021.113867 | |||
| CHEMBL498311 | 188117 | 0 | None | 12022 | 2 | Human | 8.0 | pKi | = | 8 | Binding | ChEMBL | 419 | 5 | 0 | 7 | 4.9 | CCC(CC)c1cc(C)nn2c(-c3sc(N4CCOCC4)nc3Cl)c(C)nc12 | 10.1016/j.ejmech.2021.113867 | |||
| 9950645 | 105243 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 357 | 7 | 0 | 5 | 4.0 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL311520 | 105243 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 357 | 7 | 0 | 5 | 4.0 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(C)c1=O | 10.1016/s0960-894x(03)00483-9 | |||
| 10686834 | 120459 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 315 | 5 | 0 | 5 | 4.2 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)=O)cc1SC | 10.1021/jm980222w | |||
| CHEMBL354022 | 120459 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 315 | 5 | 0 | 5 | 4.2 | CCN(c1nc(C)cc(C)n1)c1ccc(C(C)=O)cc1SC | 10.1021/jm980222w | |||
| 44392742 | 123573 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 409 | 11 | 0 | 4 | 5.8 | CCCN(CC1CC1)c1cc(C(OC)c2c(CC)cc(CC)cc2CC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| CHEMBL361831 | 123573 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 409 | 11 | 0 | 4 | 5.8 | CCCN(CC1CC1)c1cc(C(OC)c2c(CC)cc(CC)cc2CC)nc(C)n1 | 10.1016/j.bmcl.2004.05.072 | |||
| 11440355 | 63009 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 378 | 8 | 0 | 5 | 5.0 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C(C)C)C(C)C | 10.1021/jm049339c | |||
| CHEMBL178702 | 63009 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 378 | 8 | 0 | 5 | 5.0 | CCCN(c1nc(-c2ccc(Cl)cc2OC)n(C)n1)C(C(C)C)C(C)C | 10.1021/jm049339c | |||
| 11304752 | 67655 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 422 | 7 | 0 | 7 | 4.1 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(C(=O)OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| CHEMBL190661 | 67655 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 422 | 7 | 0 | 7 | 4.1 | CCCC(CCC)N1CCn2c(=O)n(-c3ccc(C(=O)OC)cc3)c3nc(C)cc1c32 | 10.1021/jm050384+ | |||
| 21916077 | 7284 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 442 | 3 | 0 | 5 | 5.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCSCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| CHEMBL1086017 | 7284 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 442 | 3 | 0 | 5 | 5.3 | Cc1cc(C)c(-n2c(Cl)cn3c(CN4CCSCC4)c(C(F)(F)F)nc23)c(C)c1 | 10.1016/j.bmcl.2010.04.094 | |||
| 44317760 | 205555 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 378 | 7 | 1 | 3 | 5.7 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C)c(Cl)c1 | 10.1021/jm049974i | |||
| CHEMBL81117 | 205555 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 378 | 7 | 1 | 3 | 5.7 | Cc1ccc(NC(C(=O)CCc2ccncc2)c2ccccc2C)c(Cl)c1 | 10.1021/jm049974i | |||
| 44305209 | 203431 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 424 | 6 | 0 | 4 | 6.6 | CCCCN(CC)c1cc(C)nc2c(-c3c(Cl)cc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| CHEMBL65724 | 203431 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 424 | 6 | 0 | 4 | 6.6 | CCCCN(CC)c1cc(C)nc2c(-c3c(Cl)cc(Cl)cc3Cl)c(C)nn12 | 10.1016/s0960-894x(98)00372-2 | |||
| 20780175 | 166603 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 401 | 6 | 0 | 5 | 5.1 | CCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| CHEMBL428048 | 166603 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 401 | 6 | 0 | 5 | 5.1 | CCN(Cc1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ncccc3n12)CC1CC1 | 10.1016/j.bmcl.2007.01.008 | |||
| 135553002 | 205690 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 343 | 7 | 1 | 5 | 4.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1O | 10.1016/s0960-894x(03)00483-9 | |||
| CHEMBL82265 | 205690 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 343 | 7 | 1 | 5 | 4.4 | CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)nc1O | 10.1016/s0960-894x(03)00483-9 | |||
| 44397631 | 67146 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 460 | 7 | 0 | 4 | 6.2 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| CHEMBL187577 | 67146 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 460 | 7 | 0 | 4 | 6.2 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n(-c3c(C)cc(C)cc3C)c3ccc(F)cc3n12 | 10.1016/j.bmcl.2005.06.028 | |||
| 11689443 | 64367 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 380 | 6 | 0 | 4 | 4.4 | CCc1nc2n(c1C(=O)N(CC)CC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL181283 | 64367 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 380 | 6 | 0 | 4 | 4.4 | CCc1nc2n(c1C(=O)N(CC)CC1CC1)CCN2c1c(C)cc(C)cc1C | 10.1016/j.bmcl.2005.05.117 | |||
| 20780028 | 131372 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 414 | 7 | 0 | 4 | 5.1 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| CHEMBL368879 | 131372 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 414 | 7 | 0 | 4 | 5.1 | CCCN(CC1CC1)C(=O)c1c(CC)nc2n1CCN2c1c(C)cc(C)cc1Cl | 10.1016/j.bmcl.2005.05.117 | |||
| 44587377 | 172927 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 343 | 7 | 1 | 5 | 4.7 | CCC(CC)Nc1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| CHEMBL451660 | 172927 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 343 | 7 | 1 | 5 | 4.7 | CCC(CC)Nc1c(C)nc(-c2c(C)cc(C)cc2OC)nc1OC | 10.1016/j.bmcl.2008.07.063 | |||
| 10616689 | 58737 | 1 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 333 | 3 | 0 | 3 | 4.7 | Cc1cc(C)nc(N(C)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980223o | |||
| CHEMBL168568 | 58737 | 1 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 333 | 3 | 0 | 3 | 4.7 | Cc1cc(C)nc(N(C)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980223o | |||
| 10616689 | 58737 | 1 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 333 | 3 | 0 | 3 | 4.7 | Cc1cc(C)nc(N(C)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| CHEMBL168568 | 58737 | 1 | None | - | 1 | Rat | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 333 | 3 | 0 | 3 | 4.7 | Cc1cc(C)nc(N(C)c2ccc(C(C)C)cc2Br)n1 | 10.1021/jm980222w | |||
| 44446719 | 94778 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 352 | 6 | 0 | 2 | 6.5 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| CHEMBL253286 | 94778 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 352 | 6 | 0 | 2 | 6.5 | CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2)c2ccccc12 | 10.1016/j.bmcl.2007.12.050 | |||
| 44389088 | 62974 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 459 | 6 | 1 | 4 | 7.5 | CC(C)N(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)C(C)C | 10.1016/j.bmcl.2004.10.055 | |||
| CHEMBL178523 | 62974 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 459 | 6 | 1 | 4 | 7.5 | CC(C)N(Cc1sc(Nc2c(Cl)cc(Cl)cc2Cl)nc1C(F)(F)F)C(C)C | 10.1016/j.bmcl.2004.10.055 | |||
| 10379 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | |||
| 9884366 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | |||
| CHEMBL482950 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | |||
| DB12572 | 3059 | 39 | None | - | 1 | Human | 6.5 | pIC50 | = | 6.5 | Binding | Guide to Pharmacology | 340 | 5 | 1 | 7 | 3.3 | CC[C@H](Nc1nc(C)nc2n1nc(c2c1ccc(nc1C)OC)C)C | 28174066 | |||
| 10377 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Guide to Pharmacology | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18260619 | |||
| 9818802 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Guide to Pharmacology | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18260619 | |||
| CHEMBL270738 | 1179 | 27 | None | 1 | 2 | Rat | 8.2 | pIC50 | = | 8.2 | Binding | Guide to Pharmacology | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18260619 | |||
| 912 | 1167 | 0 | None | 1 | 4 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 912 | 1167 | 0 | None | 1 | 4 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 7477349 | |||||
| 912 | 1167 | 0 | None | 1 | 4 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 7692441 | |||||
| 912 | 1167 | 0 | None | 1 | 4 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 8612563 | |||||
| 912 | 1167 | 0 | None | 1 | 4 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9326293 | |||||
| 912 | 1167 | 0 | None | 1 | 4 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9851694 | |||||
| 913 | 1168 | 0 | None | 44 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 913 | 1168 | 0 | None | 44 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 15450949 | |||||
| 913 | 1168 | 0 | None | 44 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9326293 | |||||
| 913 | 1168 | 0 | None | 44 | 2 | Human | 8.1 | pKd | = | 8.1 | Binding | Guide to Pharmacology | None | None | None | None | 9851694 | |||||
| 16133798 | 506 | 0 | None | -3 | 4 | Human | 8.3 | pKd | = | 8.3 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 16133798 | 506 | 0 | None | -3 | 4 | Human | 8.3 | pKd | = | 8.3 | Binding | Guide to Pharmacology | None | None | None | None | 9851694 | |||||
| 16133798 | 506 | 0 | None | -3 | 4 | Human | 8.3 | pKd | = | 8.3 | Binding | Guide to Pharmacology | None | None | None | None | 9918582 | |||||
| 925 | 506 | 0 | None | -3 | 4 | Human | 8.3 | pKd | = | 8.3 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 925 | 506 | 0 | None | -3 | 4 | Human | 8.3 | pKd | = | 8.3 | Binding | Guide to Pharmacology | None | None | None | None | 9851694 | |||||
| 925 | 506 | 0 | None | -3 | 4 | Human | 8.3 | pKd | = | 8.3 | Binding | Guide to Pharmacology | None | None | None | None | 9918582 | |||||
| 920 | 3949 | 0 | None | -1 | 3 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 920 | 3949 | 0 | None | -1 | 3 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 11416224 | |||||
| 920 | 3949 | 0 | None | -1 | 3 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 7477349 | |||||
| 920 | 3949 | 0 | None | -1 | 3 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 8612563 | |||||
| 920 | 3949 | 0 | None | -1 | 3 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 9918582 | |||||
| 919 | 3950 | 0 | None | -1 | 4 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 919 | 3950 | 0 | None | -1 | 4 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 15450949 | |||||
| 919 | 3950 | 0 | None | -1 | 4 | Human | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 8612563 | |||||
| 921 | 3953 | 0 | None | -8912 | 4 | Human | 5.4 | pKd | None | 5.4 | Binding | Guide to Pharmacology | None | None | None | None | 15450949 | |||||
| CHEMBL429970 | 3953 | 0 | None | -8912 | 4 | Human | 5.4 | pKd | None | 5.4 | Binding | Guide to Pharmacology | None | None | None | None | 15450949 | |||||
| 155817385 | 360 | 0 | None | -31 | 3 | Human | 7.6 | pKd | None | 7.6 | Binding | Guide to Pharmacology | None | None | None | None | 9918582 | |||||
| 923 | 360 | 0 | None | -31 | 3 | Human | 7.6 | pKd | None | 7.6 | Binding | Guide to Pharmacology | None | None | None | None | 9918582 | |||||
| 918 | 3488 | 0 | None | -3 | 4 | Human | 8.0 | pKd | None | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 918 | 3488 | 0 | None | -3 | 4 | Human | 8.0 | pKd | None | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 15450949 | |||||
| 918 | 3488 | 0 | None | -3 | 4 | Human | 8.0 | pKd | None | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 7477349 | |||||
| 918 | 3488 | 0 | None | -3 | 4 | Human | 8.0 | pKd | None | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 8612563 | |||||
| 918 | 3488 | 0 | None | -3 | 4 | Human | 8.0 | pKd | None | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9326293 | |||||
| 918 | 3488 | 0 | None | -3 | 4 | Human | 8.0 | pKd | None | 8.0 | Binding | Guide to Pharmacology | None | None | None | None | 9918582 | |||||
| 922 | 3957 | 0 | None | 1 | 3 | Human | 8.6 | pKd | None | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11123370 | |||||
| 922 | 3957 | 0 | None | 1 | 3 | Human | 8.6 | pKd | None | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 7477349 | |||||
| 177990 | 426 | 23 | 125I-Sauvagine | -1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 3489 | 426 | 23 | 125I-Sauvagine | -1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| CHEMBL296641 | 426 | 23 | 125I-Sauvagine | -1 | 2 | Human | 9.4 | pKi | = | 9.4 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 177990 | 426 | 23 | 3H-NBI 35965 + GTP GammaS | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 3489 | 426 | 23 | 3H-NBI 35965 + GTP GammaS | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| CHEMBL296641 | 426 | 23 | 3H-NBI 35965 + GTP GammaS | -1 | 2 | Human | 9.2 | pKi | = | 9.2 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 177990 | 426 | 23 | 125I-Sauvigine + GTP GammaS | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 3489 | 426 | 23 | 125I-Sauvigine + GTP GammaS | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| CHEMBL296641 | 426 | 23 | 125I-Sauvigine + GTP GammaS | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 177990 | 426 | 23 | 125I-Sauvagine | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 3489 | 426 | 23 | 125I-Sauvagine | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| CHEMBL296641 | 426 | 23 | 125I-Sauvagine | -1 | 2 | Human | 8.5 | pKi | = | 8.5 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 177990 | 426 | 23 | 125I-Astressin + GTP GammaS | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 3489 | 426 | 23 | 125I-Astressin + GTP GammaS | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| CHEMBL296641 | 426 | 23 | 125I-Astressin + GTP GammaS | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | PDSP KiDatabase | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | None | |||
| 10377 | 1179 | 27 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18260619 | |||
| 9818802 | 1179 | 27 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18260619 | |||
| CHEMBL270738 | 1179 | 27 | None | -1 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Guide to Pharmacology | 327 | 6 | 0 | 3 | 6.0 | CCC(Oc1cc(C)nc(c1C)Oc1c(C)cc(cc1C)C)CC | 18260619 | |||
| 10378 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 21074436 | |||
| 11596613 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 21074436 | |||
| CHEMBL1287935 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 21074436 | |||
| DB12512 | 3985 | 37 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Guide to Pharmacology | 406 | 6 | 1 | 8 | 4.6 | COc1ccc(c(c1)C)c1c(C)nn2c1nc(C)cc2N[C@H](c1onc(n1)C)CC | 21074436 | |||
| 10375 | 2739 | 18 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 16078829 | |||
| 9888194 | 2739 | 18 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 16078829 | |||
| CHEMBL188907 | 2739 | 18 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | 416 | 6 | 0 | 4 | 6.5 | CCCC(N1CCn2c3c1cc(C)nc3c(n2)c1ccc(cc1Cl)Cl)CCC | 16078829 | |||
| 11025 | 2740 | 7 | None | -1 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 12957366 | |||
| 11713007 | 2740 | 7 | None | -1 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 12957366 | |||
| CHEMBL380800 | 2740 | 7 | None | -1 | 2 | Rat | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 400 | 4 | 0 | 4 | 5.7 | CC[C@H]1Cn2nc(c3c2c(N1CC1CC1)cc(n3)C)c1ccc(cc1Cl)Cl | 12957366 | |||
| 177990 | 426 | 23 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 8940412 | |||
| 3489 | 426 | 23 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 8940412 | |||
| CHEMBL296641 | 426 | 23 | None | -1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 378 | 6 | 0 | 4 | 5.9 | CCCCN(c1nc(C)nc2c1c(C)c(n2c1c(C)cc(cc1C)C)C)CC | 8940412 | |||
| 3499 | 1448 | 28 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10669572 | |||
| 9909468 | 1448 | 28 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10669572 | |||
| CHEMBL44698 | 1448 | 28 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 409 | 7 | 1 | 7 | 3.8 | COCC(Nc1nc(C)nc2n1nc(c2c1ccc(cc1Cl)Cl)C)COC | 10669572 | |||
| 176157 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 8893829 | |||
| 3512 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 8893829 | |||
| CHEMBL45281 | 2738 | 28 | None | 9 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 432 | 7 | 1 | 4 | 6.8 | CCCN(c1nc(C)nc(c1Cl)Nc1c(Cl)cc(cc1Cl)Cl)CC1CC1 | 8893829 | |||
| 3520 | 3267 | 54 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10867111 | |||
| 9821250 | 3267 | 54 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10867111 | |||
| CHEMBL309138 | 3267 | 54 | None | 1 | 2 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 380 | 7 | 0 | 6 | 4.4 | CCCN(c1cc(C)nc2n1nc(c2c1cnc(cc1C)N(C)C)C)CCC | 10867111 | |||
| 16133798 | 506 | 0 | None | -3 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 24269930 | |||||
| 925 | 506 | 0 | None | -3 | 4 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | None | None | None | None | 24269930 | |||||
| 3533 | 1206 | 24 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 11907190 | |||
| 5282340 | 1206 | 24 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 11907190 | |||
| CHEMBL291657 | 1206 | 24 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | Guide to Pharmacology | 482 | 8 | 0 | 4 | 7.5 | C#CCN([C@H](c1ccc(c(c1)F)C)CC1CC1)c1sc(c(n1)c1cc(C)c(cc1Cl)OC)C | 11907190 | |||