Ligand source activities (1 row/activity)
| Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Potency) |
# tested GPCRs (Potency) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
| 101635584 | 2559 | 26 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm801332q | ||||
| 1458 | 2559 | 26 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm801332q | ||||
| 16136567 | 2559 | 26 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm801332q | ||||
| 3794 | 2559 | 26 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm801332q | ||||
| 91898963 | 2559 | 26 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm801332q | ||||
| CHEMBL525634 | 2559 | 26 | None | - | 1 | Human | 10.4 | pEC50 | = | 10.4 | Functional | ChEMBL | None | None | None | None | 10.1021/jm801332q | ||||
| 10010118 | 100965 | 0 | None | - | 1 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL297494 | 100965 | 0 | None | - | 1 | Human | 10.3 | pEC50 | = | 10.3 | Functional | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL2372767 | 208540 | 0 | None | - | 1 | Human | 9.8 | pEC50 | = | 9.8 | Functional | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](CCSC)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](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O | 10.1021/jm0304865 | ||||
| 11181688 | 100865 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 721 | 13 | 4 | 11 | 1.5 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL296748 | 100865 | 0 | None | - | 1 | Human | 9.7 | pEC50 | = | 9.7 | Functional | ChEMBL | 721 | 13 | 4 | 11 | 1.5 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 23728661 | 88402 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 432 | 5 | 1 | 4 | 4.3 | Cc1cc(N(C)C(=O)c2ccc(-c3cccc(F)c3)nc2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364292 | 88402 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 432 | 5 | 1 | 4 | 4.3 | Cc1cc(N(C)C(=O)c2ccc(-c3cccc(F)c3)nc2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| 23728772 | 88423 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 448 | 6 | 1 | 5 | 4.4 | Cc1cc(N(C)C(=O)c2ccc(Oc3ccc(F)cc3)nc2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364312 | 88423 | 0 | None | - | 1 | Human | 9.6 | pEC50 | = | 9.6 | Functional | ChEMBL | 448 | 6 | 1 | 5 | 4.4 | Cc1cc(N(C)C(=O)c2ccc(Oc3ccc(F)cc3)nc2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| 23728875 | 88428 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 468 | 6 | 1 | 5 | 4.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccc(F)cc4)nc3)cc2Cl)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364317 | 88428 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 468 | 6 | 1 | 5 | 4.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccc(F)cc4)nc3)cc2Cl)CCN1 | 10.6019/CHEMBL2364262 | ||
| 10010118 | 100965 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL297494 | 100965 | 0 | None | - | 1 | Human | 9.5 | pEC50 | = | 9.5 | Functional | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 23728544 | 88395 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 446 | 5 | 1 | 4 | 4.7 | Cc1nc(-c2ccc(F)cc2)ccc1C(=O)N(C)c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364285 | 88395 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 446 | 5 | 1 | 4 | 4.7 | Cc1nc(-c2ccc(F)cc2)ccc1C(=O)N(C)c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 23728806 | 88429 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 448 | 7 | 1 | 5 | 4.5 | CCN(C(=O)c1ccc(Oc2ccc(F)cc2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364318 | 88429 | 0 | None | - | 1 | Human | 9.4 | pEC50 | = | 9.4 | Functional | ChEMBL | 448 | 7 | 1 | 5 | 4.5 | CCN(C(=O)c1ccc(Oc2ccc(F)cc2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 23729106 | 88392 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 432 | 5 | 1 | 4 | 4.3 | Cc1nc(-c2cccc(F)c2)ccc1C(=O)N(C)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364282 | 88392 | 0 | None | - | 1 | Human | 9.2 | pEC50 | = | 9.2 | Functional | ChEMBL | 432 | 5 | 1 | 4 | 4.3 | Cc1nc(-c2cccc(F)c2)ccc1C(=O)N(C)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 23728770 | 88412 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 432 | 6 | 1 | 4 | 4.3 | CCN(C(=O)c1ccc(-c2cccc(F)c2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364302 | 88412 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 432 | 6 | 1 | 4 | 4.3 | CCN(C(=O)c1ccc(-c2cccc(F)c2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 16749783 | 88441 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 450 | 6 | 1 | 7 | 3.2 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4cccc(F)c4)CC3)n2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364330 | 88441 | 0 | None | - | 1 | Human | 9.1 | pEC50 | = | 9.1 | Functional | ChEMBL | 450 | 6 | 1 | 7 | 3.2 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4cccc(F)c4)CC3)n2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 101635584 | 2559 | 26 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2022.128554 | ||||
| 1458 | 2559 | 26 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2022.128554 | ||||
| 16136567 | 2559 | 26 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2022.128554 | ||||
| 3794 | 2559 | 26 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2022.128554 | ||||
| 91898963 | 2559 | 26 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2022.128554 | ||||
| CHEMBL525634 | 2559 | 26 | None | - | 1 | Human | 9.0 | pEC50 | = | 9.0 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmcl.2022.128554 | ||||
| 23728693 | 88407 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 434 | 6 | 1 | 5 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(F)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364297 | 88407 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 434 | 6 | 1 | 5 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(F)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 16040758 | 88437 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 487 | 6 | 2 | 5 | 4.4 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364326 | 88437 | 0 | None | - | 1 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 487 | 6 | 2 | 5 | 4.4 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23729022 | 88391 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364281 | 88391 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728731 | 88411 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 436 | 5 | 1 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)nc3)cc2F)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364301 | 88411 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 436 | 5 | 1 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)nc3)cc2F)CCN1 | 10.6019/CHEMBL2364262 | ||
| 16749753 | 88440 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 464 | 6 | 1 | 7 | 3.6 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4ccc(F)cc4)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364329 | 88440 | 0 | None | - | 1 | Human | 8.9 | pEC50 | = | 8.9 | Functional | ChEMBL | 464 | 6 | 1 | 7 | 3.6 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4ccc(F)cc4)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 23729025 | 88387 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364277 | 88387 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728541 | 88394 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 439 | 5 | 1 | 5 | 4.0 | Cc1nc(-c2cccc(C#N)c2)ccc1C(=O)N(C)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364284 | 88394 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 439 | 5 | 1 | 5 | 4.0 | Cc1nc(-c2cccc(C#N)c2)ccc1C(=O)N(C)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 23728581 | 88398 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 433 | 5 | 1 | 5 | 3.7 | Cc1nc(-c2ccc(F)cc2)ncc1C(=O)N(C)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364288 | 88398 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 433 | 5 | 1 | 5 | 3.7 | Cc1nc(-c2ccc(F)cc2)ncc1C(=O)N(C)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 42623380 | 88426 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 454 | 6 | 2 | 5 | 3.8 | Cc1cc(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)nc2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364315 | 88426 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 454 | 6 | 2 | 5 | 3.8 | Cc1cc(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)nc2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| 42623463 | 88431 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 508 | 6 | 2 | 5 | 4.5 | C[C@H]1CN(Cc2ccc(NS(=O)(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2C(F)(F)F)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364320 | 88431 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 508 | 6 | 2 | 5 | 4.5 | C[C@H]1CN(Cc2ccc(NS(=O)(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2C(F)(F)F)CCN1 | 10.6019/CHEMBL2364262 | ||
| 56959013 | 190805 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 534 | 9 | 2 | 5 | 4.5 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cccc(CC(=O)NC(C)C)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5192530 | 190805 | 0 | None | - | 1 | Human | 8.8 | pEC50 | = | 8.8 | Functional | ChEMBL | 534 | 9 | 2 | 5 | 4.5 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cccc(CC(=O)NC(C)C)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| 89723534 | 189933 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 499 | 7 | 2 | 5 | 4.5 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(Cl)c(CO)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5179573 | 189933 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 499 | 7 | 2 | 5 | 4.5 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(Cl)c(CO)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| 16041119 | 177829 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 519 | 6 | 2 | 5 | 4.9 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)c(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465917 | 177829 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 519 | 6 | 2 | 5 | 4.9 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)c(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 23728546 | 88396 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 432 | 5 | 1 | 4 | 4.3 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364286 | 88396 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 432 | 5 | 1 | 4 | 4.3 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 59262141 | 88409 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 441 | 6 | 1 | 6 | 3.8 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(C#N)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364299 | 88409 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 441 | 6 | 1 | 6 | 3.8 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(C#N)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728915 | 88432 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 449 | 6 | 1 | 6 | 3.8 | Cc1cc(N(C)C(=O)c2ccc(Oc3ccc(F)cc3)nc2)ncc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364321 | 88432 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 449 | 6 | 1 | 6 | 3.8 | Cc1cc(N(C)C(=O)c2ccc(Oc3ccc(F)cc3)nc2)ncc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| 16122912 | 88434 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 463 | 6 | 2 | 7 | 3.7 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Nc4ccc(F)cc4)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364323 | 88434 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 463 | 6 | 2 | 7 | 3.7 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Nc4ccc(F)cc4)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 15984938 | 186205 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| CHEMBL489094 | 186205 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| 46882521 | 5635 | 0 | None | 158 | 2 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 458 | 6 | 2 | 4 | 4.5 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(-c2ccccc2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078207 | 5635 | 0 | None | 158 | 2 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 458 | 6 | 2 | 4 | 4.5 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(-c2ccccc2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 16752689 | 187784 | 0 | None | 5 | 3 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL501315 | 187784 | 0 | None | 5 | 3 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.072 | ||
| 16752689 | 187784 | 0 | None | 5 | 3 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL501315 | 187784 | 0 | None | 5 | 3 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 16040941 | 177713 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 519 | 6 | 2 | 5 | 4.9 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2F)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465094 | 177713 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 519 | 6 | 2 | 5 | 4.9 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2F)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 11993730 | 177832 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 500 | 6 | 1 | 4 | 5.2 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465925 | 177832 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 500 | 6 | 1 | 4 | 5.2 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570412 | 177846 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 505 | 8 | 1 | 5 | 4.0 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)CS(=O)(=O)c3ccccc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465948 | 177846 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 505 | 8 | 1 | 5 | 4.0 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)CS(=O)(=O)c3ccccc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570489 | 182477 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 499 | 6 | 1 | 3 | 5.8 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL479418 | 182477 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 499 | 6 | 1 | 3 | 5.8 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15985000 | 88378 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 474 | 6 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(C(F)(F)F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364268 | 88378 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 474 | 6 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(C(F)(F)F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 44571939 | 180034 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 540 | 10 | 2 | 4 | 5.9 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL475467 | 180034 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 540 | 10 | 2 | 4 | 5.9 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 52946479 | 17049 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 794 | 9 | 7 | 15 | 1.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256547 | 17049 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 794 | 9 | 7 | 15 | 1.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 52946426 | 17057 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 778 | 9 | 6 | 14 | 2.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256558 | 17057 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 778 | 9 | 6 | 14 | 2.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| 54584627 | 61898 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 794 | 9 | 7 | 15 | 1.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778155 | 61898 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 794 | 9 | 7 | 15 | 1.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 42623375 | 88403 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 429 | 6 | 2 | 6 | 2.7 | C[C@H]1CN(Cc2ccc(NS(=O)(=O)c3ccc(N4CCCCC4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364293 | 88403 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 429 | 6 | 2 | 6 | 2.7 | C[C@H]1CN(Cc2ccc(NS(=O)(=O)c3ccc(N4CCCCC4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 44570112 | 176855 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 513 | 7 | 2 | 6 | 4.7 | COc1ccc(NC2CCN(C(=O)c3ncccc3-c3ccc(CN4C[C@H](C)N[C@H](C)C4)cc3)CC2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL463861 | 176855 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 513 | 7 | 2 | 6 | 4.7 | COc1ccc(NC2CCN(C(=O)c3ncccc3-c3ccc(CN4C[C@H](C)N[C@H](C)C4)cc3)CC2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570452 | 189240 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 446 | 7 | 1 | 5 | 4.0 | Cc1cc(CC(=O)N(C)Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)on1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL516551 | 189240 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 446 | 7 | 1 | 5 | 4.0 | Cc1cc(CC(=O)N(C)Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)on1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44571990 | 189104 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 533 | 11 | 1 | 4 | 5.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)Cc2ccccc2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL515434 | 189104 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 533 | 11 | 1 | 4 | 5.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)Cc2ccccc2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmc.2010.08.035 | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmc.2010.08.035 | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmc.2010.08.035 | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmc.2010.08.035 | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmc.2010.08.035 | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 52944056 | 17053 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 748 | 8 | 5 | 13 | 3.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256554 | 17053 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 748 | 8 | 5 | 13 | 3.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| 168288449 | 191100 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 475 | 7 | 1 | 6 | 4.0 | CC[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccnc(C#N)c4)CC3)cc2C)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5196819 | 191100 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 475 | 7 | 1 | 6 | 4.0 | CC[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccnc(C#N)c4)CC3)cc2C)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| 15984937 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1021/jm801332q | ||
| 4035 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1021/jm801332q | ||
| CHEMBL489095 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1021/jm801332q | ||
| DB12567 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1021/jm801332q | ||
| 46882713 | 5654 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 395 | 4 | 1 | 3 | 4.2 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(F)cc2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078345 | 5654 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 395 | 4 | 1 | 3 | 4.2 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(F)cc2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 15984136 | 88373 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364263 | 88373 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 15984135 | 88381 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 442 | 6 | 2 | 4 | 3.4 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)c(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364271 | 88381 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 442 | 6 | 2 | 4 | 3.4 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)c(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 15984138 | 88383 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 432 | 6 | 1 | 5 | 3.0 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364273 | 88383 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 432 | 6 | 1 | 5 | 3.0 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728769 | 88418 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 446 | 6 | 1 | 4 | 4.7 | CC(C)N(C(=O)c1ccc(-c2cccc(F)c2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364308 | 88418 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 446 | 6 | 1 | 4 | 4.7 | CC(C)N(C(=O)c1ccc(-c2cccc(F)c2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 54583621 | 61882 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 760 | 8 | 5 | 13 | 3.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778046 | 61882 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 760 | 8 | 5 | 13 | 3.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 44542067 | 197056 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 865 | 13 | 7 | 16 | 1.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCCO)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL582871 | 197056 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 865 | 13 | 7 | 16 | 1.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCCO)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44542068 | 197057 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 905 | 12 | 6 | 16 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC2CCOCC2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL582872 | 197057 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 905 | 12 | 6 | 16 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC2CCOCC2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 1048 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 12560 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 1456 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL532 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| DB00199 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 1048 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 1048 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm901107f | ||
| 12560 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 12560 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm901107f | ||
| 1456 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 1456 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm901107f | ||
| CHEMBL532 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL532 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm901107f | ||
| DB00199 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| DB00199 | 1555 | 72 | None | -5 | 2 | Rabbit | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm901107f | ||
| 46882672 | 5559 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 357 | 6 | 1 | 3 | 3.7 | CCCCc1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1077736 | 5559 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 357 | 6 | 1 | 3 | 3.7 | CCCCc1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882711 | 5652 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 351 | 3 | 1 | 3 | 3.5 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc2ccccc2c1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078343 | 5652 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 351 | 3 | 1 | 3 | 3.5 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc2ccccc2c1 | 10.1016/j.bmcl.2009.09.027 | ||
| 54583623 | 61884 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 764 | 9 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778049 | 61884 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 764 | 9 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 44542518 | 196485 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 863 | 12 | 6 | 15 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL574848 | 196485 | 0 | None | - | 1 | Rabbit | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 863 | 12 | 6 | 15 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 16041292 | 183029 | 0 | None | 31 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 490 | 6 | 2 | 6 | 3.9 | C[C@H]1CN(Cc2ccc(-n3ccnc3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL480219 | 183029 | 0 | None | 31 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 490 | 6 | 2 | 6 | 3.9 | C[C@H]1CN(Cc2ccc(-n3ccnc3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15984137 | 88382 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4cccc(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364272 | 88382 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4cccc(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 15984184 | 88384 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364274 | 88384 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728771 | 88424 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 462 | 8 | 1 | 5 | 4.0 | COCCN(C(=O)c1ccc(-c2cccc(F)c2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364313 | 88424 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 462 | 8 | 1 | 5 | 4.0 | COCCN(C(=O)c1ccc(-c2cccc(F)c2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 59262173 | 88427 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 478 | 9 | 1 | 6 | 4.1 | COCCN(C(=O)c1ccc(Oc2ccc(F)cc2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364316 | 88427 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 478 | 9 | 1 | 6 | 4.1 | COCCN(C(=O)c1ccc(Oc2ccc(F)cc2)nc1)c1ccc(CN2CCN[C@@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 15984243 | 88443 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 452 | 6 | 2 | 4 | 4.2 | CC(C(=O)N1CCC(Nc2cccc(F)c2)CC1)c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364332 | 88443 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 452 | 6 | 2 | 4 | 4.2 | CC(C(=O)N1CCC(Nc2cccc(F)c2)CC1)c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.6019/CHEMBL2364262 | ||
| 44542965 | 197091 | 0 | None | - | 1 | Rabbit | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 891 | 15 | 6 | 15 | 3.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCCCCCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL583097 | 197091 | 0 | None | - | 1 | Rabbit | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 891 | 15 | 6 | 15 | 3.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCCCCCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44542966 | 196243 | 0 | None | - | 1 | Rabbit | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 911 | 12 | 6 | 15 | 3.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCc2ccc(C(=O)NC)cc2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL572998 | 196243 | 0 | None | - | 1 | Rabbit | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 911 | 12 | 6 | 15 | 3.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCc2ccc(C(=O)NC)cc2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 46882754 | 5644 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 403 | 4 | 1 | 5 | 3.3 | N#Cc1ccc(-c2ccc(S(=O)(=O)Cc3ccc4c(c3)CCNCC4)cn2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078269 | 5644 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 403 | 4 | 1 | 5 | 3.3 | N#Cc1ccc(-c2ccc(S(=O)(=O)Cc3ccc4c(c3)CCNCC4)cn2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882794 | 5671 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 360 | 5 | 1 | 5 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cn1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078461 | 5671 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 360 | 5 | 1 | 5 | 2.5 | CC(C)Oc1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cn1 | 10.1016/j.bmcl.2009.09.027 | ||
| 42623379 | 88425 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 454 | 6 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(NS(=O)(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364314 | 88425 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 454 | 6 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(NS(=O)(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 46882623 | 5774 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 388 | 4 | 2 | 6 | 1.4 | O=S(=O)(Nc1ccc2c(c1)CCNCC2)c1ccc(N2CCOCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079260 | 5774 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 388 | 4 | 2 | 6 | 1.4 | O=S(=O)(Nc1ccc2c(c1)CCNCC2)c1ccc(N2CCOCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 9863611 | 96482 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 358 | 6 | 2 | 3 | 3.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL266018 | 96482 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 358 | 6 | 2 | 3 | 3.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44571376 | 183479 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 510 | 9 | 2 | 3 | 5.8 | O=C(NC1CCCCC1)N(CCc1ccccc1)Cc1ccccc1-c1cccc(CN2CCNCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL482307 | 183479 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 510 | 9 | 2 | 3 | 5.8 | O=C(NC1CCCCC1)N(CCc1ccccc1)Cc1ccccc1-c1cccc(CN2CCNCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 44542519 | 197246 | 0 | None | - | 1 | Rabbit | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 903 | 12 | 6 | 15 | 3.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCC(F)(F)F)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL584553 | 197246 | 0 | None | - | 1 | Rabbit | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 903 | 12 | 6 | 15 | 3.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCC(F)(F)F)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 54583624 | 61887 | 0 | None | - | 1 | Rabbit | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 819 | 11 | 5 | 14 | 3.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778052 | 61887 | 0 | None | - | 1 | Rabbit | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 819 | 11 | 5 | 14 | 3.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 168274082 | 189701 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 459 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3N3CCC(Nc4cccc(F)c4)CC3)cc2)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5175905 | 189701 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 459 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3N3CCC(Nc4cccc(F)c4)CC3)cc2)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| 52941569 | 17055 | 0 | None | - | 1 | Rabbit | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 764 | 9 | 6 | 14 | 2.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256556 | 17055 | 0 | None | - | 1 | Rabbit | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 764 | 9 | 6 | 14 | 2.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| 15984134 | 192668 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| CHEMBL523933 | 192668 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| 46882712 | 5653 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 411 | 4 | 1 | 3 | 4.7 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078344 | 5653 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 411 | 4 | 1 | 3 | 4.7 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(Cl)cc2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882797 | 5674 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 411 | 5 | 2 | 5 | 3.6 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(Nc2ccc(F)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078464 | 5674 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 411 | 5 | 2 | 5 | 3.6 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(Nc2ccc(F)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44570450 | 177165 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 534 | 9 | 2 | 5 | 3.8 | Cc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL464247 | 177165 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 534 | 9 | 2 | 5 | 3.8 | Cc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| 16041481 | 178227 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 508 | 6 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4cccc(C#N)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL469098 | 178227 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 508 | 6 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4cccc(C#N)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 16040587 | 178804 | 0 | None | 14 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL473921 | 178804 | 0 | None | 14 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15984997 | 88376 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364266 | 88376 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 59262241 | 88421 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 495 | 6 | 1 | 4 | 5.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(C(=O)c4ccc(C(F)(F)F)cc4)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364310 | 88421 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 495 | 6 | 1 | 4 | 5.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(C(=O)c4ccc(C(F)(F)F)cc4)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 42623461 | 88433 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 454 | 6 | 2 | 5 | 3.8 | Cc1cc(NS(=O)(=O)c2cncc(-c3ccc(F)cc3)c2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364322 | 88433 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 454 | 6 | 2 | 5 | 3.8 | Cc1cc(NS(=O)(=O)c2cncc(-c3ccc(F)cc3)c2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| 16041291 | 88436 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 555 | 7 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3S(=O)(=O)N3CCC(Nc4ccccc4F)CC3)cc2F)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364325 | 88436 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 555 | 7 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3S(=O)(=O)N3CCC(Nc4ccccc4F)CC3)cc2F)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 54581677 | 61888 | 0 | None | - | 1 | Rabbit | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 833 | 11 | 4 | 14 | 3.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)N(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778053 | 61888 | 0 | None | - | 1 | Rabbit | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 833 | 11 | 4 | 14 | 3.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)N(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL388812 | 210673 | 0 | None | - | 1 | Rat | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | None | None | None | CC(C)c1nc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1016/j.bmc.2006.09.045 | ||||
| 46882302 | 5689 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 426 | 7 | 1 | 3 | 5.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(C2CCCC2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078558 | 5689 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 426 | 7 | 1 | 3 | 5.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(C2CCCC2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882755 | 5645 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 439 | 5 | 2 | 5 | 3.1 | O=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cn1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078270 | 5645 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 439 | 5 | 2 | 5 | 3.1 | O=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cn1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882303 | 5692 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 442 | 8 | 1 | 4 | 4.3 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(CC2CCOC2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078586 | 5692 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 442 | 8 | 1 | 4 | 4.3 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(CC2CCOC2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 89723541 | 189931 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 473 | 6 | 1 | 4 | 4.9 | C[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccc(F)cc4)CC3)cc2Cl)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5179543 | 189931 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 473 | 6 | 1 | 4 | 4.9 | C[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccc(F)cc4)CC3)cc2Cl)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| 56960874 | 190520 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 453 | 6 | 1 | 4 | 4.5 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)cc3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5187928 | 190520 | 0 | None | - | 1 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 453 | 6 | 1 | 4 | 4.5 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)cc3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL223972 | 207702 | 0 | None | 2 | 2 | Rat | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | None | None | None | Cn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 | 10.1016/j.bmc.2006.09.045 | ||||
| 46882458 | 5901 | 0 | None | 31 | 2 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 438 | 8 | 2 | 4 | 4.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1080046 | 5901 | 0 | None | 31 | 2 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 438 | 8 | 2 | 4 | 4.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44570527 | 190385 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 500 | 6 | 2 | 4 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL518618 | 190385 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 500 | 6 | 2 | 4 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15984186 | 88386 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 474 | 6 | 2 | 4 | 4.1 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C(F)(F)F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364276 | 88386 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 474 | 6 | 2 | 4 | 4.1 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C(F)(F)F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23729107 | 88393 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 433 | 6 | 1 | 4 | 4.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(F)c4)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364283 | 88393 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 433 | 6 | 1 | 4 | 4.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(F)c4)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 16749782 | 88439 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 464 | 6 | 1 | 7 | 3.6 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4cccc(F)c4)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364328 | 88439 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 464 | 6 | 1 | 7 | 3.6 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4cccc(F)c4)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 89723498 | 190811 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 492 | 9 | 2 | 5 | 5.0 | CCOCc1cccc(N[C@H]2CC[C@H](C(=O)N(C)c3ccc(CN4CCN[C@@H](C)C4)c(C)c3)CC2)c1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5192584 | 190811 | 0 | None | - | 1 | Human | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | 492 | 9 | 2 | 5 | 5.0 | CCOCc1cccc(N[C@H]2CC[C@H](C(=O)N(C)c3ccc(CN4CCN[C@@H](C)C4)c(C)c3)CC2)c1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL390942 | 210701 | 0 | None | 5 | 2 | Rat | 8.6 | pEC50 | = | 8.6 | Functional | ChEMBL | None | None | None | CCn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 | 10.1016/j.bmc.2006.09.045 | ||||
| CHEMBL389037 | 210676 | 0 | None | 8 | 2 | Rat | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | None | None | None | NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)[C@@H]1CCCC(=O)N1 | 10.1016/j.bmc.2006.09.045 | ||||
| 52942786 | 17041 | 0 | None | - | 1 | Rabbit | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 790 | 9 | 6 | 14 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3(C)CC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256538 | 17041 | 0 | None | - | 1 | Rabbit | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 790 | 9 | 6 | 14 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3(C)CC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 52943975 | 17044 | 0 | None | - | 1 | Rabbit | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 765 | 9 | 7 | 15 | 0.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256542 | 17044 | 0 | None | - | 1 | Rabbit | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 765 | 9 | 7 | 15 | 0.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 54586525 | 61890 | 0 | None | - | 1 | Rabbit | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 765 | 9 | 7 | 15 | 0.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778055 | 61890 | 0 | None | - | 1 | Rabbit | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 765 | 9 | 7 | 15 | 0.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 44542215 | 195456 | 0 | None | - | 1 | Rabbit | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 911 | 12 | 6 | 15 | 3.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCc2cccc(C(=O)NC)c2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL567808 | 195456 | 0 | None | - | 1 | Rabbit | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 911 | 12 | 6 | 15 | 3.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCc2cccc(C(=O)NC)c2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 54582662 | 61885 | 0 | None | - | 1 | Rabbit | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 778 | 9 | 6 | 14 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778050 | 61885 | 0 | None | - | 1 | Rabbit | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 778 | 9 | 6 | 14 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)(C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 168278248 | 190508 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 453 | 6 | 1 | 4 | 4.5 | Cc1cc(CN2CCN[C@@H](C)C2)ccc1N(C)C(=O)[C@H]1CC[C@H](Oc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5187776 | 190508 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 453 | 6 | 1 | 4 | 4.5 | Cc1cc(CN2CCN[C@@H](C)C2)ccc1N(C)C(=O)[C@H]1CC[C@H](Oc2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2022.128554 | ||
| 52942785 | 17039 | 0 | None | - | 1 | Rabbit | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 776 | 9 | 6 | 14 | 2.5 | C=C(C)CN(C)[C@H]1C[C@@H](C)O[C@@H](O[C@@H]2[C@@H](C)[C@H](O[C@@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)[C@@H](O)[C@H](C)C[C@@]2(C)O)[C@@H]1O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256536 | 17039 | 0 | None | - | 1 | Rabbit | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 776 | 9 | 6 | 14 | 2.5 | C=C(C)CN(C)[C@H]1C[C@@H](C)O[C@@H](O[C@@H]2[C@@H](C)[C@H](O[C@@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)[C@@H](O)[C@H](C)C[C@@]2(C)O)[C@@H]1O | 10.1016/j.bmcl.2010.08.030 | ||
| 16088034 | 197088 | 0 | None | - | 1 | Rabbit | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 899 | 12 | 6 | 17 | 2.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)Nc2ccncn2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL583094 | 197088 | 0 | None | - | 1 | Rabbit | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 899 | 12 | 6 | 17 | 2.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)Nc2ccncn2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 15984241 | 178943 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 438 | 7 | 2 | 4 | 3.7 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| CHEMBL474130 | 178943 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 438 | 7 | 2 | 4 | 3.7 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| 46882714 | 5615 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 413 | 4 | 1 | 3 | 4.3 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(F)c(F)c2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1077991 | 5615 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 413 | 4 | 1 | 3 | 4.3 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(F)c(F)c2)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 15984998 | 88377 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4cccc(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364267 | 88377 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 425 | 6 | 1 | 4 | 3.2 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4cccc(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 15984187 | 88380 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 454 | 7 | 2 | 5 | 3.3 | COc1cc(CC(=O)N2CCC(Nc3cccc(F)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364270 | 88380 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 454 | 7 | 2 | 5 | 3.3 | COc1cc(CC(=O)N2CCC(Nc3cccc(F)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.6019/CHEMBL2364262 | ||
| 16749728 | 88435 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 479 | 6 | 2 | 6 | 5.2 | C[C@H]1CN(Cc2ccc(-c3cccnc3N3CCC(Nc4ccc(F)cc4)CC3)s2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364324 | 88435 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 479 | 6 | 2 | 6 | 5.2 | C[C@H]1CN(Cc2ccc(-c3cccnc3N3CCC(Nc4ccc(F)cc4)CC3)s2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 15984319 | 88444 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 466 | 6 | 2 | 4 | 4.4 | C[C@H]1CN(Cc2ccc(C(C)(C)C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364333 | 88444 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 466 | 6 | 2 | 4 | 4.4 | C[C@H]1CN(Cc2ccc(C(C)(C)C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 52948855 | 17050 | 0 | None | - | 1 | Rabbit | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 795 | 10 | 8 | 16 | 0.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(O)CO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256548 | 17050 | 0 | None | - | 1 | Rabbit | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 795 | 10 | 8 | 16 | 0.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(O)CO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 44593551 | 37534 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 549 | 12 | 1 | 5 | 5.4 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)COc2ccccc2)c1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL14581 | 37534 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 549 | 12 | 1 | 5 | 5.4 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)COc2ccccc2)c1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570451 | 189910 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 421 | 8 | 1 | 3 | 4.9 | CC(C)CCC(=O)N(C)Cc1ccccc1-c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL517934 | 189910 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 421 | 8 | 1 | 3 | 4.9 | CC(C)CCC(=O)N(C)Cc1ccccc1-c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44593551 | 37534 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 549 | 12 | 1 | 5 | 5.4 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)COc2ccccc2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL14581 | 37534 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 549 | 12 | 1 | 5 | 5.4 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)COc2ccccc2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 46882350 | 5729 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 454 | 8 | 1 | 4 | 5.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cccs2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078882 | 5729 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 454 | 8 | 1 | 4 | 5.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cccs2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882624 | 5775 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 372 | 6 | 1 | 3 | 3.5 | CCCCc1ccc(S(=O)(=O)N(C)c2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079261 | 5775 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 372 | 6 | 1 | 3 | 3.5 | CCCCc1ccc(S(=O)(=O)N(C)c2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882625 | 5776 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 388 | 4 | 2 | 6 | 1.4 | O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1ccc2c(c1)CCNCC2 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079262 | 5776 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 388 | 4 | 2 | 6 | 1.4 | O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1ccc2c(c1)CCNCC2 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882460 | 6233 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 396 | 6 | 2 | 4 | 3.0 | O=S(=O)(Cc1ccccc1)Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1081859 | 6233 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 396 | 6 | 2 | 4 | 3.0 | O=S(=O)(Cc1ccccc1)Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2 | 10.1016/j.bmcl.2009.09.027 | ||
| 44570013 | 176293 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 526 | 7 | 3 | 6 | 3.7 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(C(N)=O)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL461446 | 176293 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 526 | 7 | 3 | 6 | 3.7 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(C(N)=O)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570608 | 190140 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 493 | 6 | 2 | 5 | 4.1 | C[C@H]1CN(Cc2ccc(N3CCCC3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL518261 | 190140 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 493 | 6 | 2 | 5 | 4.1 | C[C@H]1CN(Cc2ccc(N3CCCC3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 52947632 | 17037 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 8 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256534 | 17037 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 8 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 44542667 | 197242 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 8 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 44542667 | 197242 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 8 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL584549 | 197242 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 8 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL584549 | 197242 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 8 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44542964 | 197090 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 877 | 14 | 6 | 15 | 3.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCCCCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL583096 | 197090 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 877 | 14 | 6 | 15 | 3.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCCCCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44542520 | 197055 | 0 | None | - | 1 | Rabbit | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 875 | 12 | 6 | 15 | 3.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC2CCC2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL582870 | 197055 | 0 | None | - | 1 | Rabbit | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 875 | 12 | 6 | 15 | 3.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC2CCC2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 52942801 | 17056 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 9 | 6 | 14 | 2.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256557 | 17056 | 0 | None | - | 1 | Rabbit | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 764 | 9 | 6 | 14 | 2.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL224525 | 207703 | 0 | None | 13 | 2 | Rat | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | None | None | None | CCCc1nc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1016/j.bmc.2006.09.045 | ||||
| 2139 | 3794 | 51 | None | -57 | 3 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 2316 | 3794 | 51 | None | -57 | 3 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 3836 | 3794 | 51 | None | -57 | 3 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 638678 | 3794 | 51 | None | -57 | 3 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| CHEMBL1472 | 3794 | 51 | None | -57 | 3 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| DB09421 | 3794 | 51 | None | -57 | 3 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 46882395 | 5766 | 0 | None | 1 | 2 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 452 | 8 | 2 | 4 | 4.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2[nH]cnc2C)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079186 | 5766 | 0 | None | 1 | 2 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 452 | 8 | 2 | 4 | 4.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2[nH]cnc2C)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44570411 | 177791 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 473 | 8 | 1 | 4 | 5.3 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)CSc3ccccc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465271 | 177791 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 473 | 8 | 1 | 4 | 5.3 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)CSc3ccccc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15984185 | 88385 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C#N)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364275 | 88385 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C#N)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728695 | 88405 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 441 | 6 | 1 | 6 | 3.8 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(C#N)c4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364295 | 88405 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 441 | 6 | 1 | 6 | 3.8 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4cccc(C#N)c4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728694 | 88408 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 452 | 6 | 1 | 5 | 4.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccc(F)cc4)nc3)c(F)c2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364298 | 88408 | 0 | None | - | 1 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 452 | 6 | 1 | 5 | 4.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccc(F)cc4)nc3)c(F)c2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 16040587 | 178804 | 0 | None | 14 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| CHEMBL473921 | 178804 | 0 | None | 14 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| 15984939 | 186270 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C#N)c4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| CHEMBL489480 | 186270 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C#N)c4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| 46882522 | 5636 | 0 | None | 39 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 440 | 7 | 2 | 5 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078208 | 5636 | 0 | None | 39 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 440 | 7 | 2 | 5 | 3.6 | CC(C)Oc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 16040939 | 190111 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 519 | 6 | 2 | 5 | 4.9 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2F)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL518229 | 190111 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 519 | 6 | 2 | 5 | 4.9 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2F)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 52946425 | 17054 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 760 | 8 | 5 | 13 | 3.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256555 | 17054 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 760 | 8 | 5 | 13 | 3.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| 44541929 | 197054 | 0 | None | - | 1 | Rabbit | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 861 | 12 | 6 | 15 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC2CC2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL582869 | 197054 | 0 | None | - | 1 | Rabbit | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 861 | 12 | 6 | 15 | 2.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC2CC2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 15984242 | 186231 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 452 | 6 | 2 | 4 | 4.2 | CC(C(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.1021/jm801332q | ||
| CHEMBL489297 | 186231 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 452 | 6 | 2 | 4 | 4.2 | CC(C(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.1021/jm801332q | ||
| 15984318 | 186269 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 466 | 6 | 2 | 4 | 4.4 | C[C@H]1CN(Cc2ccc(C(C)(C)C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| CHEMBL489479 | 186269 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 466 | 6 | 2 | 4 | 4.4 | C[C@H]1CN(Cc2ccc(C(C)(C)C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| 46882583 | 5679 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 453 | 5 | 2 | 6 | 2.6 | CN1CCOc2cc(S(=O)(=O)Nc3ccc4c(c3)CCN(Cc3cc[nH]n3)CC4)ccc21 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078491 | 5679 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 453 | 5 | 2 | 6 | 2.6 | CN1CCOc2cc(S(=O)(=O)Nc3ccc4c(c3)CCN(Cc3cc[nH]n3)CC4)ccc21 | 10.1016/j.bmcl.2009.09.027 | ||
| 44570365 | 177594 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 475 | 8 | 1 | 4 | 4.7 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)COc3ccc(F)cc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL464909 | 177594 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 475 | 8 | 1 | 4 | 4.7 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)COc3ccc(F)cc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15984994 | 88374 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364264 | 88374 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 431 | 6 | 2 | 5 | 3.0 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728774 | 88413 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 435 | 6 | 1 | 6 | 3.5 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccc(F)cc4)nc3)nc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364303 | 88413 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 435 | 6 | 1 | 6 | 3.5 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccc(F)cc4)nc3)nc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 52950053 | 17040 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 776 | 9 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256537 | 17040 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 776 | 9 | 6 | 14 | 2.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC3CC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 46882710 | 5651 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 357 | 3 | 1 | 3 | 3.6 | CC(C)(C)c1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078342 | 5651 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 357 | 3 | 1 | 3 | 3.6 | CC(C)(C)c1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882457 | 5874 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 452 | 8 | 1 | 5 | 4.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cncn2C)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079868 | 5874 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 452 | 8 | 1 | 5 | 4.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cncn2C)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44572092 | 179964 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 487 | 14 | 0 | 4 | 5.0 | COCCCN(Cc1ccccc1-c1ccc(CN(C)CCN(C)C)cc1)C(=O)Cc1ccccc1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL475380 | 179964 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 487 | 14 | 0 | 4 | 5.0 | COCCCN(Cc1ccccc1-c1ccc(CN(C)CCN(C)C)cc1)C(=O)Cc1ccccc1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL224655 | 207705 | 0 | None | - | 1 | Rat | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | None | None | None | CC(C)(C)c1nc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1016/j.bmc.2006.09.045 | ||||
| CHEMBL388528 | 210671 | 0 | None | 15 | 2 | Rat | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | None | None | None | C=CCn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 | 10.1016/j.bmc.2006.09.045 | ||||
| 89872388 | 189893 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 467 | 7 | 1 | 4 | 4.9 | CC[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccc(F)cc4)CC3)cc2C)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5179060 | 189893 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 467 | 7 | 1 | 4 | 4.9 | CC[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccc(F)cc4)CC3)cc2C)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| 52941620 | 17042 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 776 | 8 | 6 | 14 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256539 | 17042 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 776 | 8 | 6 | 14 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 54587558 | 61889 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 776 | 8 | 6 | 14 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778054 | 61889 | 0 | None | - | 1 | Rabbit | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 776 | 8 | 6 | 14 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 54580662 | 61886 | 0 | None | - | 1 | Rabbit | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 805 | 11 | 5 | 14 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(N)=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778051 | 61886 | 0 | None | - | 1 | Rabbit | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 805 | 11 | 5 | 14 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(N)=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 52942788 | 17047 | 0 | None | - | 1 | Rabbit | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 780 | 9 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256545 | 17047 | 0 | None | - | 1 | Rabbit | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 780 | 9 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 54584626 | 61897 | 0 | None | - | 1 | Rabbit | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 780 | 9 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778154 | 61897 | 0 | None | - | 1 | Rabbit | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 780 | 9 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 52946408 | 17038 | 0 | None | - | 1 | Rabbit | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 778 | 9 | 6 | 14 | 2.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256535 | 17038 | 0 | None | - | 1 | Rabbit | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 778 | 9 | 6 | 14 | 2.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 52942789 | 17051 | 0 | None | - | 1 | Rabbit | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 767 | 9 | 6 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCF)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256549 | 17051 | 0 | None | - | 1 | Rabbit | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 767 | 9 | 6 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCF)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 15604512 | 179606 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 438 | 6 | 2 | 4 | 3.7 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| CHEMBL474934 | 179606 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 438 | 6 | 2 | 4 | 3.7 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| 46882795 | 5672 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 374 | 6 | 1 | 5 | 2.8 | CC(C)COc1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cn1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078462 | 5672 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 374 | 6 | 1 | 5 | 2.8 | CC(C)COc1ccc(S(=O)(=O)Cc2ccc3c(c2)CCNCC3)cn1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882520 | 5779 | 0 | None | 1 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 430 | 5 | 2 | 4 | 3.8 | Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1Cl | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079311 | 5779 | 0 | None | 1 | 2 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 430 | 5 | 2 | 4 | 3.8 | Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1Cl | 10.1016/j.bmcl.2009.09.027 | ||
| 23729060 | 88388 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 417 | 5 | 1 | 3 | 4.6 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364278 | 88388 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 417 | 5 | 1 | 3 | 4.6 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728733 | 88414 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 445 | 6 | 1 | 5 | 3.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4cccc(C#N)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364304 | 88414 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 445 | 6 | 1 | 5 | 3.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4cccc(C#N)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728840 | 88419 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 1 | 5 | 3.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(C#N)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364309 | 88419 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 425 | 5 | 1 | 5 | 3.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(C#N)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 15984239 | 88442 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 452 | 7 | 2 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364331 | 88442 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 452 | 7 | 2 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 44571375 | 189083 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 539 | 10 | 2 | 3 | 7.0 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CC3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL515275 | 189083 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 539 | 10 | 2 | 3 | 7.0 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CC3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 44593552 | 177733 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 487 | 12 | 1 | 5 | 4.2 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)COc1ccccc1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465104 | 177733 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 487 | 12 | 1 | 5 | 4.2 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)COc1ccccc1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570568 | 183320 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 507 | 6 | 2 | 6 | 4.8 | C[C@H]1CN(Cc2cnc(-c3ccccc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)s2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL481192 | 183320 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 507 | 6 | 2 | 6 | 4.8 | C[C@H]1CN(Cc2cnc(-c3ccccc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)s2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44593552 | 177733 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 487 | 12 | 1 | 5 | 4.2 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)COc1ccccc1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL465104 | 177733 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 487 | 12 | 1 | 5 | 4.2 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)COc1ccccc1 | 10.1016/j.bmcl.2008.10.071 | ||
| 53322109 | 55976 | 0 | None | 1 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm0304865 | ||
| CHEMBL1628277 | 55976 | 0 | None | 1 | 2 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm0304865 | ||
| 89723511 | 189451 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 507 | 8 | 2 | 5 | 4.7 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cccc(CC(C)(C)O)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5171964 | 189451 | 0 | None | - | 1 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 507 | 8 | 2 | 5 | 4.7 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cccc(CC(C)(C)O)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| 56960875 | 190277 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 454 | 6 | 1 | 5 | 3.9 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)cn3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5184722 | 190277 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 454 | 6 | 1 | 5 | 3.9 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)cn3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| 56961016 | 191113 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 479 | 8 | 2 | 5 | 3.9 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cccc(CCO)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5196982 | 191113 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 479 | 8 | 2 | 5 | 3.9 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cccc(CCO)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| 44292287 | 186997 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 546 | 7 | 3 | 10 | -0.0 | NC(=O)[C@@H](Cc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL49464 | 186997 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 546 | 7 | 3 | 10 | -0.0 | NC(=O)[C@@H](Cc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 89723443 | 189923 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 439 | 6 | 1 | 4 | 4.1 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)cc3)CC2)ccc1CN1CCNCC1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5179463 | 189923 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 439 | 6 | 1 | 4 | 4.1 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)cc3)CC2)ccc1CN1CCNCC1 | 10.1016/j.bmcl.2022.128554 | ||
| 52950055 | 17048 | 0 | None | - | 1 | Rabbit | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 780 | 9 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256546 | 17048 | 0 | None | - | 1 | Rabbit | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 780 | 9 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C[C@@H](C)O)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 46882753 | 5643 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 396 | 4 | 1 | 4 | 3.6 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(F)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078268 | 5643 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 396 | 4 | 1 | 4 | 3.6 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(F)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882582 | 5678 | 0 | None | 125 | 2 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 466 | 5 | 2 | 5 | 3.9 | CC1(C)CCc2cc(S(=O)(=O)Nc3ccc4c(c3)CCN(Cc3cc[nH]n3)CC4)ccc2O1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078490 | 5678 | 0 | None | 125 | 2 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 466 | 5 | 2 | 5 | 3.9 | CC1(C)CCc2cc(S(=O)(=O)Nc3ccc4c(c3)CCN(Cc3cc[nH]n3)CC4)ccc2O1 | 10.1016/j.bmcl.2009.09.027 | ||
| 16041121 | 177714 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 531 | 7 | 2 | 6 | 4.8 | COc1cc(-c2cccnc2C(=O)N2CCC(Nc3ccc(F)cc3)CC2)ccc1CN1C[C@H](C)N[C@H](C)C1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465095 | 177714 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 531 | 7 | 2 | 6 | 4.8 | COc1cc(-c2cccnc2C(=O)N2CCC(Nc3ccc(F)cc3)CC2)ccc1CN1C[C@H](C)N[C@H](C)C1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570491 | 182478 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 482 | 6 | 2 | 4 | 5.3 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Nc4ccccc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL479419 | 182478 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 482 | 6 | 2 | 4 | 5.3 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Nc4ccccc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 23729063 | 88389 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 438 | 6 | 1 | 4 | 3.5 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4cccc(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364279 | 88389 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 438 | 6 | 1 | 4 | 3.5 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4cccc(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23729103 | 88390 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccccc4F)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364280 | 88390 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccccc4F)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728578 | 88397 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 433 | 6 | 1 | 4 | 4.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccccc4F)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364287 | 88397 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 433 | 6 | 1 | 4 | 4.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccccc4F)cc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728582 | 88399 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 419 | 5 | 1 | 5 | 3.4 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3cnc(-c4ccc(F)cc4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364289 | 88399 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 419 | 5 | 1 | 5 | 3.4 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3cnc(-c4ccc(F)cc4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 57586303 | 88400 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 458 | 6 | 2 | 4 | 3.9 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2Cl)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364290 | 88400 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 458 | 6 | 2 | 4 | 3.9 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2Cl)CCN1 | 10.6019/CHEMBL2364262 | ||
| 11902 | 1459 | 5 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 465 | 7 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| 56960876 | 1459 | 5 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 465 | 7 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5201797 | 1459 | 5 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 465 | 7 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| 89723482 | 191505 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 479 | 7 | 2 | 5 | 4.2 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cc(CO)ccc3C)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5203126 | 191505 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 479 | 7 | 2 | 5 | 4.2 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3cc(CO)ccc3C)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| 44542816 | 196392 | 0 | None | - | 1 | Rabbit | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 879 | 14 | 6 | 16 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCCOC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL574205 | 196392 | 0 | None | - | 1 | Rabbit | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 879 | 14 | 6 | 16 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCCOC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm801332q | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm801332q | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm801332q | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm801332q | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm801332q | ||
| 15984238 | 188978 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 452 | 7 | 2 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| CHEMBL514475 | 188978 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 452 | 7 | 2 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm801332q | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| 46882393 | 5763 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 511 | 9 | 2 | 5 | 5.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2ccc(NC(C)=O)s2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079170 | 5763 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 511 | 9 | 2 | 5 | 5.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2ccc(NC(C)=O)s2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44571939 | 180034 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 540 | 10 | 2 | 4 | 5.9 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL475467 | 180034 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 540 | 10 | 2 | 4 | 5.9 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 44570409 | 177839 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 459 | 7 | 1 | 3 | 4.9 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)Cc3ccc(F)cc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465940 | 177839 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 459 | 7 | 1 | 3 | 4.9 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)Cc3ccc(F)cc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570492 | 183367 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 516 | 6 | 2 | 4 | 5.9 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Nc4ccc(Cl)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL481575 | 183367 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 516 | 6 | 2 | 4 | 5.9 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Nc4ccc(Cl)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 16752689 | 187784 | 0 | None | 5 | 3 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL501315 | 187784 | 0 | None | 5 | 3 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.072 | ||
| 16041483 | 190327 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccccc4F)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL518540 | 190327 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccccc4F)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 46882671 | 5558 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 387 | 4 | 1 | 6 | 1.6 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(N2CCOCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1077735 | 5558 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 387 | 4 | 1 | 6 | 1.6 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(N2CCOCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882756 | 5688 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 412 | 5 | 1 | 5 | 3.7 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(Oc2ccc(F)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078555 | 5688 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 412 | 5 | 1 | 5 | 3.7 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(Oc2ccc(F)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882349 | 5728 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 505 | 9 | 2 | 4 | 5.4 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cccc(NC(C)=O)c2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078881 | 5728 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 505 | 9 | 2 | 4 | 5.4 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cccc(NC(C)=O)c2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44571989 | 179637 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 478 | 10 | 2 | 4 | 4.6 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)NC1CCCCC1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL474978 | 179637 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 478 | 10 | 2 | 4 | 4.6 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)NC1CCCCC1 | 10.1016/j.bmcl.2008.10.071 | ||
| 44571373 | 179333 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 526 | 9 | 2 | 4 | 5.9 | COc1cccc(CCN(Cc2ccccc2-c2ccc(N3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL474606 | 179333 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 526 | 9 | 2 | 4 | 5.9 | COc1cccc(CCN(Cc2ccccc2-c2ccc(N3CCNCC3)cc2)C(=O)NC2CCCCC2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 44571940 | 180349 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 415 | 9 | 2 | 4 | 4.1 | COc1cccc(CCNCc2ccccc2-c2ccc(CN3CCNCC3)cc2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL475808 | 180349 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 415 | 9 | 2 | 4 | 4.1 | COc1cccc(CCNCc2ccccc2-c2ccc(CN3CCNCC3)cc2)c1 | 10.1016/j.bmcl.2008.10.071 | ||
| 11993730 | 177832 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 500 | 6 | 1 | 4 | 5.2 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL465925 | 177832 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 500 | 6 | 1 | 4 | 5.2 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2022.128554 | ||
| 44542367 | 196419 | 0 | None | - | 1 | Rabbit | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 847 | 11 | 6 | 15 | 2.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL574429 | 196419 | 0 | None | - | 1 | Rabbit | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 847 | 11 | 6 | 15 | 2.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3CCC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44542368 | 197243 | 0 | None | - | 1 | Rabbit | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 821 | 11 | 6 | 15 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(N)=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 44542368 | 197243 | 0 | None | - | 1 | Rabbit | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 821 | 11 | 6 | 15 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(N)=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL584550 | 197243 | 0 | None | - | 1 | Rabbit | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 821 | 11 | 6 | 15 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(N)=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL584550 | 197243 | 0 | None | - | 1 | Rabbit | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 821 | 11 | 6 | 15 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(N)=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 56960873 | 191120 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 439 | 6 | 1 | 4 | 4.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccc(F)cc4)CC3)cc2)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5197045 | 191120 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 439 | 6 | 1 | 4 | 4.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@H](Oc4ccc(F)cc4)CC3)cc2)CCN1 | 10.1016/j.bmcl.2022.128554 | ||
| 11398860 | 175471 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 560 | 8 | 3 | 10 | 0.4 | NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL45905 | 175471 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 560 | 8 | 3 | 10 | 0.4 | NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 52947633 | 17043 | 0 | None | - | 1 | Rabbit | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 777 | 8 | 6 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3COC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256540 | 17043 | 0 | None | - | 1 | Rabbit | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 777 | 8 | 6 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C3COC3)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 45483679 | 196241 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 835 | 11 | 6 | 15 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 45483679 | 196241 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 835 | 11 | 6 | 15 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL572996 | 196241 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 835 | 11 | 6 | 15 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL572996 | 196241 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 835 | 11 | 6 | 15 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 54584601 | 61881 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 748 | 8 | 5 | 13 | 3.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778045 | 61881 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 748 | 8 | 5 | 13 | 3.4 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 45102708 | 5693 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 468 | 6 | 2 | 7 | 2.0 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(N2CCOCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078595 | 5693 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 468 | 6 | 2 | 7 | 2.0 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(N2CCOCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 16040940 | 176876 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL463881 | 176876 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4cccc(F)c4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15984999 | 88379 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 474 | 6 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C(F)(F)F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364269 | 88379 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 474 | 6 | 2 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4cccc(C(F)(F)F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728692 | 88406 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 436 | 5 | 1 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)nc3)c(F)c2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364296 | 88406 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 436 | 5 | 1 | 4 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)nc3)c(F)c2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 16749781 | 88438 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 464 | 6 | 1 | 7 | 3.6 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4ccccc4F)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364327 | 88438 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 464 | 6 | 1 | 7 | 3.6 | C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4ccccc4F)CC3)n2)C[C@@H](C)N1 | 10.6019/CHEMBL2364262 | ||
| 54582661 | 61883 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 749 | 9 | 6 | 14 | 2.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1778047 | 61883 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 749 | 9 | 6 | 14 | 2.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 15984240 | 178942 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 438 | 7 | 2 | 4 | 3.7 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| CHEMBL474129 | 178942 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 438 | 7 | 2 | 4 | 3.7 | C[C@H]1CN(Cc2ccc(CCC(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)CCN1 | 10.1021/jm801332q | ||
| 46882796 | 5673 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 2.7 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(N2CCCCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078463 | 5673 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 385 | 4 | 1 | 5 | 2.7 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(N2CCCCC2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882396 | 5767 | 0 | None | -3 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 452 | 8 | 2 | 4 | 4.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cnc(C)[nH]2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079187 | 5767 | 0 | None | -3 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 452 | 8 | 2 | 4 | 4.5 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cnc(C)[nH]2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44570528 | 183024 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 513 | 6 | 1 | 4 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(C(=O)c4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL480210 | 183024 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 513 | 6 | 1 | 4 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(C(=O)c4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570490 | 190053 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 501 | 6 | 1 | 4 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Oc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL518142 | 190053 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 501 | 6 | 1 | 4 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)N3CCC(Oc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 23728734 | 88415 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 445 | 6 | 1 | 5 | 3.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364305 | 88415 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 445 | 6 | 1 | 5 | 3.2 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4ccc(C#N)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/j.bmcl.2008.10.072 | ||
| 44569919 | 178226 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 508 | 6 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(C#N)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL469097 | 178226 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 508 | 6 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(C#N)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44572029 | 178826 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 511 | 11 | 1 | 5 | 4.1 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL474008 | 178826 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 511 | 11 | 1 | 5 | 4.1 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)S(=O)(=O)c1ccc(F)cc1 | 10.1016/j.bmcl.2008.10.071 | ||
| 44571991 | 180363 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 395 | 9 | 1 | 4 | 3.1 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(C)=O | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL475823 | 180363 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 395 | 9 | 1 | 4 | 3.1 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(C)=O | 10.1016/j.bmcl.2008.10.071 | ||
| 44542369 | 197244 | 0 | None | - | 1 | Rabbit | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 849 | 11 | 5 | 15 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)N(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| 44542369 | 197244 | 0 | None | - | 1 | Rabbit | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 849 | 11 | 5 | 15 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)N(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL584551 | 197244 | 0 | None | - | 1 | Rabbit | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 849 | 11 | 5 | 15 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)N(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL584551 | 197244 | 0 | None | - | 1 | Rabbit | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 849 | 11 | 5 | 15 | 2.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)N(C)C)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44541928 | 197245 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 849 | 12 | 6 | 15 | 2.5 | CCNC(=O)CO[C@H]1[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@H](C)[C@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@H]1C | 10.1021/jm901107f | ||
| CHEMBL584552 | 197245 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 849 | 12 | 6 | 15 | 2.5 | CCNC(=O)CO[C@H]1[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@H](C)[C@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@H]1C | 10.1021/jm901107f | ||
| 44542069 | 196242 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 899 | 12 | 6 | 17 | 2.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)Nc2cnccn2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL572997 | 196242 | 0 | None | - | 1 | Rabbit | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 899 | 12 | 6 | 17 | 2.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)Nc2cnccn2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 53322109 | 55976 | 0 | None | -1 | 2 | Rabbit | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1628277 | 55976 | 0 | None | -1 | 2 | Rabbit | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2010.08.030 | ||
| 53322109 | 55976 | 0 | None | -1 | 2 | Rabbit | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2011.04.078 | ||
| 53322109 | 55976 | 0 | None | -1 | 2 | Rabbit | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm901107f | ||
| CHEMBL1628277 | 55976 | 0 | None | -1 | 2 | Rabbit | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1016/j.bmcl.2011.04.078 | ||
| CHEMBL1628277 | 55976 | 0 | None | -1 | 2 | Rabbit | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm901107f | ||
| 44292517 | 101061 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@@H](CCc1ccccc1)NC(=O)[C@@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL298224 | 101061 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@@H](CCc1ccccc1)NC(=O)[C@@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 89723612 | 190694 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 483 | 7 | 2 | 5 | 4.0 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)c(CO)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL5190786 | 190694 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 483 | 7 | 2 | 5 | 4.0 | Cc1cc(N(C)C(=O)[C@H]2CC[C@H](Oc3ccc(F)c(CO)c3)CC2)ccc1CN1CCN[C@@H](C)C1 | 10.1016/j.bmcl.2022.128554 | ||
| 46882752 | 5642 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 412 | 4 | 1 | 4 | 4.1 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(Cl)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078267 | 5642 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 412 | 4 | 1 | 4 | 4.1 | O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(Cl)cc2)nc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 45102707 | 5680 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 465 | 6 | 2 | 6 | 3.9 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(-c2ccccn2)s1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078492 | 5680 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 465 | 6 | 2 | 6 | 3.9 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(-c2ccccn2)s1 | 10.1016/j.bmcl.2009.09.027 | ||
| 46882394 | 5765 | 0 | None | -1 | 2 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 438 | 8 | 2 | 4 | 4.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cnc[nH]2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1079185 | 5765 | 0 | None | -1 | 2 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 438 | 8 | 2 | 4 | 4.2 | CCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cnc[nH]2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44570453 | 177799 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 455 | 8 | 1 | 3 | 5.2 | CCN(CCc1ccccc1)C(=O)c1ccccc1-c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465289 | 177799 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 455 | 8 | 1 | 3 | 5.2 | CCN(CCc1ccccc1)C(=O)c1ccccc1-c1ccc(CN2C[C@H](C)N[C@H](C)C2)cc1 | 10.1016/j.bmcl.2008.10.072 | ||
| 15984995 | 88375 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 442 | 6 | 2 | 4 | 3.4 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)c(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364265 | 88375 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 442 | 6 | 2 | 4 | 3.4 | C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(Nc4ccc(F)c(F)c4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728626 | 88401 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 434 | 6 | 1 | 5 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccccc4F)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364291 | 88401 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 434 | 6 | 1 | 5 | 4.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(Oc4ccccc4F)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728691 | 88404 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 425 | 5 | 1 | 5 | 3.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(C#N)c4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364294 | 88404 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 425 | 5 | 1 | 5 | 3.7 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(C#N)c4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728730 | 88410 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 438 | 6 | 1 | 4 | 3.5 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364300 | 88410 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 438 | 6 | 1 | 4 | 3.5 | C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4ccc(F)cc4)CC3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728871 | 88416 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364306 | 88416 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728838 | 88417 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364307 | 88417 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 418 | 5 | 1 | 4 | 4.0 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4ccc(F)cc4)cn3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 23728841 | 88422 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 430 | 6 | 1 | 5 | 3.8 | COc1cccc(-c2ccc(C(=O)N(C)c3ccc(CN4CCN[C@@H](C)C4)cc3)nc2)c1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364311 | 88422 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 430 | 6 | 1 | 5 | 3.8 | COc1cccc(-c2ccc(C(=O)N(C)c3ccc(CN4CCN[C@@H](C)C4)cc3)nc2)c1 | 10.6019/CHEMBL2364262 | ||
| 52946409 | 17046 | 0 | None | - | 1 | Rabbit | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 780 | 10 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256544 | 17046 | 0 | None | - | 1 | Rabbit | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 780 | 10 | 7 | 15 | 1.3 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCCO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 52945184 | 17052 | 0 | None | - | 1 | Rabbit | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 765 | 9 | 7 | 15 | 0.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCN)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256550 | 17052 | 0 | None | - | 1 | Rabbit | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 765 | 9 | 7 | 15 | 0.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCN)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 52950054 | 17045 | 0 | None | - | 1 | Rabbit | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 780 | 10 | 6 | 15 | 1.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCOC)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| CHEMBL1256543 | 17045 | 0 | None | - | 1 | Rabbit | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 780 | 10 | 6 | 15 | 1.6 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCOC)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/j.bmcl.2010.08.030 | ||
| 44542817 | 197058 | 0 | None | - | 1 | Rabbit | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 911 | 13 | 6 | 15 | 3.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCc2ccccc2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL582873 | 197058 | 0 | None | - | 1 | Rabbit | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 911 | 13 | 6 | 15 | 3.7 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NCc2ccccc2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44570364 | 177785 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 457 | 8 | 1 | 4 | 4.6 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)COc3ccccc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465244 | 177785 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 457 | 8 | 1 | 4 | 4.6 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)COc3ccccc3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 44570410 | 177840 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 475 | 7 | 1 | 3 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)Cc3cccc(Cl)c3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL465941 | 177840 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 475 | 7 | 1 | 3 | 5.4 | C[C@H]1CN(Cc2ccc(-c3ccccc3CN(C)C(=O)Cc3cccc(Cl)c3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 23728916 | 88430 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 425 | 5 | 1 | 5 | 3.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(N4CCC(F)CC4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| CHEMBL2364319 | 88430 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 425 | 5 | 1 | 5 | 3.1 | C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(N4CCC(F)CC4)nc3)cc2)CCN1 | 10.6019/CHEMBL2364262 | ||
| 46882519 | 5631 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 416 | 5 | 2 | 4 | 3.5 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1078104 | 5631 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 416 | 5 | 2 | 4 | 3.5 | O=S(=O)(Nc1ccc2c(c1)CCN(Cc1cc[nH]n1)CC2)c1ccc(Cl)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44572030 | 178836 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 471 | 11 | 1 | 4 | 4.4 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)Cc1ccccc1 | 10.1016/j.bmcl.2008.10.071 | ||
| CHEMBL474018 | 178836 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 471 | 11 | 1 | 4 | 4.4 | COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)Cc1ccccc1 | 10.1016/j.bmcl.2008.10.071 | ||
| 44569920 | 188824 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 508 | 6 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccccc4C#N)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| CHEMBL513183 | 188824 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 508 | 6 | 2 | 6 | 4.5 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccccc4C#N)CC3)cc2)C[C@@H](C)N1 | 10.1016/j.bmcl.2008.10.072 | ||
| 46882461 | 6235 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 407 | 5 | 2 | 5 | 2.7 | N#Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| CHEMBL1081860 | 6235 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 407 | 5 | 2 | 5 | 2.7 | N#Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCN(Cc2cc[nH]n2)CC3)cc1 | 10.1016/j.bmcl.2009.09.027 | ||
| 44542214 | 197089 | 0 | None | - | 1 | Rabbit | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 863 | 13 | 6 | 15 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCCCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL583095 | 197089 | 0 | None | - | 1 | Rabbit | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 863 | 13 | 6 | 15 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCCCC(=O)NC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 44542666 | 197092 | 0 | None | - | 1 | Rabbit | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 819 | 11 | 5 | 14 | 3.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm901107f | ||
| CHEMBL583098 | 197092 | 0 | None | - | 1 | Rabbit | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 819 | 11 | 5 | 14 | 3.0 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NC)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm901107f | ||
| 44542815 | 196567 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 851 | 12 | 6 | 16 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NOC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| CHEMBL575518 | 196567 | 0 | None | - | 1 | Rabbit | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 851 | 12 | 6 | 16 | 2.1 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)NOC)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1021/jm901107f | ||
| 15984937 | 773 | 27 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1016/j.bmcl.2022.128554 | ||
| 4035 | 773 | 27 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1016/j.bmcl.2022.128554 | ||
| CHEMBL489095 | 773 | 27 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1016/j.bmcl.2022.128554 | ||
| DB12567 | 773 | 27 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 10.1016/j.bmcl.2022.128554 | ||
| 23656869 | 147323 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 631 | 5 | 4 | 6 | 3.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN2CCCC2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL393315 | 147323 | 0 | None | - | 1 | Human | 8.7 | pIC50 | = | 8.7 | Functional | ChEMBL | 631 | 5 | 4 | 6 | 3.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN2CCCC2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 23557214 | 140552 | 0 | None | 6 | 2 | Rabbit | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 721 | 11 | 0 | 4 | 8.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL382613 | 140552 | 0 | None | 6 | 2 | Rabbit | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 721 | 11 | 0 | 4 | 8.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 23557214 | 140552 | 0 | None | -6 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 721 | 11 | 0 | 4 | 8.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL382613 | 140552 | 0 | None | -6 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 721 | 11 | 0 | 4 | 8.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 11341873 | 140972 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 552 | 6 | 4 | 6 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(OC)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL384501 | 140972 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 552 | 6 | 4 | 6 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(OC)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 23557218 | 139026 | 0 | None | 38 | 2 | Rabbit | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL379665 | 139026 | 0 | None | 38 | 2 | Rabbit | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 12016400 | 168394 | 0 | None | -11 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@H]1CCC[C@@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL438962 | 168394 | 0 | None | -11 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@H]1CCC[C@@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412878 | 140551 | 0 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 707 | 11 | 0 | 4 | 8.6 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL382612 | 140551 | 0 | None | -5 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Functional | ChEMBL | 707 | 11 | 0 | 4 | 8.6 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412861 | 77521 | 0 | None | - | 1 | Rabbit | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 673 | 11 | 0 | 4 | 7.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL209333 | 77521 | 0 | None | - | 1 | Rabbit | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 673 | 11 | 0 | 4 | 7.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44432977 | 151148 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 619 | 5 | 7 | 6 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL396413 | 151148 | 0 | None | - | 1 | Human | 7.6 | pIC50 | = | 7.6 | Functional | ChEMBL | 619 | 5 | 7 | 6 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432975 | 87312 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 591 | 5 | 5 | 6 | 2.2 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL233711 | 87312 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Functional | ChEMBL | 591 | 5 | 5 | 6 | 2.2 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432974 | 87136 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 557 | 5 | 5 | 6 | 1.8 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL233560 | 87136 | 0 | None | - | 1 | Human | 7.5 | pIC50 | = | 7.5 | Functional | ChEMBL | 557 | 5 | 5 | 6 | 1.8 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 9895192 | 77502 | 0 | None | -38 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CCC[C@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL209301 | 77502 | 0 | None | -38 | 2 | Human | 6.5 | pIC50 | = | 6.5 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CCC[C@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412878 | 140551 | 0 | None | 5 | 2 | Rabbit | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 707 | 11 | 0 | 4 | 8.6 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL382612 | 140551 | 0 | None | 5 | 2 | Rabbit | 7.4 | pIC50 | = | 7.4 | Functional | ChEMBL | 707 | 11 | 0 | 4 | 8.6 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412894 | 138381 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 718 | 12 | 0 | 6 | 7.8 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL378317 | 138381 | 0 | None | -1 | 2 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 718 | 12 | 0 | 6 | 7.8 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 25114977 | 146476 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 594 | 5 | 4 | 7 | 2.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cn2cccn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL392657 | 146476 | 0 | None | - | 1 | Human | 7.3 | pIC50 | = | 7.3 | Functional | ChEMBL | 594 | 5 | 4 | 7 | 2.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cn2cccn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 12016400 | 168394 | 0 | None | 11 | 2 | Rabbit | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@H]1CCC[C@@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL438962 | 168394 | 0 | None | 11 | 2 | Rabbit | 6.2 | pIC50 | = | 6.2 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@H]1CCC[C@@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412894 | 138381 | 0 | None | 1 | 2 | Rabbit | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 718 | 12 | 0 | 6 | 7.8 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL378317 | 138381 | 0 | None | 1 | 2 | Rabbit | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 718 | 12 | 0 | 6 | 7.8 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 11994554 | 80160 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL214935 | 80160 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 11994554 | 80160 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL214935 | 80160 | 0 | None | - | 1 | Human | 7.1 | pIC50 | = | 7.1 | Functional | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 9895192 | 77502 | 0 | None | 38 | 2 | Rabbit | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CCC[C@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL209301 | 77502 | 0 | None | 38 | 2 | Rabbit | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CCC[C@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44432973 | 97860 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 577 | 4 | 5 | 6 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL274876 | 97860 | 0 | None | - | 1 | Human | 8.1 | pIC50 | = | 8.1 | Functional | ChEMBL | 577 | 4 | 5 | 6 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432976 | 154325 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 571 | 5 | 4 | 6 | 2.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN(C)C)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL400635 | 154325 | 0 | None | - | 1 | Human | 7.0 | pIC50 | = | 7.0 | Functional | ChEMBL | 571 | 5 | 4 | 6 | 2.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN(C)C)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 23557218 | 139026 | 0 | None | -38 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL379665 | 139026 | 0 | None | -38 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL496391 | 212312 | 0 | None | - | 1 | Rabbit | 7.9 | pKd | = | 7.9 | Functional | ChEMBL | None | None | None | CC(C)[C@@H](C(=O)N[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||||
| CHEMBL496389 | 212310 | 0 | None | - | 1 | Rabbit | 6.9 | pKd | = | 6.9 | Functional | ChEMBL | None | None | None | CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||||
| CHEMBL497004 | 212313 | 0 | None | - | 1 | Rabbit | 7.8 | pKd | = | 7.8 | Functional | ChEMBL | None | None | None | CC(C)(C)c1cc(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccccc2)c2ccccc2)C(N)=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||||
| 44583348 | 187257 | 0 | None | - | 1 | Rabbit | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 510 | 10 | 3 | 5 | 2.6 | CC(C)[C@@H](C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL496190 | 187257 | 0 | None | - | 1 | Rabbit | 8.6 | pKd | = | 8.6 | Functional | ChEMBL | 510 | 10 | 3 | 5 | 2.6 | CC(C)[C@@H](C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| 9956253 | 187258 | 0 | None | - | 1 | Rabbit | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 467 | 9 | 3 | 4 | 3.8 | CC(C)[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(C(C)(C)C)c1)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL496191 | 187258 | 0 | None | - | 1 | Rabbit | 8.4 | pKd | = | 8.4 | Functional | ChEMBL | 467 | 9 | 3 | 4 | 3.8 | CC(C)[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(C(C)(C)C)c1)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| 44583286 | 192847 | 0 | None | - | 1 | Rabbit | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 564 | 6 | 5 | 6 | 2.8 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCCC(=O)CCNC2=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL526496 | 192847 | 0 | None | - | 1 | Rabbit | 7.4 | pKd | = | 7.4 | Functional | ChEMBL | 564 | 6 | 5 | 6 | 2.8 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCCC(=O)CCNC2=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL496390 | 212311 | 0 | None | - | 1 | Rabbit | 7.3 | pKd | = | 7.3 | Functional | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||||
| 44583347 | 187237 | 0 | None | - | 1 | Rabbit | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 496 | 10 | 4 | 5 | 2.3 | CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL495994 | 187237 | 0 | None | - | 1 | Rabbit | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | 496 | 10 | 4 | 5 | 2.3 | CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL502792 | 212387 | 0 | None | - | 1 | Rabbit | 7.2 | pKd | = | 7.2 | Functional | ChEMBL | None | None | None | CC(C)(C)c1cc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)Cc2ccccc2)C(N)=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||||
| 1466 | 1798 | 0 | None | - | 1 | Rabbit | 7.4 | pA2 | = | 7.4 | Functional | Guide to Pharmacology | None | None | None | None | 10081621 | ||||
| 1466 | 1798 | 0 | None | - | 1 | Rabbit | 7.4 | pA2 | = | 7.4 | Functional | Guide to Pharmacology | None | None | None | None | 7752063 | ||||
| 9850904 | 1798 | 0 | None | - | 1 | Rabbit | 7.4 | pA2 | = | 7.4 | Functional | Guide to Pharmacology | None | None | None | None | 10081621 | ||||
| 9850904 | 1798 | 0 | None | - | 1 | Rabbit | 7.4 | pA2 | = | 7.4 | Functional | Guide to Pharmacology | None | None | None | None | 7752063 | ||||
| CHEMBL3143516 | 1798 | 0 | None | - | 1 | Rabbit | 7.4 | pA2 | = | 7.4 | Functional | Guide to Pharmacology | None | None | None | None | 10081621 | ||||
| CHEMBL3143516 | 1798 | 0 | None | - | 1 | Rabbit | 7.4 | pA2 | = | 7.4 | Functional | Guide to Pharmacology | None | None | None | None | 7752063 | ||||
| 4036 | 2419 | 0 | None | - | 1 | Human | 9.2 | pA2 | = | 9.2 | Functional | Guide to Pharmacology | 592 | 12 | 4 | 5 | 3.7 | CCNC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@H](Cc1ccc(cc1)F)NC)C)C(C)C)Cc1ccc(c(c1)C(C)(C)C)O.Cl | 18164286 | ||
| 73755070 | 2419 | 0 | None | - | 1 | Human | 9.2 | pA2 | = | 9.2 | Functional | Guide to Pharmacology | 592 | 12 | 4 | 5 | 3.7 | CCNC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@H](Cc1ccc(cc1)F)NC)C)C(C)C)Cc1ccc(c(c1)C(C)(C)C)O.Cl | 18164286 | ||
| 138107041 | 555 | 63 | None | 60 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | None | ||
| 276 | 555 | 63 | None | 60 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | None | ||
| 447043 | 555 | 63 | None | 60 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | None | ||
| 6510 | 555 | 63 | None | 60 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | None | ||
| CHEMBL529 | 555 | 63 | None | 60 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | None | ||
| DB00207 | 555 | 63 | None | 60 | 3 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | None | ||
| 138107041 | 555 | 63 | None | 60 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | 23190027 | ||
| 276 | 555 | 63 | None | 60 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | 23190027 | ||
| 447043 | 555 | 63 | None | 60 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | 23190027 | ||
| 6510 | 555 | 63 | None | 60 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | 23190027 | ||
| CHEMBL529 | 555 | 63 | None | 60 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | 23190027 | ||
| DB00207 | 555 | 63 | None | 60 | 3 | Human | 5.5 | pEC50 | = | 5.5 | Functional | Guide to Pharmacology | 749 | 7 | 5 | 14 | 1.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@H]([C@]1(C)O)O)C)C)C)(C)O | 23190027 | ||
| 177964 | 2508 | 2 | None | -3 | 2 | Rabbit | 7.7 | pEC50 | = | 7.7 | Functional | Guide to Pharmacology | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 17183187 | ||
| 3511 | 2508 | 2 | None | -3 | 2 | Rabbit | 7.7 | pEC50 | = | 7.7 | Functional | Guide to Pharmacology | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 17183187 | ||
| CHEMBL1778156 | 2508 | 2 | None | -3 | 2 | Rabbit | 7.7 | pEC50 | = | 7.7 | Functional | Guide to Pharmacology | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 17183187 | ||
| 15984937 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 19374732 | ||
| 15984937 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 25341626 | ||
| 4035 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 19374732 | ||
| 4035 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 25341626 | ||
| CHEMBL489095 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 19374732 | ||
| CHEMBL489095 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 25341626 | ||
| DB12567 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 19374732 | ||
| DB12567 | 773 | 27 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | Guide to Pharmacology | 424 | 6 | 2 | 4 | 3.3 | C[C@@H]1NCCN(C1)Cc1ccc(cc1)CC(=O)N1CCC(CC1)Nc1cccc(c1)F | 25341626 | ||
| 11902 | 1459 | 5 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Guide to Pharmacology | 465 | 7 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2)CCN1 | 35051575 | ||
| 56960876 | 1459 | 5 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Guide to Pharmacology | 465 | 7 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2)CCN1 | 35051575 | ||
| CHEMBL5201797 | 1459 | 5 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Guide to Pharmacology | 465 | 7 | 2 | 5 | 3.9 | C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2)CCN1 | 35051575 | ||
| 139592915 | 3322 | 31 | None | 16 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | None | ||
| 1465 | 3322 | 31 | None | 16 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | None | ||
| 2410 | 3322 | 31 | None | 16 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | None | ||
| 6915744 | 3322 | 31 | None | 16 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | None | ||
| CHEMBL1214185 | 3322 | 31 | None | 16 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | None | ||
| DB00778 | 3322 | 31 | None | 16 | 2 | Human | 8.2 | pIC50 | = | 8.2 | Functional | Drug Central | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | None | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10381885 | ||
| 1048 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 15764739 | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10381885 | ||
| 12560 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 15764739 | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10381885 | ||
| 1456 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 15764739 | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10381885 | ||
| CHEMBL532 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 15764739 | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10381885 | ||
| DB00199 | 1555 | 72 | None | 5 | 2 | Human | 6.0 | pIC50 | = | 6 | Functional | Guide to Pharmacology | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 15764739 | ||
| 1444 | 338 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 697 | 8 | 2 | 11 | 5.2 | CCN([C@H]1C[C@@H](C)O[C@H]([C@@H]1O)O[C@@H]1[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)C[C@](C2)(C)OC)[C@@H](C)C(=O)O[C@@H]([C@@H]([C@@H]([C@H](C2=C(C[C@@]1(C)O2)C)C)O)C)CC)C | 15764739 | ||
| 9918079 | 338 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 697 | 8 | 2 | 11 | 5.2 | CCN([C@H]1C[C@@H](C)O[C@H]([C@@H]1O)O[C@@H]1[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)C[C@](C2)(C)OC)[C@@H](C)C(=O)O[C@@H]([C@@H]([C@@H]([C@H](C2=C(C[C@@]1(C)O2)C)C)O)C)CC)C | 15764739 | ||
| CHEMBL300049 | 338 | 0 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Functional | Guide to Pharmacology | 697 | 8 | 2 | 11 | 5.2 | CCN([C@H]1C[C@@H](C)O[C@H]([C@@H]1O)O[C@@H]1[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)C[C@](C2)(C)OC)[C@@H](C)C(=O)O[C@@H]([C@@H]([C@@H]([C@H](C2=C(C[C@@]1(C)O2)C)C)O)C)CC)C | 15764739 | ||
| 1466 | 1798 | 0 | None | - | 1 | Rabbit | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | None | None | None | None | 11806718 | ||||
| 9850904 | 1798 | 0 | None | - | 1 | Rabbit | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | None | None | None | None | 11806718 | ||||
| CHEMBL3143516 | 1798 | 0 | None | - | 1 | Rabbit | 8.0 | pIC50 | = | 8 | Functional | Guide to Pharmacology | None | None | None | None | 11806718 | ||||
| 177964 | 2508 | 2 | None | -3 | 2 | Rabbit | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 10081621 | ||
| 3511 | 2508 | 2 | None | -3 | 2 | Rabbit | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 10081621 | ||
| CHEMBL1778156 | 2508 | 2 | None | -3 | 2 | Rabbit | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 10081621 | ||
| 1447 | 2443 | 0 | None | - | 1 | Human | 4.7 | pIC50 | None | 4.7 | Functional | Guide to Pharmacology | 747 | 8 | 5 | 14 | 2.2 | CCN(C1CC(C)OC(C1O)OC1C(C)C(OC2OC(C)C(C(C2)(C)OC)O)C(C)C(=O)OC(CC)C(C(C(C(=O)C(CC1(C)O)C)C)O)(C)O)C | 15764739 | ||
| 14487390 | 2443 | 0 | None | - | 1 | Human | 4.7 | pIC50 | None | 4.7 | Functional | Guide to Pharmacology | 747 | 8 | 5 | 14 | 2.2 | CCN(C1CC(C)OC(C1O)OC1C(C)C(OC2OC(C)C(C(C2)(C)OC)O)C(C)C(=O)OC(CC)C(C(C(C(=O)C(CC1(C)O)C)C)O)(C)O)C | 15764739 | ||
| 139592915 | 3322 | 31 | None | 16 | 2 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | 10381885 | ||
| 1465 | 3322 | 31 | None | 16 | 2 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | 10381885 | ||
| 2410 | 3322 | 31 | None | 16 | 2 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | 10381885 | ||
| 6915744 | 3322 | 31 | None | 16 | 2 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | 10381885 | ||
| CHEMBL1214185 | 3322 | 31 | None | 16 | 2 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | 10381885 | ||
| DB00778 | 3322 | 31 | None | 16 | 2 | Human | 6.2 | pIC50 | None | 6.2 | Functional | Guide to Pharmacology | 837 | 13 | 5 | 17 | 2.2 | COCCOCO/N=C/1\[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H]1C)O)(C)O)CC)C | 10381885 | ||
| 1448 | 2444 | 29 | None | -2 | 2 | Human | 6.3 | pIC50 | None | 6.3 | Functional | Guide to Pharmacology | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| 83954 | 2444 | 29 | None | -2 | 2 | Human | 6.3 | pIC50 | None | 6.3 | Functional | Guide to Pharmacology | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| CHEMBL300004 | 2444 | 29 | None | -2 | 2 | Human | 6.3 | pIC50 | None | 6.3 | Functional | Guide to Pharmacology | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| 10032648 | 2445 | 0 | None | - | 1 | Human | 6.5 | pIC50 | None | 6.5 | Functional | Guide to Pharmacology | 699 | 7 | 3 | 12 | 3.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H]([C@H]([C@@H]1C)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| 1449 | 2445 | 0 | None | - | 1 | Human | 6.5 | pIC50 | None | 6.5 | Functional | Guide to Pharmacology | 699 | 7 | 3 | 12 | 3.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H]([C@H]([C@@H]1C)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| 1445 | 1521 | 0 | None | - | 1 | Human | 6.6 | pIC50 | None | 6.6 | Functional | Guide to Pharmacology | 729 | 8 | 4 | 13 | 3.3 | CCN([C@H]1C[C@@H](C)O[C@H]([C@@H]1O)O[C@@H]1[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@@H](C)C(=O)O[C@@H]([C@@]([C@@H]([C@H](C2=C(C[C@]1(C)O2)C)C)O)(C)O)CC)C | 15764739 | ||
| 184178 | 1521 | 0 | None | - | 1 | Human | 6.6 | pIC50 | None | 6.6 | Functional | Guide to Pharmacology | 729 | 8 | 4 | 13 | 3.3 | CCN([C@H]1C[C@@H](C)O[C@H]([C@@H]1O)O[C@@H]1[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@@H](C)C(=O)O[C@@H]([C@@]([C@@H]([C@H](C2=C(C[C@]1(C)O2)C)C)O)(C)O)CC)C | 15764739 | ||
| 1460 | 2561 | 0 | None | - | 1 | Human | 6.8 | pIC50 | None | 6.8 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 155817408 | 2561 | 0 | None | - | 1 | Human | 6.8 | pIC50 | None | 6.8 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 10259168 | 2168 | 0 | None | - | 1 | Human | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | 699 | 7 | 3 | 12 | 3.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)C[C@](C2)(C)OC)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| 1446 | 2168 | 0 | None | - | 1 | Human | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | 699 | 7 | 3 | 12 | 3.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)C[C@](C2)(C)OC)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| CHEMBL51522 | 2168 | 0 | None | - | 1 | Human | 7.2 | pIC50 | None | 7.2 | Functional | Guide to Pharmacology | 699 | 7 | 3 | 12 | 3.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)C[C@](C2)(C)OC)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 15764739 | ||
| 1464 | 2565 | 0 | None | - | 1 | Human | 7.5 | pIC50 | None | 7.5 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 155817411 | 2565 | 0 | None | - | 1 | Human | 7.5 | pIC50 | None | 7.5 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1454 | 3056 | 0 | None | - | 1 | Human | 8.9 | pIC50 | None | 8.9 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 101650014 | 2267 | 0 | None | - | 1 | Human | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1453 | 2267 | 0 | None | - | 1 | Human | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 16198245 | 2267 | 0 | None | - | 1 | Human | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 91898971 | 2267 | 0 | None | - | 1 | Human | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 101930759 | 2562 | 0 | None | - | 1 | Human | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1461 | 2562 | 0 | None | - | 1 | Human | 9.0 | pIC50 | None | 9 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1457 | 2560 | 0 | None | - | 1 | Human | 9.3 | pIC50 | None | 9.3 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 155817406 | 2560 | 0 | None | - | 1 | Human | 9.3 | pIC50 | None | 9.3 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 16139289 | 2560 | 0 | None | - | 1 | Human | 9.3 | pIC50 | None | 9.3 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 71311666 | 2560 | 0 | None | - | 1 | Human | 9.3 | pIC50 | None | 9.3 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1462 | 2563 | 0 | None | - | 1 | Human | 9.5 | pIC50 | None | 9.5 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 155817409 | 2563 | 0 | None | - | 1 | Human | 9.5 | pIC50 | None | 9.5 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1463 | 2564 | 0 | None | - | 1 | Human | 9.5 | pIC50 | None | 9.5 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 155817410 | 2564 | 0 | None | - | 1 | Human | 9.5 | pIC50 | None | 9.5 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1455 | 2787 | 0 | None | - | 1 | Human | 9.5 | pIC50 | None | 9.5 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1459 | 2558 | 0 | None | - | 1 | Human | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 155817407 | 2558 | 0 | None | - | 1 | Human | 9.7 | pIC50 | None | 9.7 | Functional | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| Ligands | Receptor | Assay information | Chemical information | ||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID | #Vendors | Reference ligand |
Fold selectivity (Affinity) |
# tested GPCRs (Affinity) |
Species | p-value (-log) |
Type | Activity Relation |
Activity Value |
Assay Type | Assay Description | Source | Mol weight |
Rot Bonds |
H don | H acc | LogP | Smiles | DOI |
| 16752689 | 187784 | 0 | None | - | 0 | Human | 8.0 | pEC50 | = | 8 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1021/jm301653f | ||
| CHEMBL501315 | 187784 | 0 | None | - | 0 | Human | 8.0 | pEC50 | = | 8 | Binding | ChEMBL | 568 | 10 | 2 | 4 | 6.6 | COc1cccc(CCN(Cc2ccccc2-c2ccc(CN3C[C@H](C)N[C@H](C)C3)cc2)C(=O)NC2CCCCC2)c1 | 10.1021/jm301653f | ||
| CHEMBL382080 | 210547 | 0 | None | - | 0 | Rat | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | None | None | None | NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c(C2CCCCC2)n1)NC(=O)[C@@H]1CCC(=O)N1 | 10.1021/jm0505462 | ||||
| CHEMBL382714 | 210564 | 0 | None | - | 0 | Rat | 5.9 | pEC50 | = | 5.9 | Binding | ChEMBL | None | None | None | CC(C)(C)c1nc(C[C@H](NC(=O)[C@@H]2CCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1021/jm0505462 | ||||
| CHEMBL381666 | 210544 | 0 | None | - | 0 | Rat | 5.8 | pEC50 | = | 5.8 | Binding | ChEMBL | None | None | None | CC(C)c1nc(C[C@H](NC(=O)[C@@H]2CCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1021/jm0505462 | ||||
| CHEMBL197149 | 207361 | 0 | None | - | 1 | Rat | 7.6 | pEC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CCCc1nc(C[C@H](NC(=O)[C@@H]2CCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1021/jm0505462 | ||||
| 2139 | 3794 | 51 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| 2316 | 3794 | 51 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| 3836 | 3794 | 51 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| 638678 | 3794 | 51 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| CHEMBL1472 | 3794 | 51 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| DB09421 | 3794 | 51 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| CHEMBL198263 | 207362 | 0 | None | - | 0 | Rat | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | None | None | None | NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c(C2CC2)n1)NC(=O)[C@@H]1CCC(=O)N1 | 10.1021/jm0505462 | ||||
| CHEMBL496391 | 212312 | 0 | None | - | 1 | Rabbit | 9.0 | pIC50 | = | 9.0 | Binding | ChEMBL | None | None | None | CC(C)[C@@H](C(=O)N[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||||
| 11018075 | 99922 | 0 | None | - | 0 | Rabbit | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 739 | 9 | 1 | 12 | 5.6 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL289955 | 99922 | 0 | None | - | 0 | Rabbit | 8.8 | pIC50 | = | 8.8 | Binding | ChEMBL | 739 | 9 | 1 | 12 | 5.6 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44290233 | 172257 | 0 | None | - | 0 | Rabbit | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 723 | 9 | 0 | 11 | 6.6 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2CC(N(C)C(C)C)CC(C)O2)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL45141 | 172257 | 0 | None | - | 0 | Rabbit | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 723 | 9 | 0 | 11 | 6.6 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2CC(N(C)C(C)C)CC(C)O2)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 9956253 | 187258 | 0 | None | - | 1 | Rabbit | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 467 | 9 | 3 | 4 | 3.8 | CC(C)[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(C(C)(C)C)c1)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL496191 | 187258 | 0 | None | - | 1 | Rabbit | 8.7 | pIC50 | = | 8.7 | Binding | ChEMBL | 467 | 9 | 3 | 4 | 3.8 | CC(C)[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(C(C)(C)C)c1)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| 9895192 | 77502 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CCC[C@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL209301 | 77502 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CCC[C@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412981 | 137812 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 704 | 11 | 2 | 5 | 7.3 | O=C(Nc1ccccc1)N(CC1=C[C@@](Cc2cccc(Cl)c2)(NC(=O)C(Cl)(Cl)Cl)CC1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL377137 | 137812 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 704 | 11 | 2 | 5 | 7.3 | O=C(Nc1ccccc1)N(CC1=C[C@@](Cc2cccc(Cl)c2)(NC(=O)C(Cl)(Cl)Cl)CC1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 1466 | 1798 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010332u | ||||
| 9850904 | 1798 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010332u | ||||
| CHEMBL3143516 | 1798 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm010332u | ||||
| 10122749 | 77909 | 0 | None | - | 0 | Rabbit | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 691 | 13 | 1 | 7 | 7.2 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)c2cccc([N+](=O)[O-])c2)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL210899 | 77909 | 0 | None | - | 0 | Rabbit | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 691 | 13 | 1 | 7 | 7.2 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)c2cccc([N+](=O)[O-])c2)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44583286 | 192847 | 0 | None | - | 1 | Rabbit | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 564 | 6 | 5 | 6 | 2.8 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCCC(=O)CCNC2=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL526496 | 192847 | 0 | None | - | 1 | Rabbit | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 564 | 6 | 5 | 6 | 2.8 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCCC(=O)CCNC2=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL497004 | 212313 | 0 | None | - | 1 | Rabbit | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | None | None | None | CC(C)(C)c1cc(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccccc2)c2ccccc2)C(N)=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||||
| 44412894 | 138381 | 0 | None | - | 0 | Rabbit | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 718 | 12 | 0 | 6 | 7.8 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL378317 | 138381 | 0 | None | - | 0 | Rabbit | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 718 | 12 | 0 | 6 | 7.8 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44380651 | 119627 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 757 | 9 | 3 | 13 | 4.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL351216 | 119627 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 757 | 9 | 3 | 13 | 4.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| 44276703 | 98827 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL281952 | 98827 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/0960-894X(95)00122-A | ||
| 44276703 | 98827 | 0 | None | - | 0 | Rabbit | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL281952 | 98827 | 0 | None | - | 0 | Rabbit | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/S0960-894X(01)80359-0 | ||
| 44276703 | 98827 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL281952 | 98827 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/0960-894X(95)00122-A | ||
| 44276703 | 98827 | 0 | None | - | 0 | Rabbit | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL281952 | 98827 | 0 | None | - | 0 | Rabbit | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 715 | 7 | 3 | 13 | 3.0 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)C3(O2)O[C@]1(C)[C@H](O)[C@H]3C | 10.1016/S0960-894X(01)80359-0 | ||
| 11767227 | 106209 | 0 | None | - | 0 | Rabbit | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 607 | 6 | 6 | 6 | 2.7 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL3143521 | 106209 | 0 | None | - | 0 | Rabbit | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 607 | 6 | 6 | 6 | 2.7 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| 10940742 | 114916 | 0 | None | - | 0 | Rabbit | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 565 | 6 | 6 | 6 | 1.6 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL3350348 | 114916 | 0 | None | - | 0 | Rabbit | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 565 | 6 | 6 | 6 | 1.6 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL524083 | 213824 | 0 | None | - | 0 | Rabbit | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | None | None | None | C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||||
| 24878741 | 187356 | 1 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 522 | 8 | 4 | 7 | 6.1 | Cc1c(O)c(C(=O)CCc2ccccc2)c(O)c(C(CC(C)C)C2=C(O)C(C)(C)C(=O)C(C)(C)C2=O)c1O | 10.1021/np0706567 | ||
| CHEMBL496930 | 187356 | 1 | None | - | 0 | Rat | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 522 | 8 | 4 | 7 | 6.1 | Cc1c(O)c(C(=O)CCc2ccccc2)c(O)c(C(CC(C)C)C2=C(O)C(C)(C)C(=O)C(C)(C)C2=O)c1O | 10.1021/np0706567 | ||
| 44290232 | 100914 | 0 | None | - | 0 | Rabbit | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 711 | 8 | 1 | 12 | 4.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL297168 | 100914 | 0 | None | - | 0 | Rabbit | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 711 | 8 | 1 | 12 | 4.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 11018075 | 99922 | 0 | None | - | 0 | Rabbit | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 739 | 9 | 1 | 12 | 5.6 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL289955 | 99922 | 0 | None | - | 0 | Rabbit | 8.6 | pIC50 | = | 8.6 | Binding | ChEMBL | 739 | 9 | 1 | 12 | 5.6 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 9809991 | 138992 | 0 | None | - | 0 | Rabbit | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 670 | 11 | 2 | 5 | 6.6 | O=C(Nc1ccccc1)N(CC1=C[C@@](Cc2ccccc2)(NC(=O)C(Cl)(Cl)Cl)CC1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL379519 | 138992 | 0 | None | - | 0 | Rabbit | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 670 | 11 | 2 | 5 | 6.6 | O=C(Nc1ccccc1)N(CC1=C[C@@](Cc2ccccc2)(NC(=O)C(Cl)(Cl)Cl)CC1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 10211030 | 77392 | 0 | None | - | 0 | Rabbit | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 610 | 11 | 1 | 4 | 7.8 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)Nc2ccccc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL209024 | 77392 | 0 | None | - | 0 | Rabbit | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 610 | 11 | 1 | 4 | 7.8 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)Nc2ccccc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44374025 | 51901 | 0 | None | - | 0 | Rabbit | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 565 | 6 | 6 | 6 | 1.6 | CC(C)(C)c1cc(CC2NC(=O)[C@@H](NC(=O)C(N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL158821 | 51901 | 0 | None | - | 0 | Rabbit | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 565 | 6 | 6 | 6 | 1.6 | CC(C)(C)c1cc(CC2NC(=O)[C@@H](NC(=O)C(N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)ccc1O | 10.1021/jm010332u | ||
| 1448 | 2444 | 29 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/0960-894X(95)00122-A | ||
| 83954 | 2444 | 29 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL300004 | 2444 | 29 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/0960-894X(95)00122-A | ||
| 1448 | 2444 | 29 | None | - | 0 | Rabbit | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/S0960-894X(01)80359-0 | ||
| 83954 | 2444 | 29 | None | - | 0 | Rabbit | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL300004 | 2444 | 29 | None | - | 0 | Rabbit | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/S0960-894X(01)80359-0 | ||
| 2139 | 3794 | 51 | None | 1 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np070658r | ||||
| 2316 | 3794 | 51 | None | 1 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np070658r | ||||
| 3836 | 3794 | 51 | None | 1 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np070658r | ||||
| 638678 | 3794 | 51 | None | 1 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np070658r | ||||
| CHEMBL1472 | 3794 | 51 | None | 1 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np070658r | ||||
| DB09421 | 3794 | 51 | None | 1 | 4 | Rat | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np070658r | ||||
| 2139 | 3794 | 51 | None | 1 | 4 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np0706567 | ||||
| 2316 | 3794 | 51 | None | 1 | 4 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np0706567 | ||||
| 3836 | 3794 | 51 | None | 1 | 4 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np0706567 | ||||
| 638678 | 3794 | 51 | None | 1 | 4 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np0706567 | ||||
| CHEMBL1472 | 3794 | 51 | None | 1 | 4 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np0706567 | ||||
| DB09421 | 3794 | 51 | None | 1 | 4 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | None | None | None | None | 10.1021/np0706567 | ||||
| 24878685 | 171604 | 1 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 570 | 9 | 4 | 7 | 6.7 | Cc1c(O)c(C(=O)CCc2ccccc2)c(O)c(C(CCc2ccccc2)C2=C(O)C(C)(C)C(=O)C(C)(C)C2=O)c1O | 10.1021/np0706567 | ||
| CHEMBL447346 | 171604 | 1 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 570 | 9 | 4 | 7 | 6.7 | Cc1c(O)c(C(=O)CCc2ccccc2)c(O)c(C(CCc2ccccc2)C2=C(O)C(C)(C)C(=O)C(C)(C)C2=O)c1O | 10.1021/np0706567 | ||
| 24878743 | 188781 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 360 | 3 | 1 | 4 | 4.2 | CC(=O)OC[C@]12CCC[C@](C)(CO)[C@@H]1CC[C@@]1(C)c3cocc3CC[C@H]21 | 10.1021/np070658r | ||
| CHEMBL512825 | 188781 | 0 | None | - | 0 | Rat | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 360 | 3 | 1 | 4 | 4.2 | CC(=O)OC[C@]12CCC[C@](C)(CO)[C@@H]1CC[C@@]1(C)c3cocc3CC[C@H]21 | 10.1021/np070658r | ||
| 44583347 | 187237 | 0 | None | - | 1 | Rabbit | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 496 | 10 | 4 | 5 | 2.3 | CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL495994 | 187237 | 0 | None | - | 1 | Rabbit | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 496 | 10 | 4 | 5 | 2.3 | CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||
| 11081770 | 89029 | 0 | None | - | 0 | Rabbit | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 509 | 6 | 6 | 6 | 0.3 | N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)CCNC(=O)[C@H](Cc2ccc(O)cc2)NC1=O | 10.1021/jm010332u | ||
| CHEMBL2371260 | 89029 | 0 | None | - | 0 | Rabbit | 4.6 | pIC50 | = | 4.6 | Binding | ChEMBL | 509 | 6 | 6 | 6 | 0.3 | N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)CCNC(=O)[C@H](Cc2ccc(O)cc2)NC1=O | 10.1021/jm010332u | ||
| CHEMBL496390 | 212311 | 0 | None | - | 1 | Rabbit | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | None | None | None | CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||||
| 23557218 | 139026 | 0 | None | - | 0 | Rabbit | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL379665 | 139026 | 0 | None | - | 0 | Rabbit | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44380970 | 119894 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 8 | 4 | 13 | 3.0 | CCC1OC(=O)C(C)C(OC2C[C@@](C)(OC)[C@@H](O)C(C)O2)C[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL353526 | 119894 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 8 | 4 | 13 | 3.0 | CCC1OC(=O)C(C)C(OC2C[C@@](C)(OC)[C@@H](O)C(C)O2)C[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/0960-894X(95)00122-A | ||
| 44276737 | 96929 | 0 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL26966 | 96929 | 0 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| 44276737 | 96929 | 0 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL26966 | 96929 | 0 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80583-7 | ||
| 1448 | 2444 | 29 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/0960-894X(95)00122-A | ||
| 83954 | 2444 | 29 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL300004 | 2444 | 29 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/0960-894X(95)00122-A | ||
| 1448 | 2444 | 29 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/S0960-894X(01)80359-0 | ||
| 83954 | 2444 | 29 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL300004 | 2444 | 29 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 715 | 7 | 4 | 13 | 2.9 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@@]2(OC(=C(C)C2)[C@@H]([C@H]([C@]1(C)O)O)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C)C | 10.1016/S0960-894X(01)80359-0 | ||
| 44290012 | 167598 | 0 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 725 | 9 | 1 | 12 | 5.2 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL43313 | 167598 | 0 | None | - | 0 | Rabbit | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 725 | 9 | 1 | 12 | 5.2 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44276779 | 96423 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL265495 | 96423 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| 44290012 | 167598 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 725 | 9 | 1 | 12 | 5.2 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL43313 | 167598 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 725 | 9 | 1 | 12 | 5.2 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44276779 | 96423 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL265495 | 96423 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44290232 | 100914 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 711 | 8 | 1 | 12 | 4.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL297168 | 100914 | 0 | None | - | 0 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 711 | 8 | 1 | 12 | 4.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)CC(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 177964 | 2508 | 2 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 10.1021/jm301653f | ||
| 3511 | 2508 | 2 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 10.1021/jm301653f | ||
| CHEMBL1778156 | 2508 | 2 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C | 10.1021/jm301653f | ||
| 16040587 | 178804 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm301653f | ||
| CHEMBL473921 | 178804 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 501 | 6 | 2 | 5 | 4.8 | C[C@H]1CN(Cc2ccc(-c3cccnc3C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)C[C@@H](C)N1 | 10.1021/jm301653f | ||
| 44380970 | 119894 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 715 | 8 | 4 | 13 | 3.0 | CCC1OC(=O)C(C)C(OC2C[C@@](C)(OC)[C@@H](O)C(C)O2)C[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL353526 | 119894 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 715 | 8 | 4 | 13 | 3.0 | CCC1OC(=O)C(C)C(OC2C[C@@](C)(OC)[C@@H](O)C(C)O2)C[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/0960-894X(95)00122-A | ||
| 44276737 | 96929 | 0 | None | - | 0 | Rabbit | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL26966 | 96929 | 0 | None | - | 0 | Rabbit | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| 44276737 | 96929 | 0 | None | - | 0 | Rabbit | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL26966 | 96929 | 0 | None | - | 0 | Rabbit | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 729 | 8 | 4 | 13 | 3.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80583-7 | ||
| 10897050 | 106205 | 0 | None | - | 0 | Rabbit | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 565 | 6 | 6 | 6 | 1.6 | CC(C)(C)c1cc(C[C@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL3143517 | 106205 | 0 | None | - | 0 | Rabbit | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 565 | 6 | 6 | 6 | 1.6 | CC(C)(C)c1cc(C[C@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)ccc1O | 10.1021/jm010332u | ||
| 11146277 | 106206 | 0 | None | - | 0 | Rabbit | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 579 | 6 | 6 | 6 | 2.0 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL3143518 | 106206 | 0 | None | - | 0 | Rabbit | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 579 | 6 | 6 | 6 | 2.0 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL2371264 | 208282 | 0 | None | - | 0 | Rabbit | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | None | None | None | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CNC2=O)ccc1O | 10.1021/jm010332u | ||||
| 44413071 | 77911 | 0 | None | - | 0 | Rabbit | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 731 | 12 | 1 | 7 | 7.3 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL210906 | 77911 | 0 | None | - | 0 | Rabbit | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 731 | 12 | 1 | 7 | 7.3 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2cccc([N+](=O)[O-])c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44380971 | 57271 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 729 | 8 | 3 | 13 | 3.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL166642 | 57271 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 729 | 8 | 3 | 13 | 3.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| 44583348 | 187257 | 0 | None | - | 1 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 510 | 10 | 3 | 5 | 2.6 | CC(C)[C@@H](C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| CHEMBL496190 | 187257 | 0 | None | - | 1 | Rabbit | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 510 | 10 | 3 | 5 | 2.6 | CC(C)[C@@H](C(=O)N(C)[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O)N(C)C(=O)[C@@H](N)Cc1ccccc1 | 10.1016/j.bmcl.2009.05.059 | ||
| 44380610 | 95979 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 743 | 9 | 3 | 13 | 3.9 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL262052 | 95979 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 743 | 9 | 3 | 13 | 3.9 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| 11081770 | 89029 | 0 | None | - | 0 | Rabbit | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 509 | 6 | 6 | 6 | 0.3 | N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)CCNC(=O)[C@H](Cc2ccc(O)cc2)NC1=O | 10.1021/jm010332u | ||
| CHEMBL2371260 | 89029 | 0 | None | - | 0 | Rabbit | 4.4 | pIC50 | = | 4.4 | Binding | ChEMBL | 509 | 6 | 6 | 6 | 0.3 | N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)CCNC(=O)[C@H](Cc2ccc(O)cc2)NC1=O | 10.1021/jm010332u | ||
| 1048 | 1555 | 72 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| 12560 | 1555 | 72 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| 1456 | 1555 | 72 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL532 | 1555 | 72 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| DB00199 | 1555 | 72 | None | - | 1 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| 10897911 | 155736 | 0 | None | - | 0 | Rabbit | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL406517 | 155736 | 0 | None | - | 0 | Rabbit | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL496389 | 212310 | 0 | None | - | 1 | Rabbit | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | None | None | None | CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)=O | 10.1016/j.bmcl.2009.05.059 | ||||
| 11135894 | 106210 | 0 | None | - | 0 | Rabbit | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 621 | 6 | 6 | 6 | 2.9 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)cc(C(C)(C)C)c1O | 10.1021/jm010332u | ||
| CHEMBL3143523 | 106210 | 0 | None | - | 0 | Rabbit | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 621 | 6 | 6 | 6 | 2.9 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)cc(C(C)(C)C)c1O | 10.1021/jm010332u | ||
| 10995344 | 106207 | 0 | None | - | 0 | Rabbit | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 565 | 9 | 5 | 6 | 1.8 | CCC(C)Oc1ccc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)cc1 | 10.1021/jm010332u | ||
| CHEMBL3143519 | 106207 | 0 | None | - | 0 | Rabbit | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 565 | 9 | 5 | 6 | 1.8 | CCC(C)Oc1ccc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)cc1 | 10.1021/jm010332u | ||
| 44412861 | 77521 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 673 | 11 | 0 | 4 | 7.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL209333 | 77521 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 673 | 11 | 0 | 4 | 7.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412878 | 140551 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 707 | 11 | 0 | 4 | 8.6 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL382612 | 140551 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 707 | 11 | 0 | 4 | 8.6 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 11146277 | 106206 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 579 | 6 | 6 | 6 | 2.0 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL3143518 | 106206 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 579 | 6 | 6 | 6 | 2.0 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL502792 | 212387 | 0 | None | - | 1 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)(C)c1cc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)Cc2ccccc2)C(N)=O)ccc1O | 10.1016/j.bmcl.2009.05.059 | ||||
| 44276778 | 97754 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL27424 | 97754 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| 44276778 | 97754 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL27424 | 97754 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44276779 | 96423 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL265495 | 96423 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| 44276779 | 96423 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL265495 | 96423 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 741 | 9 | 2 | 13 | 4.1 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44380651 | 119627 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 757 | 9 | 3 | 13 | 4.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL351216 | 119627 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 757 | 9 | 3 | 13 | 4.3 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| 23557214 | 140552 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 721 | 11 | 0 | 4 | 8.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL382613 | 140552 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 721 | 11 | 0 | 4 | 8.9 | O=C(c1ccc(F)cc1)N(CC1CCCC(N(Cc2cccc(Cl)c2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCCCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 11767227 | 106209 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 607 | 6 | 6 | 6 | 2.7 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| CHEMBL3143521 | 106209 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 607 | 6 | 6 | 6 | 2.7 | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCCCCNC2=O)ccc1O | 10.1021/jm010332u | ||
| 44412941 | 139800 | 0 | None | - | 0 | Rabbit | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 710 | 13 | 1 | 6 | 8.0 | COc1cccc(C(=O)N(Cc2cccc(Cl)c2)C2CCCC(CN(C(=O)Nc3ccccc3)c3cccc(OCCN4CCOCC4)c3)C2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL380678 | 139800 | 0 | None | - | 0 | Rabbit | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 710 | 13 | 1 | 6 | 8.0 | COc1cccc(C(=O)N(Cc2cccc(Cl)c2)C2CCCC(CN(C(=O)Nc3ccccc3)c3cccc(OCCN4CCOCC4)c3)C2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44413072 | 77913 | 0 | None | - | 0 | Rabbit | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 636 | 12 | 1 | 6 | 6.9 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)c2ccco2)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL210923 | 77913 | 0 | None | - | 0 | Rabbit | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 636 | 12 | 1 | 6 | 6.9 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)c2ccco2)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL2371264 | 208282 | 0 | None | - | 0 | Rabbit | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | None | None | None | CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CNC2=O)ccc1O | 10.1021/jm010332u | ||||
| 44380971 | 57271 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 729 | 8 | 3 | 13 | 3.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL166642 | 57271 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 729 | 8 | 3 | 13 | 3.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| 44276778 | 97754 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL27424 | 97754 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| 44276778 | 97754 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL27424 | 97754 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 755 | 9 | 2 | 13 | 4.5 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 1048 | 1555 | 72 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| 12560 | 1555 | 72 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| 1456 | 1555 | 72 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL532 | 1555 | 72 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| DB00199 | 1555 | 72 | None | - | 1 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1016/0960-894X(95)00122-A | ||
| 10897911 | 155736 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL406517 | 155736 | 0 | None | - | 0 | Rabbit | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O | 10.1016/S0960-894X(01)80359-0 | ||
| 24878742 | 178190 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 360 | 3 | 1 | 4 | 4.2 | CC(=O)OC[C@@]1(C)CCC[C@@]2(CO)[C@H]1CC[C@@]1(C)c3cocc3CC[C@H]21 | 10.1021/np070658r | ||
| CHEMBL468803 | 178190 | 0 | None | - | 0 | Rat | 4.2 | pIC50 | = | 4.2 | Binding | ChEMBL | 360 | 3 | 1 | 4 | 4.2 | CC(=O)OC[C@@]1(C)CCC[C@@]2(CO)[C@H]1CC[C@@]1(C)c3cocc3CC[C@H]21 | 10.1021/np070658r | ||
| 12016400 | 168394 | 0 | None | - | 0 | Rabbit | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@H]1CCC[C@@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL438962 | 168394 | 0 | None | - | 0 | Rabbit | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 613 | 11 | 0 | 4 | 7.6 | CC(C)(C)C(=O)N(Cc1ccccc1)[C@H]1CCC[C@@H](CN(C(=O)c2ccc(F)cc2)c2cccc(OCCN3CCCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44412951 | 77807 | 0 | None | - | 0 | Rabbit | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 674 | 14 | 1 | 5 | 7.7 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)CCc2ccccc2)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL210447 | 77807 | 0 | None | - | 0 | Rabbit | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 674 | 14 | 1 | 5 | 7.7 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)CCc2ccccc2)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| 10875453 | 106208 | 0 | None | - | 0 | Rabbit | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 565 | 7 | 5 | 6 | 1.8 | CC(C)(C)Oc1ccc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)cc1 | 10.1021/jm010332u | ||
| CHEMBL3143520 | 106208 | 0 | None | - | 0 | Rabbit | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 565 | 7 | 5 | 6 | 1.8 | CC(C)(C)Oc1ccc(C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)CCCCNC(=O)CCNC2=O)cc1 | 10.1021/jm010332u | ||
| 44412982 | 58751 | 0 | None | - | 0 | Rabbit | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 644 | 11 | 1 | 5 | 7.2 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)Nc2ccc(F)cc2)c2cccc(OCCN3CCOCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL169509 | 58751 | 0 | None | - | 0 | Rabbit | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 644 | 11 | 1 | 5 | 7.2 | CC(C)(C)C(=O)N(Cc1ccccc1)C1CCCC(CN(C(=O)Nc2ccc(F)cc2)c2cccc(OCCN3CCOCC3)c2)C1 | 10.1016/j.bmcl.2006.04.017 | ||
| 44380610 | 95979 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 743 | 9 | 3 | 13 | 3.9 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| CHEMBL262052 | 95979 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 743 | 9 | 3 | 13 | 3.9 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)CC)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)OC | 10.1016/0960-894X(95)00122-A | ||
| 44276817 | 97750 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL27419 | 97750 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| 44276817 | 97750 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL27419 | 97750 | 0 | None | - | 0 | Rabbit | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44276817 | 97750 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| CHEMBL27419 | 97750 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80359-0 | ||
| 44276817 | 97750 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| CHEMBL27419 | 97750 | 0 | None | - | 0 | Rabbit | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 727 | 8 | 2 | 13 | 3.8 | CCC1OC(=O)C(C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(N(C)C)[C@H]2O)[C@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC | 10.1016/S0960-894X(01)80583-7 | ||
| 44412977 | 79404 | 0 | None | - | 0 | Rabbit | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 686 | 11 | 1 | 5 | 7.4 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL212044 | 79404 | 0 | None | - | 0 | Rabbit | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 686 | 11 | 1 | 5 | 7.4 | O=C(Nc1ccccc1)N(CC1CCCC(N(Cc2ccccc2)C(=O)C(Cl)(Cl)Cl)C1)c1cccc(OCCN2CCOCC2)c1 | 10.1016/j.bmcl.2006.04.017 | ||
| CHEMBL2372767 | 208540 | 0 | None | - | 1 | Human | 9.4 | pKi | = | 9.4 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](CCSC)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](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O | 10.1021/jm0606600 | ||||
| 10010118 | 100965 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL297494 | 100965 | 0 | None | - | 1 | Human | 9.2 | pKi | = | 9.2 | Binding | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 10010118 | 100965 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL297494 | 100965 | 0 | None | - | 1 | Human | 9.0 | pKi | = | 9 | Binding | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 2139 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 2316 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 3836 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 638678 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| CHEMBL1472 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| DB09421 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1016/j.bmc.2006.09.045 | ||||
| 2139 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| 2316 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| 3836 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| 638678 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| CHEMBL1472 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| DB09421 | 3794 | 51 | None | 1 | 4 | Rat | 8.0 | pKi | = | 8 | Binding | ChEMBL | None | None | None | None | 10.1021/jm0505462 | ||||
| 25115428 | 160216 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 610 | 5 | 6 | 7 | 1.0 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN/C(N)=N/C#N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL411408 | 160216 | 0 | None | - | 1 | Human | 7.0 | pKi | = | 7 | Binding | ChEMBL | 610 | 5 | 6 | 7 | 1.0 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN/C(N)=N/C#N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11444593 | 172157 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 578 | 5 | 4 | 6 | 4.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2csc3ccccc23)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL450634 | 172157 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 578 | 5 | 4 | 6 | 4.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2csc3ccccc23)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 44432981 | 87545 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 595 | 5 | 4 | 7 | 2.8 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cc2cscn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL234191 | 87545 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 595 | 5 | 4 | 7 | 2.8 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cc2cscn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11995356 | 80141 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 488 | 5 | 5 | 5 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCCCCCCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL214869 | 80141 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 488 | 5 | 5 | 5 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCCCCCCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL223972 | 207702 | 0 | None | -3 | 2 | Rat | 7.9 | pKi | = | 7.9 | Binding | ChEMBL | None | None | None | Cn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 | 10.1016/j.bmc.2006.09.045 | ||||
| 11994554 | 80160 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL214935 | 80160 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 11994554 | 80160 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL214935 | 80160 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11994677 | 141367 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 508 | 3 | 5 | 6 | 1.8 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](C)NC1=O | 10.1021/jm0606600 | ||
| CHEMBL386854 | 141367 | 0 | None | - | 1 | Human | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 508 | 3 | 5 | 6 | 1.8 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](C)NC1=O | 10.1021/jm0606600 | ||
| 11995358 | 80188 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 536 | 6 | 4 | 5 | 3.1 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](CCc2ccccc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215043 | 80188 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 536 | 6 | 4 | 5 | 3.1 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](CCc2ccccc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 44432973 | 97860 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 577 | 4 | 5 | 6 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL274876 | 97860 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 577 | 4 | 5 | 6 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11995155 | 141376 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 584 | 6 | 5 | 6 | 3.1 | CCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL386906 | 141376 | 0 | None | - | 1 | Human | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 584 | 6 | 5 | 6 | 3.1 | CCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 11410548 | 87137 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 571 | 5 | 4 | 6 | 2.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CN(C)C)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL233561 | 87137 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 571 | 5 | 4 | 6 | 2.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CN(C)C)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 25115652 | 96837 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 643 | 5 | 4 | 8 | 2.6 | Cc1cnnn1C[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL269007 | 96837 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 643 | 5 | 4 | 8 | 2.6 | Cc1cnnn1C[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL197149 | 207361 | 0 | None | - | 1 | Rat | 4.8 | pKi | = | 4.8 | Binding | ChEMBL | None | None | None | CCCc1nc(C[C@H](NC(=O)[C@@H]2CCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1021/jm0505462 | ||||
| 44432969 | 147070 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 525 | 4 | 6 | 7 | 0.6 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL393112 | 147070 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 525 | 4 | 6 | 7 | 0.6 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 25114977 | 146476 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 594 | 5 | 4 | 7 | 2.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cn2cccn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL392657 | 146476 | 0 | None | - | 1 | Human | 7.8 | pKi | = | 7.8 | Binding | ChEMBL | 594 | 5 | 4 | 7 | 2.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cn2cccn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11994680 | 168200 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 584 | 5 | 5 | 6 | 3.0 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm0606600 | ||
| CHEMBL437326 | 168200 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 584 | 5 | 5 | 6 | 3.0 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](Cc2ccccc2)NC1=O | 10.1021/jm0606600 | ||
| 11995359 | 168400 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 539 | 5 | 4 | 7 | 2.9 | CCC[C@@H]1OC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL438998 | 168400 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 539 | 5 | 4 | 7 | 2.9 | CCC[C@@H]1OC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 44467360 | 124015 | 0 | None | -3 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 420 | 3 | 2 | 6 | 1.5 | COc1nc(N2C[C@H]3C(=O)N(C)C(=N)N[C@@]3(c3ccc(F)cc3F)C2)nc(C)c1F | 10.1021/acs.jmedchem.5b01995 | ||
| CHEMBL3640290 | 124015 | 0 | None | -3 | 2 | Human | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 420 | 3 | 2 | 6 | 1.5 | COc1nc(N2C[C@H]3C(=O)N(C)C(=N)N[C@@]3(c3ccc(F)cc3F)C2)nc(C)c1F | 10.1021/acs.jmedchem.5b01995 | ||
| 11994928 | 141337 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 539 | 5 | 4 | 7 | 2.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)OC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL386626 | 141337 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 539 | 5 | 4 | 7 | 2.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)OC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 44432971 | 86610 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 567 | 5 | 6 | 7 | 0.8 | CC(=O)NC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL232551 | 86610 | 0 | None | - | 1 | Human | 5.7 | pKi | = | 5.7 | Binding | ChEMBL | 567 | 5 | 6 | 7 | 0.8 | CC(=O)NC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11995153 | 141103 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 508 | 4 | 5 | 6 | 1.9 | CCC[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL385293 | 141103 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 508 | 4 | 5 | 6 | 1.9 | CCC[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 11181688 | 100865 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 721 | 13 | 4 | 11 | 1.5 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL296748 | 100865 | 0 | None | - | 1 | Human | 8.7 | pKi | = | 8.7 | Binding | ChEMBL | 721 | 13 | 4 | 11 | 1.5 | NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 71720372 | 88624 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 570 | 13 | 4 | 6 | 3.3 | CCNC(=O)[C@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc1ccc(F)cc1)NC | 10.1021/jm301653f | ||
| CHEMBL2313632 | 88624 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 570 | 13 | 4 | 6 | 3.3 | CCNC(=O)[C@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc1ccc(F)cc1)NC | 10.1021/jm301653f | ||
| CHEMBL2364821 | 88624 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 570 | 13 | 4 | 6 | 3.3 | CCNC(=O)[C@H](Cc1ccc(O)c(C(C)(C)C)c1)C(N)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc1ccc(F)cc1)NC | 10.1021/jm301653f | ||
| 44292517 | 101061 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@@H](CCc1ccccc1)NC(=O)[C@@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL298224 | 101061 | 0 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | ChEMBL | 723 | 13 | 4 | 11 | 1.7 | NC(=O)[C@@H](CCc1ccccc1)NC(=O)[C@@H](CCc1ccccc1)NC(=O)C1CCC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 25115429 | 86273 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 655 | 6 | 5 | 8 | 2.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNc2ncccn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL231744 | 86273 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 655 | 6 | 5 | 8 | 2.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNc2ncccn2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 25115653 | 146474 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 644 | 5 | 4 | 9 | 2.0 | Cc1nnnn1C[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL392656 | 146474 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 644 | 5 | 4 | 9 | 2.0 | Cc1nnnn1C[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL388528 | 210671 | 0 | None | -2 | 2 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | None | None | None | C=CCn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 | 10.1016/j.bmc.2006.09.045 | ||||
| 11250008 | 80003 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 566 | 5 | 4 | 6 | 3.0 | CC(C)C[C@H]1C(=O)NCCCc2ccccc2OCCN[C@H](Cc2ccc(O)cc2)C(=O)N[C@H](C(C)C)C(=O)N1C | 10.1021/jm0606600 | ||
| CHEMBL214570 | 80003 | 0 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | ChEMBL | 566 | 5 | 4 | 6 | 3.0 | CC(C)C[C@H]1C(=O)NCCCc2ccccc2OCCN[C@H](Cc2ccc(O)cc2)C(=O)N[C@H](C(C)C)C(=O)N1C | 10.1021/jm0606600 | ||
| 25115654 | 159457 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 657 | 5 | 4 | 8 | 2.9 | Cc1nnn(C[C@@H]2NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc3cccc(C(F)(F)F)c3)NCCOc3ccccc3CCCNC2=O)c1C | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL410786 | 159457 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 657 | 5 | 4 | 8 | 2.9 | Cc1nnn(C[C@@H]2NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc3cccc(C(F)(F)F)c3)NCCOc3ccccc3CCCNC2=O)c1C | 10.1016/j.bmcl.2007.05.043 | ||
| 11995042 | 141355 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 553 | 5 | 6 | 7 | 2.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NNC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL386735 | 141355 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 553 | 5 | 6 | 7 | 2.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NNC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 11192254 | 141177 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 561 | 5 | 5 | 5 | 3.2 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL385673 | 141177 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 561 | 5 | 5 | 5 | 3.2 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 11995157 | 168758 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 552 | 5 | 6 | 7 | 1.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CC(=O)O)NC1=O | 10.1021/jm0606600 | ||
| CHEMBL441697 | 168758 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 552 | 5 | 6 | 7 | 1.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CC(=O)O)NC1=O | 10.1021/jm0606600 | ||
| 11995157 | 168758 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 552 | 5 | 6 | 7 | 1.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CC(=O)O)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL441697 | 168758 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 552 | 5 | 6 | 7 | 1.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CC(=O)O)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 25115200 | 87817 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 584 | 6 | 6 | 6 | 2.3 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CCC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL234810 | 87817 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 584 | 6 | 6 | 6 | 2.3 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CCC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432976 | 154325 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 571 | 5 | 4 | 6 | 2.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN(C)C)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL400635 | 154325 | 0 | None | - | 1 | Human | 7.6 | pKi | = | 7.6 | Binding | ChEMBL | 571 | 5 | 4 | 6 | 2.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN(C)C)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11995454 | 141242 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 552 | 5 | 4 | 6 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)N(C)CCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL386086 | 141242 | 0 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 552 | 5 | 4 | 6 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)N(C)CCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL224525 | 207703 | 0 | None | 1 | 2 | Rat | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | None | None | None | CCCc1nc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 | 10.1016/j.bmc.2006.09.045 | ||||
| CHEMBL2372767 | 208540 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | None | None | None | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](CCSC)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](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O | 10.1021/jm0304865 | ||||
| 53322109 | 55976 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm0304865 | ||
| CHEMBL1628277 | 55976 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 697 | 8 | 2 | 11 | 5.2 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)C[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@H]1C | 10.1021/jm0304865 | ||
| 44432974 | 87136 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 557 | 5 | 5 | 6 | 1.8 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL233560 | 87136 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 557 | 5 | 5 | 6 | 1.8 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11995041 | 80072 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 524 | 5 | 5 | 6 | 2.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL214685 | 80072 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 524 | 5 | 5 | 6 | 2.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 11995357 | 140919 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 528 | 5 | 4 | 5 | 3.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](CC2CCCCC2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL384204 | 140919 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 528 | 5 | 4 | 5 | 3.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](CC2CCCCC2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 25114744 | 160218 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 599 | 6 | 7 | 6 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CCNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL411409 | 160218 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 599 | 6 | 7 | 6 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CCNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11994678 | 140856 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL383881 | 140856 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 536 | 5 | 5 | 6 | 2.5 | CCC[C@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL390942 | 210701 | 0 | None | -3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | None | None | None | CCn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 | 10.1016/j.bmc.2006.09.045 | ||||
| 44432968 | 86521 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 539 | 5 | 6 | 7 | 1.0 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CCN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL232342 | 86521 | 0 | None | - | 1 | Human | 6.5 | pKi | = | 6.5 | Binding | ChEMBL | 539 | 5 | 6 | 7 | 1.0 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CCN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11994556 | 80078 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 472 | 4 | 4 | 5 | 2.2 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](C(C)C)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL214703 | 80078 | 0 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 472 | 4 | 4 | 5 | 2.2 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](C(C)C)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 1048 | 1555 | 72 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| 12560 | 1555 | 72 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| 1456 | 1555 | 72 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| CHEMBL532 | 1555 | 72 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| DB00199 | 1555 | 72 | None | - | 1 | Human | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | 10.1021/jm0304865 | ||
| 44432970 | 86609 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 567 | 6 | 6 | 7 | 1.7 | CC(C)NC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL232550 | 86609 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 567 | 6 | 6 | 7 | 1.7 | CC(C)NC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 23656869 | 147323 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 631 | 5 | 4 | 6 | 3.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN2CCCC2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL393315 | 147323 | 0 | None | - | 1 | Human | 8.3 | pKi | = | 8.3 | Binding | ChEMBL | 631 | 5 | 4 | 6 | 3.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN2CCCC2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432979 | 147985 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 626 | 6 | 5 | 8 | 3.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNc2nccs2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL393842 | 147985 | 0 | None | - | 1 | Human | 7.4 | pKi | = | 7.4 | Binding | ChEMBL | 626 | 6 | 5 | 8 | 3.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNc2nccs2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11398860 | 175471 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 560 | 8 | 3 | 10 | 0.4 | NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL45905 | 175471 | 0 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 560 | 8 | 3 | 10 | 0.4 | NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 11995154 | 80676 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 566 | 7 | 6 | 7 | 1.7 | CCC[C@@H]1NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215532 | 80676 | 0 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 566 | 7 | 6 | 7 | 1.7 | CCC[C@@H]1NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 25115201 | 158228 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 611 | 5 | 6 | 8 | 1.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC2=NCCN2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL409410 | 158228 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 611 | 5 | 6 | 8 | 1.2 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC2=NCCN2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432978 | 86546 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 586 | 5 | 6 | 6 | 1.3 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(N)=O)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL232359 | 86546 | 0 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 586 | 5 | 6 | 6 | 1.3 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(N)=O)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11226476 | 80763 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 538 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215825 | 80763 | 0 | None | - | 1 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 538 | 5 | 5 | 6 | 2.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 11994925 | 80653 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 522 | 5 | 4 | 5 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccccc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215440 | 80653 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 522 | 5 | 4 | 5 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccccc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 44432980 | 146363 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 585 | 5 | 7 | 6 | 1.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL392553 | 146363 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 585 | 5 | 7 | 6 | 1.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11398860 | 175471 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 560 | 8 | 3 | 10 | 0.4 | NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| CHEMBL45905 | 175471 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 560 | 8 | 3 | 10 | 0.4 | NC(=O)[C@H](CCc1ccccc1)NC(=O)C1C=CC2(CCNCC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21 | 10.1021/jm0304865 | ||
| 11204067 | 86358 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 585 | 5 | 7 | 6 | 1.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL232154 | 86358 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 585 | 5 | 7 | 6 | 1.1 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432975 | 87312 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 591 | 5 | 5 | 6 | 2.2 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL233711 | 87312 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 591 | 5 | 5 | 6 | 2.2 | CNC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432977 | 151148 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 619 | 5 | 7 | 6 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL396413 | 151148 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | ChEMBL | 619 | 5 | 7 | 6 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(C(F)(F)F)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC(=N)N)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11168753 | 144418 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 543 | 4 | 5 | 6 | 1.6 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL391045 | 144418 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 543 | 4 | 5 | 6 | 1.6 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(Cl)cc2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11994802 | 81045 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 536 | 5 | 5 | 5 | 3.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCCCc2ccccc2CCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215963 | 81045 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 536 | 5 | 5 | 5 | 3.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCCCc2ccccc2CCNC1=O | 10.1021/jm0606600 | ||
| 11994800 | 141260 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 536 | 5 | 5 | 5 | 3.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCc2ccccc2CCCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL386187 | 141260 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 536 | 5 | 5 | 5 | 3.0 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCc2ccccc2CCCCNC1=O | 10.1021/jm0606600 | ||
| 11180385 | 81004 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 550 | 5 | 5 | 6 | 2.8 | CC(C)C[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215946 | 81004 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 550 | 5 | 5 | 6 | 2.8 | CC(C)C[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 25114976 | 147481 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 594 | 5 | 4 | 7 | 2.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cn2ccnc2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL393439 | 147481 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 594 | 5 | 4 | 7 | 2.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](Cn2ccnc2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44417633 | 140917 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 580 | 5 | 4 | 6 | 2.7 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)N(C(C)=O)CCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL384188 | 140917 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 580 | 5 | 4 | 6 | 2.7 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)N(C(C)=O)CCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 11398651 | 147598 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 543 | 4 | 5 | 6 | 1.6 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL393541 | 147598 | 0 | None | - | 1 | Human | 7.2 | pKi | = | 7.2 | Binding | ChEMBL | 543 | 4 | 5 | 6 | 1.6 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11995156 | 141232 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 524 | 4 | 6 | 7 | 0.7 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CO)NC1=O | 10.1021/jm0606600 | ||
| CHEMBL386036 | 141232 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 524 | 4 | 6 | 7 | 0.7 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CO)NC1=O | 10.1021/jm0606600 | ||
| 11994679 | 79984 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 565 | 7 | 6 | 7 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm0606600 | ||
| CHEMBL214508 | 79984 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 565 | 7 | 6 | 7 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CCCCN)NC1=O | 10.1021/jm0606600 | ||
| 11994679 | 79984 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 565 | 7 | 6 | 7 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CCCCN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL214508 | 79984 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 565 | 7 | 6 | 7 | 1.9 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CCCCN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11994924 | 80000 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 444 | 5 | 5 | 5 | 1.4 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NC/C=C/CCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL214555 | 80000 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 444 | 5 | 5 | 5 | 1.4 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NC/C=C/CCNC1=O | 10.1021/jm0606600 | ||
| 44417743 | 165554 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 548 | 5 | 5 | 5 | 3.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCCc2ccccc2/C=C\CCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL425988 | 165554 | 0 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 548 | 5 | 5 | 5 | 3.5 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCCc2ccccc2/C=C\CCNC1=O | 10.1021/jm0606600 | ||
| 11203197 | 80181 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 520 | 5 | 4 | 5 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccccc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215016 | 80181 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 520 | 5 | 4 | 5 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccccc2)NCCOc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 11994927 | 81352 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 572 | 5 | 4 | 5 | 3.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL216400 | 81352 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 572 | 5 | 4 | 5 | 3.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 11341873 | 140972 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 552 | 6 | 4 | 6 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(OC)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL384501 | 140972 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 552 | 6 | 4 | 6 | 2.8 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(OC)cc2)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 11433096 | 141071 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 572 | 5 | 4 | 5 | 3.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc3ccccc23)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL385087 | 141071 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 572 | 5 | 4 | 5 | 3.9 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2cccc3ccccc23)NCCOc2ccccc2CCCNC1=O | 10.1021/jm0606600 | ||
| 25115427 | 98205 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 625 | 5 | 6 | 8 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC2=NCCCN2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL277329 | 98205 | 0 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 625 | 5 | 6 | 8 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2cccc(Cl)c2)NCCOc2ccccc2CCCNC(=O)[C@H](CNC2=NCCCN2)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 44432967 | 145038 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 551 | 6 | 6 | 7 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CCCN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| CHEMBL391524 | 145038 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 551 | 6 | 6 | 7 | 1.5 | CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2/C=C/CNC(=O)[C@H](CCCN)NC1=O | 10.1016/j.bmcl.2007.05.043 | ||
| 11995259 | 80356 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 520 | 5 | 5 | 5 | 2.7 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215177 | 80356 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 520 | 5 | 5 | 5 | 2.7 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCc2ccccc2/C=C/CNC1=O | 10.1021/jm0606600 | ||
| 11995261 | 80354 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 524 | 5 | 5 | 6 | 2.1 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCNC1=O | 10.1021/jm0606600 | ||
| CHEMBL215169 | 80354 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 524 | 5 | 5 | 6 | 2.1 | CCC[C@@H]1NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCNC1=O | 10.1021/jm0606600 | ||
| 101635584 | 2559 | 26 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1458 | 2559 | 26 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 16136567 | 2559 | 26 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 3794 | 2559 | 26 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 91898963 | 2559 | 26 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| CHEMBL525634 | 2559 | 26 | None | - | 1 | Human | 10.0 | pKd | = | 10 | Binding | Guide to Pharmacology | None | None | None | None | 10381885 | ||||
| 1048 | 1555 | 72 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | None | ||
| 12560 | 1555 | 72 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | None | ||
| 1456 | 1555 | 72 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | None | ||
| CHEMBL532 | 1555 | 72 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | None | ||
| DB00199 | 1555 | 72 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Drug Central | 733 | 7 | 5 | 14 | 1.8 | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O | None | ||
| 2139 | 3794 | 51 | None | 1 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
| 2316 | 3794 | 51 | None | 1 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
| 3836 | 3794 | 51 | None | 1 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
| 638678 | 3794 | 51 | None | 1 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
| CHEMBL1472 | 3794 | 51 | None | 1 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
| DB09421 | 3794 | 51 | None | 1 | 4 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | None | None | None | None | None | ||||
| 101635584 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11461914 | ||||
| 101635584 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11781320 | ||||
| 101635584 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| 101635584 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 16531413 | ||||
| 1458 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11461914 | ||||
| 1458 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11781320 | ||||
| 1458 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| 1458 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 16531413 | ||||
| 16136567 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11461914 | ||||
| 16136567 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11781320 | ||||
| 16136567 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| 16136567 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 16531413 | ||||
| 3794 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11461914 | ||||
| 3794 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11781320 | ||||
| 3794 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| 3794 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 16531413 | ||||
| 91898963 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11461914 | ||||
| 91898963 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11781320 | ||||
| 91898963 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| 91898963 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 16531413 | ||||
| CHEMBL525634 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11461914 | ||||
| CHEMBL525634 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 11781320 | ||||
| CHEMBL525634 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| CHEMBL525634 | 2559 | 26 | None | - | 1 | Human | 8.6 | pKi | = | 8.6 | Binding | Guide to Pharmacology | None | None | None | None | 16531413 | ||||
| 1450 | 3568 | 0 | None | - | 1 | Human | 6.4 | pKi | None | 6.4 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| 1451 | 3571 | 0 | None | - | 1 | Human | 7.3 | pKi | None | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 15677347 | ||||
| 1452 | 701 | 0 | None | - | 1 | Human | 7.9 | pKi | None | 7.9 | Binding | Guide to Pharmacology | None | None | None | None | 11461914 | ||||