Ligand source activities (1 row/activity)
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Activity | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
Reference ligand |
Vendors |
Species |
Assay Type |
Activity Type |
Activity Relation |
Activity Value |
p-value (-log) |
Fold selectivity |
Tested GPCRs |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
|
| 135907764 | 113020 | None | 15 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -18 | 2 | ChEMBL | 319 | 4 | 1 | 5 | 3.5 | N#Cc1c(O)nc(SCc2cccc(F)c2F)nc1C1CC1 | 10.6019/CHEMBL5442687 | |||
| CHEMBL3310783 | 113020 | None | 15 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -18 | 2 | ChEMBL | 319 | 4 | 1 | 5 | 3.5 | N#Cc1c(O)nc(SCc2cccc(F)c2F)nc1C1CC1 | 10.6019/CHEMBL5442687 | |||
| 11316919 | 3068 | None | 31 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -32 | 8 | ChEMBL | 451 | 4 | 0 | 4 | 5.3 | Clc1c(cccc1)n1nc2C(=O)N(CCOc2c1c1ccc(cc1)Cl)CC(C)(F)F | 10.6019/CHEMBL5442687 | |||
| 11693 | 3068 | None | 31 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -32 | 8 | ChEMBL | 451 | 4 | 0 | 4 | 5.3 | Clc1c(cccc1)n1nc2C(=O)N(CCOc2c1c1ccc(cc1)Cl)CC(C)(F)F | 10.6019/CHEMBL5442687 | |||
| CHEMBL484929 | 3068 | None | 31 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -32 | 8 | ChEMBL | 451 | 4 | 0 | 4 | 5.3 | Clc1c(cccc1)n1nc2C(=O)N(CCOc2c1c1ccc(cc1)Cl)CC(C)(F)F | 10.6019/CHEMBL5442687 | |||
| 11858154 | 155430 | None | 19 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -309 | 2 | ChEMBL | 400 | 6 | 3 | 7 | 3.3 | C[C@H](CO)Nc1nc(SCc2cccc(Cl)c2F)nc2[nH]c(=O)sc12 | 10.6019/CHEMBL5442687 | |||
| CHEMBL403225 | 155430 | None | 19 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -309 | 2 | ChEMBL | 400 | 6 | 3 | 7 | 3.3 | C[C@H](CO)Nc1nc(SCc2cccc(Cl)c2F)nc2[nH]c(=O)sc12 | 10.6019/CHEMBL5442687 | |||
| 2705 | 3842 | None | 44 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -575 | 12 | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.6019/CHEMBL5442687 | |||
| 360 | 3842 | None | 44 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -575 | 12 | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.6019/CHEMBL5442687 | |||
| 443879 | 3842 | None | 44 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -575 | 12 | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.6019/CHEMBL5442687 | |||
| 443879.0 | 3842 | None | 44 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -575 | 12 | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.6019/CHEMBL5442687 | |||
| CHEMBL1382 | 3842 | None | 44 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -575 | 12 | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.6019/CHEMBL5442687 | |||
| DB01036 | 3842 | None | 44 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -575 | 12 | ChEMBL | 325 | 7 | 1 | 2 | 5.3 | Cc1ccc(c(c1)[C@@H](c1ccccc1)CCN(C(C)C)C(C)C)O | 10.6019/CHEMBL5442687 | |||
| 3036864 | 205211 | None | 16 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -9549 | 13 | ChEMBL | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | 10.6019/CHEMBL5442687 | |||
| CHEMBL1256645 | 205211 | None | 16 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -9549 | 13 | ChEMBL | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | 10.6019/CHEMBL5442687 | |||
| CHEMBL1814790 | 205211 | None | 16 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -9549 | 13 | ChEMBL | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | 10.6019/CHEMBL5442687 | |||
| CHEMBL62 | 205211 | None | 16 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -9549 | 13 | ChEMBL | 287 | 1 | 1 | 2 | 3.7 | CN1CCc2cc(Cl)c(O)cc2[C@@H](c2ccccc2)C1 | 10.6019/CHEMBL5442687 | |||
| 9887803 | 140924 | None | 26 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -19 | 2 | ChEMBL | 409 | 3 | 4 | 4 | 3.6 | NS(=O)(=O)c1c(Cl)ccc(NC(=O)Nc2cccc(Cl)c2Cl)c1O | 10.6019/CHEMBL5442687 | |||
| CHEMBL3819292 | 140924 | None | 26 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -19 | 2 | ChEMBL | 409 | 3 | 4 | 4 | 3.6 | NS(=O)(=O)c1c(Cl)ccc(NC(=O)Nc2cccc(Cl)c2Cl)c1O | 10.6019/CHEMBL5442687 | |||
| 24780598 | 1316 | None | 38 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -85 | 2 | ChEMBL | 441 | 4 | 4 | 5 | 3.7 | O=C(Nc1cccc(c1C)F)Nc1ccc(c(c1O)S(=O)(=O)[C@H]1CCCNC1)Cl | 10.6019/CHEMBL5442687 | |||
| 8500 | 1316 | None | 38 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -85 | 2 | ChEMBL | 441 | 4 | 4 | 5 | 3.7 | O=C(Nc1cccc(c1C)F)Nc1ccc(c(c1O)S(=O)(=O)[C@H]1CCCNC1)Cl | 10.6019/CHEMBL5442687 | |||
| CHEMBL3039531 | 1316 | None | 38 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -85 | 2 | ChEMBL | 441 | 4 | 4 | 5 | 3.7 | O=C(Nc1cccc(c1C)F)Nc1ccc(c(c1O)S(=O)(=O)[C@H]1CCCNC1)Cl | 10.6019/CHEMBL5442687 | |||
| DB11922 | 1316 | None | 38 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -85 | 2 | ChEMBL | 441 | 4 | 4 | 5 | 3.7 | O=C(Nc1cccc(c1C)F)Nc1ccc(c(c1O)S(=O)(=O)[C@H]1CCCNC1)Cl | 10.6019/CHEMBL5442687 | |||
| 11250647 | 1545 | None | 35 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -2511 | 7 | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| 11250647.0 | 1545 | None | 35 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -2511 | 7 | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| 5293 | 1545 | None | 35 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -2511 | 7 | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| 8362 | 1545 | None | 35 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -2511 | 7 | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| CHEMBL1208155 | 1545 | None | 35 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -2511 | 7 | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| DB11979 | 1545 | None | 35 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -2511 | 7 | ChEMBL | 631 | 12 | 2 | 7 | 5.5 | COc1cccc(c1F)c1c(=O)n(C[C@@H](c2ccccc2)NCCCC(=O)O)c(=O)n(c1C)Cc1c(F)cccc1C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| 6603703 | 208 | None | 8 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -524 | 18 | ChEMBL | 329 | 2 | 3 | 4 | 3.3 | NC[C@@H]1O[C@@H](Cc2c1ccc(c2O)O)C12CC3CC(C2)CC(C1)C3 | 10.6019/CHEMBL5442687 | |||
| 9637 | 208 | None | 8 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -524 | 18 | ChEMBL | 329 | 2 | 3 | 4 | 3.3 | NC[C@@H]1O[C@@H](Cc2c1ccc(c2O)O)C12CC3CC(C2)CC(C1)C3 | 10.6019/CHEMBL5442687 | |||
| CHEMBL291143 | 208 | None | 8 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -524 | 18 | ChEMBL | 329 | 2 | 3 | 4 | 3.3 | NC[C@@H]1O[C@@H](Cc2c1ccc(c2O)O)C12CC3CC(C2)CC(C1)C3 | 10.6019/CHEMBL5442687 | |||
| 662 | 3680 | None | 7 | Human | Functional | pIC50 | = | 5.7 | 5.7 | 1 | 12 | ChEMBL | 756 | 14 | 2 | 8 | 6.3 | COc1ccc2c(c1)ccc(c2)S(=O)(=O)N[C@@H](c1ccc2c(c1)OCO2)CC(=O)N[C@@H](C(=O)N(C(C)C)C)Cc1ccc(cc1)CN1[C@H](C)CCC[C@@H]1C | 10.6019/CHEMBL5442687 | |||
| 9853583 | 3680 | None | 7 | Human | Functional | pIC50 | = | 5.7 | 5.7 | 1 | 12 | ChEMBL | 756 | 14 | 2 | 8 | 6.3 | COc1ccc2c(c1)ccc(c2)S(=O)(=O)N[C@@H](c1ccc2c(c1)OCO2)CC(=O)N[C@@H](C(=O)N(C(C)C)C)Cc1ccc(cc1)CN1[C@H](C)CCC[C@@H]1C | 10.6019/CHEMBL5442687 | |||
| CHEMBL2021721 | 3680 | None | 7 | Human | Functional | pIC50 | = | 5.7 | 5.7 | 1 | 12 | ChEMBL | 756 | 14 | 2 | 8 | 6.3 | COc1ccc2c(c1)ccc(c2)S(=O)(=O)N[C@@H](c1ccc2c(c1)OCO2)CC(=O)N[C@@H](C(=O)N(C(C)C)C)Cc1ccc(cc1)CN1[C@H](C)CCC[C@@H]1C | 10.6019/CHEMBL5442687 | |||
| 1692 | 2154 | None | 25 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -87 | 18 | ChEMBL | 411 | 6 | 2 | 4 | 5.5 | CCc1ccc(cc1)OCc1ccccc1C(=O)Nc1ccc2c(c1)c(N)cc(n2)C | 10.6019/CHEMBL5442687 | |||
| 5311340 | 2154 | None | 25 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -87 | 18 | ChEMBL | 411 | 6 | 2 | 4 | 5.5 | CCc1ccc(cc1)OCc1ccccc1C(=O)Nc1ccc2c(c1)c(N)cc(n2)C | 10.6019/CHEMBL5442687 | |||
| CHEMBL140979 | 2154 | None | 25 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -87 | 18 | ChEMBL | 411 | 6 | 2 | 4 | 5.5 | CCc1ccc(cc1)OCc1ccccc1C(=O)Nc1ccc2c(c1)c(N)cc(n2)C | 10.6019/CHEMBL5442687 | |||
| 10150497 | 4074 | None | 40 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -457 | 15 | ChEMBL | 380 | 4 | 1 | 7 | 2.7 | NCCc1cn(c2c1cccc2)S(=O)(=O)c1c(Cl)nc2n1ccs2 | 10.6019/CHEMBL5442687 | |||
| 3240 | 4074 | None | 40 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -457 | 15 | ChEMBL | 380 | 4 | 1 | 7 | 2.7 | NCCc1cn(c2c1cccc2)S(=O)(=O)c1c(Cl)nc2n1ccs2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL392760 | 4074 | None | 40 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -457 | 15 | ChEMBL | 380 | 4 | 1 | 7 | 2.7 | NCCc1cn(c2c1cccc2)S(=O)(=O)c1c(Cl)nc2n1ccs2 | 10.6019/CHEMBL5442687 | |||
| 209 | 3057 | None | 57 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1288 | 25 | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.6019/CHEMBL5442687 | |||
| 2113 | 3057 | None | 57 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1288 | 25 | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.6019/CHEMBL5442687 | |||
| 4748 | 3057 | None | 57 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1288 | 25 | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.6019/CHEMBL5442687 | |||
| 4748.0 | 3057 | None | 57 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1288 | 25 | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL567 | 3057 | None | 57 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1288 | 25 | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.6019/CHEMBL5442687 | |||
| DB00850 | 3057 | None | 57 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -1288 | 25 | ChEMBL | 403 | 6 | 1 | 5 | 3.9 | OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2 | 10.6019/CHEMBL5442687 | |||
| 1209 | 1658 | None | 52 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -25 | 25 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| 203 | 1658 | None | 52 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -25 | 25 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| 3386 | 1658 | None | 52 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -25 | 25 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| CHEMBL41 | 1658 | None | 52 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -25 | 25 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| DB00472 | 1658 | None | 52 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -25 | 25 | ChEMBL | 309 | 6 | 1 | 2 | 4.4 | CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F | 10.6019/CHEMBL5442687 | |||
| 2419 | 3463 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -5623 | 19 | ChEMBL | 415 | 16 | 4 | 5 | 4.1 | OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O | 10.6019/CHEMBL5442687 | |||
| 5152 | 3463 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -5623 | 19 | ChEMBL | 415 | 16 | 4 | 5 | 4.1 | OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O | 10.6019/CHEMBL5442687 | |||
| 5152.0 | 3463 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -5623 | 19 | ChEMBL | 415 | 16 | 4 | 5 | 4.1 | OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O | 10.6019/CHEMBL5442687 | |||
| 559 | 3463 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -5623 | 19 | ChEMBL | 415 | 16 | 4 | 5 | 4.1 | OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O | 10.6019/CHEMBL5442687 | |||
| CHEMBL1263 | 3463 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -5623 | 19 | ChEMBL | 415 | 16 | 4 | 5 | 4.1 | OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O | 10.6019/CHEMBL5442687 | |||
| DB00938 | 3463 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -5623 | 19 | ChEMBL | 415 | 16 | 4 | 5 | 4.1 | OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O | 10.6019/CHEMBL5442687 | |||
| 10071196 | 3124 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -218 | 15 | ChEMBL | 427 | 8 | 1 | 3 | 4.7 | CC(COc1ccc(cc1)CNC(=O)N(C1CCN(CC1)C)Cc1ccc(cc1)F)C | 10.6019/CHEMBL5442687 | |||
| 10071196.0 | 3124 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -218 | 15 | ChEMBL | 427 | 8 | 1 | 3 | 4.7 | CC(COc1ccc(cc1)CNC(=O)N(C1CCN(CC1)C)Cc1ccc(cc1)F)C | 10.6019/CHEMBL5442687 | |||
| 5142 | 3124 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -218 | 15 | ChEMBL | 427 | 8 | 1 | 3 | 4.7 | CC(COc1ccc(cc1)CNC(=O)N(C1CCN(CC1)C)Cc1ccc(cc1)F)C | 10.6019/CHEMBL5442687 | |||
| 8423 | 3124 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -218 | 15 | ChEMBL | 427 | 8 | 1 | 3 | 4.7 | CC(COc1ccc(cc1)CNC(=O)N(C1CCN(CC1)C)Cc1ccc(cc1)F)C | 10.6019/CHEMBL5442687 | |||
| CHEMBL2111101 | 3124 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -218 | 15 | ChEMBL | 427 | 8 | 1 | 3 | 4.7 | CC(COc1ccc(cc1)CNC(=O)N(C1CCN(CC1)C)Cc1ccc(cc1)F)C | 10.6019/CHEMBL5442687 | |||
| DB05316 | 3124 | None | 53 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -218 | 15 | ChEMBL | 427 | 8 | 1 | 3 | 4.7 | CC(COc1ccc(cc1)CNC(=O)N(C1CCN(CC1)C)Cc1ccc(cc1)F)C | 10.6019/CHEMBL5442687 | |||
| 3929516 | 107426 | None | 4 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 1 | 2 | ChEMBL | 343 | 4 | 0 | 2 | 4.7 | CN1C2CCC1CC(OC(c1ccc(F)cc1)c1ccc(F)cc1)C2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL317757 | 107426 | None | 4 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 1 | 2 | ChEMBL | 343 | 4 | 0 | 2 | 4.7 | CN1C2CCC1CC(OC(c1ccc(F)cc1)c1ccc(F)cc1)C2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL543113 | 107426 | None | 4 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 1 | 2 | ChEMBL | 343 | 4 | 0 | 2 | 4.7 | CN1C2CCC1CC(OC(c1ccc(F)cc1)c1ccc(F)cc1)C2 | 10.6019/CHEMBL5442687 | |||
| 276 | 3513 | None | 37 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1905 | 5 | ChEMBL | 451 | 5 | 2 | 6 | 4.1 | COc1ccc(cc1N1CCNCC1)NS(=O)(=O)c1sc2c(c1C)cc(cc2)Cl | 10.6019/CHEMBL5442687 | |||
| 5312149 | 3513 | None | 37 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1905 | 5 | ChEMBL | 451 | 5 | 2 | 6 | 4.1 | COc1ccc(cc1N1CCNCC1)NS(=O)(=O)c1sc2c(c1C)cc(cc2)Cl | 10.6019/CHEMBL5442687 | |||
| CHEMBL431298 | 3513 | None | 37 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1905 | 5 | ChEMBL | 451 | 5 | 2 | 6 | 4.1 | COc1ccc(cc1N1CCNCC1)NS(=O)(=O)c1sc2c(c1C)cc(cc2)Cl | 10.6019/CHEMBL5442687 | |||
| 10390 | 2119 | None | 40 | Human | Functional | pIC50 | = | 5.4 | 5.4 | 4 | 3 | ChEMBL | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 10.6019/CHEMBL5442687 | |||
| 57382073 | 2119 | None | 40 | Human | Functional | pIC50 | = | 5.4 | 5.4 | 4 | 3 | ChEMBL | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL4760718 | 2119 | None | 40 | Human | Functional | pIC50 | = | 5.4 | 5.4 | 4 | 3 | ChEMBL | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL4803066 | 2119 | None | 40 | Human | Functional | pIC50 | = | 5.4 | 5.4 | 4 | 3 | ChEMBL | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 10.6019/CHEMBL5442687 | |||
| 44634573 | 2748 | None | 1 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -724 | 15 | ChEMBL | 465 | 6 | 0 | 2 | 5.0 | Cc1n(C/C=C/c2ccccc2)c2[n+](c1P(=S)(c1ccccc1)c1ccccc1)cccc2 | 10.6019/CHEMBL5442687 | |||
| 9168 | 2748 | None | 1 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -724 | 15 | ChEMBL | 465 | 6 | 0 | 2 | 5.0 | Cc1n(C/C=C/c2ccccc2)c2[n+](c1P(=S)(c1ccccc1)c1ccccc1)cccc2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL1474387 | 2748 | None | 1 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -724 | 15 | ChEMBL | 465 | 6 | 0 | 2 | 5.0 | Cc1n(C/C=C/c2ccccc2)c2[n+](c1P(=S)(c1ccccc1)c1ccccc1)cccc2 | 10.6019/CHEMBL5442687 | |||
| CHEMBL1622930 | 2748 | None | 1 | Human | Functional | pIC50 | = | 5.2 | 5.2 | -724 | 15 | ChEMBL | 465 | 6 | 0 | 2 | 5.0 | Cc1n(C/C=C/c2ccccc2)c2[n+](c1P(=S)(c1ccccc1)c1ccccc1)cccc2 | 10.6019/CHEMBL5442687 | |||
| 10390 | 2119 | None | 40 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 4 | 3 | Guide to Pharmacology | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 27001765 | |||
| 57382073 | 2119 | None | 40 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 4 | 3 | Guide to Pharmacology | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 27001765 | |||
| CHEMBL4760718 | 2119 | None | 40 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 4 | 3 | Guide to Pharmacology | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 27001765 | |||
| CHEMBL4803066 | 2119 | None | 40 | Human | Functional | pIC50 | = | 9.5 | 9.5 | 4 | 3 | Guide to Pharmacology | 419 | 5 | 0 | 4 | 5.2 | Clc1ccc(cc1)C1CCN(CC1)CCCn1c(=O)c2cccn2c2c1cccc2 | 27001765 | |||
| 856 | 1270 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | - | 1 | Guide to Pharmacology | None | None | None | None | 14607932 | |||||
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Activity | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
Reference ligand |
Vendors |
Species |
Assay Type |
Activity Type |
Activity Relation |
Activity Value |
p-value (-log) |
Fold selectivity |
Tested GPCRs |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
|
| 71293797 | 172400 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 501 | 8 | 2 | 4 | 4.6 | Cc1cccc(Cl)c1CN1C[C@H](C)[C@](CC(=O)O)(C(=O)NC2CCN(CC3=CCCCC3)CC2)C1 | nan | |||
| CHEMBL4475030 | 172400 | None | 0 | Human | Binding | pIC50 | = | 8.0 | 8.0 | - | 0 | ChEMBL | 501 | 8 | 2 | 4 | 4.6 | Cc1cccc(Cl)c1CN1C[C@H](C)[C@](CC(=O)O)(C(=O)NC2CCN(CC3=CCCCC3)CC2)C1 | nan | |||
| 71293723 | 170156 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 539 | 9 | 2 | 4 | 5.4 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2CCCCC2)CC1 | nan | |||
| CHEMBL4442967 | 170156 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 539 | 9 | 2 | 4 | 5.4 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2CCCCC2)CC1 | nan | |||
| 71293703 | 175051 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 549 | 10 | 2 | 4 | 5.0 | CCCC(F)CN1CCC(NC(=O)[C@]2(CC(=O)O)CN(Cc3c(Cl)cccc3C(F)(F)F)C[C@@H]2C)CC1 | nan | |||
| CHEMBL4565523 | 175051 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 549 | 10 | 2 | 4 | 5.0 | CCCC(F)CN1CCC(NC(=O)[C@]2(CC(=O)O)CN(Cc3c(Cl)cccc3C(F)(F)F)C[C@@H]2C)CC1 | nan | |||
| 71293644 | 174481 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 527 | 12 | 2 | 4 | 5.4 | CCCCCCN1CCC(NC(=O)[C@]2(CC(=O)O)CN(Cc3c(Cl)cccc3C(F)F)C[C@@H]2C)CC1 | nan | |||
| CHEMBL4551880 | 174481 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 527 | 12 | 2 | 4 | 5.4 | CCCCCCN1CCC(NC(=O)[C@]2(CC(=O)O)CN(Cc3c(Cl)cccc3C(F)F)C[C@@H]2C)CC1 | nan | |||
| 71293790 | 169653 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 523 | 9 | 2 | 4 | 4.9 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCC2)CC1 | nan | |||
| CHEMBL4435586 | 169653 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 523 | 9 | 2 | 4 | 4.9 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCC2)CC1 | nan | |||
| 71293710 | 170194 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 507 | 8 | 2 | 4 | 4.6 | C[C@H]1CN(Cc2c(Cl)cccc2Cl)C[C@@]1(CC(=O)O)C(=O)N[C@H]1CCN(CC2=CCCCC2)C1 | nan | |||
| CHEMBL4443425 | 170194 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 507 | 8 | 2 | 4 | 4.6 | C[C@H]1CN(Cc2c(Cl)cccc2Cl)C[C@@]1(CC(=O)O)C(=O)N[C@H]1CCN(CC2=CCCCC2)C1 | nan | |||
| 71293610 | 171105 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 559 | 8 | 2 | 4 | 5.3 | C[C@H]1CN(Cc2c(Cl)cccc2Cl)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2CCC(F)(F)CC2)CC1 | nan | |||
| CHEMBL4456446 | 171105 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 559 | 8 | 2 | 4 | 5.3 | C[C@H]1CN(Cc2c(Cl)cccc2Cl)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2CCC(F)(F)CC2)CC1 | nan | |||
| 71293715 | 170470 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 487 | 8 | 2 | 4 | 4.3 | Cc1cccc(Cl)c1CN1C[C@H](C)[C@](CC(=O)O)(C(=O)NC2CCN(CC3=CCCC3)CC2)C1 | nan | |||
| CHEMBL4447653 | 170470 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 487 | 8 | 2 | 4 | 4.3 | Cc1cccc(Cl)c1CN1C[C@H](C)[C@](CC(=O)O)(C(=O)NC2CCN(CC3=CCCC3)CC2)C1 | nan | |||
| 71293692 | 173124 | None | 21 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 555 | 8 | 2 | 4 | 5.4 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCCC2)CC1 | nan | |||
| CHEMBL4518556 | 173124 | None | 21 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 555 | 8 | 2 | 4 | 5.4 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCCC2)CC1 | nan | |||
| 71293607 | 173977 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 541 | 8 | 2 | 4 | 5.0 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCC2)CC1 | nan | |||
| CHEMBL4539605 | 173977 | None | 0 | Human | Binding | pIC50 | = | 8.3 | 8.3 | - | 0 | ChEMBL | 541 | 8 | 2 | 4 | 5.0 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCC2)CC1 | nan | |||
| 71293699 | 172327 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 521 | 8 | 2 | 4 | 5.0 | C[C@H]1CN(Cc2c(Cl)cccc2Cl)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCCC2)CC1 | nan | |||
| CHEMBL4474066 | 172327 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 521 | 8 | 2 | 4 | 5.0 | C[C@H]1CN(Cc2c(Cl)cccc2Cl)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCCC2)CC1 | nan | |||
| 71293737 | 175566 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 537 | 9 | 2 | 4 | 5.3 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCCC2)CC1 | nan | |||
| CHEMBL4577003 | 175566 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 537 | 9 | 2 | 4 | 5.3 | C[C@H]1CN(Cc2c(Cl)cccc2C(F)F)C[C@@]1(CC(=O)O)C(=O)NC1CCN(CC2=CCCCC2)CC1 | nan | |||
| 132072454 | 179830 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 558 | 6 | 2 | 8 | 4.7 | COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN(C#N)[C@H](c3[nH]c4ccccc4c3CCn3cc(-c4cccc(Cl)c4)nn3)C[C@@H]21 | 10.1016/j.bmc.2020.115546 | |||
| CHEMBL4744046 | 179830 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 0 | ChEMBL | 558 | 6 | 2 | 8 | 4.7 | COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN(C#N)[C@H](c3[nH]c4ccccc4c3CCn3cc(-c4cccc(Cl)c4)nn3)C[C@@H]21 | 10.1016/j.bmc.2020.115546 | |||
| 69440865 | 88403 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | -2 | 2 | ChEMBL | 426 | 8 | 3 | 7 | 3.8 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349306 | 88403 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | -2 | 2 | ChEMBL | 426 | 8 | 3 | 7 | 3.8 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 59799570 | 88437 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 5 | 2 | ChEMBL | 375 | 8 | 3 | 8 | 3.5 | CCC[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349339 | 88437 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 5 | 2 | ChEMBL | 375 | 8 | 3 | 8 | 3.5 | CCC[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625506 | 88413 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 58 | 2 | ChEMBL | 481 | 8 | 3 | 8 | 5.1 | CC(C)C[C@H](CO)Nc1nc(S[C@H](C)c2ccccc2Br)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349315 | 88413 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 58 | 2 | ChEMBL | 481 | 8 | 3 | 8 | 5.1 | CC(C)C[C@H](CO)Nc1nc(S[C@H](C)c2ccccc2Br)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625504 | 88388 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 4 | 2 | ChEMBL | 417 | 10 | 3 | 8 | 4.2 | CC(C)C[C@H](CO)Nc1nc(SCCCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349183 | 88388 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 4 | 2 | ChEMBL | 417 | 10 | 3 | 8 | 4.2 | CC(C)C[C@H](CO)Nc1nc(SCCCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71624890 | 88389 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -1 | 2 | ChEMBL | 422 | 8 | 3 | 8 | 2.2 | CC(C)C[C@H](CO)Nc1nc(S(=O)(=O)Cc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349184 | 88389 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -1 | 2 | ChEMBL | 422 | 8 | 3 | 8 | 2.2 | CC(C)C[C@H](CO)Nc1nc(S(=O)(=O)Cc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 11857680 | 97683 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 347 | 6 | 3 | 8 | 2.8 | C[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL271013 | 97683 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 347 | 6 | 3 | 8 | 2.8 | C[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625274 | 88424 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 33 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 3.7 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2C#N)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349326 | 88424 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 33 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 3.7 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2C#N)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625145 | 88392 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 417 | 8 | 3 | 8 | 4.6 | CC(C)C[C@@H](Nc1nc(SCc2ccccc2)nc2nc(N)sc12)C(C)(C)O | 10.1021/jm3012273 | |||
| CHEMBL2349187 | 88392 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 417 | 8 | 3 | 8 | 4.6 | CC(C)C[C@@H](Nc1nc(SCc2ccccc2)nc2nc(N)sc12)C(C)(C)O | 10.1021/jm3012273 | |||
| 71625390 | 88429 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -4 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 3.7 | CC(C)C[C@H](CO)Nc1nc(SCc2ccc(C#N)cc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349331 | 88429 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -4 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 3.7 | CC(C)C[C@H](CO)Nc1nc(SCc2ccc(C#N)cc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625505 | 88412 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 204 | 2 | ChEMBL | 481 | 8 | 3 | 8 | 5.1 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2Br)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349314 | 88412 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 204 | 2 | ChEMBL | 481 | 8 | 3 | 8 | 5.1 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2Br)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 66622526 | 88416 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 64 | 2 | ChEMBL | 415 | 8 | 3 | 8 | 3.7 | CCC[C@H](CO)Nc1nc(S[C@@H](C)c2cccc(C#N)c2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349318 | 88416 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 64 | 2 | ChEMBL | 415 | 8 | 3 | 8 | 3.7 | CCC[C@H](CO)Nc1nc(S[C@@H](C)c2cccc(C#N)c2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 71625503 | 88387 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 19 | 2 | ChEMBL | 403 | 9 | 3 | 8 | 3.8 | CC(C)C[C@H](CO)Nc1nc(SCCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349182 | 88387 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 19 | 2 | ChEMBL | 403 | 9 | 3 | 8 | 3.8 | CC(C)C[C@H](CO)Nc1nc(SCCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 11964663 | 88409 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 117 | 2 | ChEMBL | 403 | 8 | 3 | 8 | 4.3 | CC(C)C[C@H](CO)Nc1nc(S[C@H](C)c2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349311 | 88409 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 117 | 2 | ChEMBL | 403 | 8 | 3 | 8 | 4.3 | CC(C)C[C@H](CO)Nc1nc(S[C@H](C)c2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625146 | 88418 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 1 | 2 | ChEMBL | 389 | 6 | 3 | 8 | 3.8 | CC(C)(C)[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349320 | 88418 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 1 | 2 | ChEMBL | 389 | 6 | 3 | 8 | 3.8 | CC(C)(C)[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71720196 | 88386 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 10 | 2 | ChEMBL | 425 | 8 | 3 | 8 | 3.9 | CCC[C@H](CO)Nc1nc(S[C@@H](C)c2cnccc2Cl)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349181 | 88386 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 10 | 2 | ChEMBL | 425 | 8 | 3 | 8 | 3.9 | CCC[C@H](CO)Nc1nc(S[C@@H](C)c2cnccc2Cl)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 71625021 | 88401 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 10 | 2 | ChEMBL | 402 | 8 | 3 | 8 | 3.3 | CC(C)C[C@@H](Nc1nc(SCc2ccccc2)nc2nc(N)sc12)C(N)=O | 10.1021/jm3012273 | |||
| CHEMBL2349304 | 88401 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 10 | 2 | ChEMBL | 402 | 8 | 3 | 8 | 3.3 | CC(C)C[C@@H](Nc1nc(SCc2ccccc2)nc2nc(N)sc12)C(N)=O | 10.1021/jm3012273 | |||
| 71625143 | 88435 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 409 | 7 | 3 | 8 | 4.1 | Nc1nc2nc(SCc3ccccc3)nc(N[C@@H](CO)c3ccccc3)c2s1 | 10.1021/jm3012273 | |||
| CHEMBL2349337 | 88435 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 409 | 7 | 3 | 8 | 4.1 | Nc1nc2nc(SCc3ccccc3)nc(N[C@@H](CO)c3ccccc3)c2s1 | 10.1021/jm3012273 | |||
| 71625272 | 88422 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 9 | 2 | ChEMBL | 407 | 8 | 3 | 8 | 3.9 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349324 | 88422 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 9 | 2 | ChEMBL | 407 | 8 | 3 | 8 | 3.9 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 11964579 | 88417 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 481 | 9 | 3 | 10 | 3.7 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2cccc(S(C)(=O)=O)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349319 | 88417 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 481 | 9 | 3 | 10 | 3.7 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2cccc(S(C)(=O)=O)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 69442228 | 88390 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 406 | 8 | 3 | 7 | 2.5 | CC(C)C[C@H](CO)Nc1nc([S+]([O-])Cc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349185 | 88390 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 406 | 8 | 3 | 7 | 2.5 | CC(C)C[C@H](CO)Nc1nc([S+]([O-])Cc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 12073809 | 155392 | None | 0 | Human | Binding | pKi | = | 4.5 | 4.5 | - | 1 | ChEMBL | 348 | 6 | 3 | 7 | 2.5 | C[C@H](CO)Nc1nc(SCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL402986 | 155392 | None | 0 | Human | Binding | pKi | = | 4.5 | 4.5 | - | 1 | ChEMBL | 348 | 6 | 3 | 7 | 2.5 | C[C@H](CO)Nc1nc(SCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 11965767 | 88408 | None | 36 | Human | Binding | pKi | = | 8.4 | 8.4 | 33 | 3 | ChEMBL | 403 | 8 | 3 | 8 | 4.3 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349310 | 88408 | None | 36 | Human | Binding | pKi | = | 8.4 | 8.4 | 33 | 3 | ChEMBL | 403 | 8 | 3 | 8 | 4.3 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 57692074 | 88419 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | 390 | 8 | 3 | 7 | 3.5 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349321 | 88419 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | 390 | 8 | 3 | 7 | 3.5 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 71625276 | 88426 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 6 | 2 | ChEMBL | 467 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(Br)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349328 | 88426 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 6 | 2 | ChEMBL | 467 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(Br)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625022 | 88402 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 18 | 2 | ChEMBL | 403 | 8 | 3 | 8 | 3.9 | CC(C)C[C@@H](Nc1nc(SCc2ccccc2)nc2nc(N)sc12)C(=O)O | 10.1021/jm3012273 | |||
| CHEMBL2349305 | 88402 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 18 | 2 | ChEMBL | 403 | 8 | 3 | 8 | 3.9 | CC(C)C[C@@H](Nc1nc(SCc2ccccc2)nc2nc(N)sc12)C(=O)O | 10.1021/jm3012273 | |||
| 71625392 | 88404 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 2 | ChEMBL | 390 | 8 | 3 | 9 | 3.2 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccn2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349307 | 88404 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 2 | ChEMBL | 390 | 8 | 3 | 9 | 3.2 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccn2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625271 | 88420 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 436 | 2 | ChEMBL | 467 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2Br)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349322 | 88420 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 436 | 2 | ChEMBL | 467 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2Br)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 11964664 | 88414 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 301 | 2 | ChEMBL | 421 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349316 | 88414 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 301 | 2 | ChEMBL | 421 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625625 | 88415 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 309 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 4.0 | CCC[C@H](CO)Nc1nc(S[C@@H](C)c2cccc(C#N)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349317 | 88415 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 309 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 4.0 | CCC[C@H](CO)Nc1nc(S[C@@H](C)c2cccc(C#N)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625019 | 88399 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 97 | 2 | ChEMBL | 451 | 8 | 2 | 9 | 4.6 | COC(=O)[C@@H](CC(C)C)Nc1nc(SCc2ccccc2Cl)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349302 | 88399 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 97 | 2 | ChEMBL | 451 | 8 | 2 | 9 | 4.6 | COC(=O)[C@@H](CC(C)C)Nc1nc(SCc2ccccc2Cl)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 69441619 | 88391 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 13 | 2 | ChEMBL | 374 | 8 | 3 | 7 | 2.8 | CC(C)C[C@H](CO)Nc1nc(OCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349186 | 88391 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 13 | 2 | ChEMBL | 374 | 8 | 3 | 7 | 2.8 | CC(C)C[C@H](CO)Nc1nc(OCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 71625389 | 88428 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 33 | 2 | ChEMBL | 467 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(SCc2ccc(Br)cc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349330 | 88428 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 33 | 2 | ChEMBL | 467 | 8 | 3 | 8 | 4.5 | CC(C)C[C@H](CO)Nc1nc(SCc2ccc(Br)cc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 58230405 | 88433 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 10 | 2 | ChEMBL | 389 | 8 | 3 | 8 | 3.8 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349335 | 88433 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 10 | 2 | ChEMBL | 389 | 8 | 3 | 8 | 3.8 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71718998 | 88385 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 85 | 2 | ChEMBL | 439 | 8 | 3 | 8 | 4.1 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2cc(Cl)ccn2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349180 | 88385 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 85 | 2 | ChEMBL | 439 | 8 | 3 | 8 | 4.1 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2cc(Cl)ccn2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 58230407 | 88421 | None | 1 | Human | Binding | pKi | = | 7.3 | 7.3 | 34 | 2 | ChEMBL | 423 | 8 | 3 | 8 | 4.4 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2Cl)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349323 | 88421 | None | 1 | Human | Binding | pKi | = | 7.3 | 7.3 | 34 | 2 | ChEMBL | 423 | 8 | 3 | 8 | 4.4 | CC(C)C[C@H](CO)Nc1nc(SCc2ccccc2Cl)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 11858153 | 88432 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -26 | 2 | ChEMBL | 362 | 7 | 3 | 7 | 2.9 | CC[C@H](CO)Nc1nc(SCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349334 | 88432 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -26 | 2 | ChEMBL | 362 | 7 | 3 | 7 | 2.9 | CC[C@H](CO)Nc1nc(SCc2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 71716556 | 88384 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 181 | 2 | ChEMBL | 438 | 8 | 3 | 9 | 4.4 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2cc(Cl)ccn2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349179 | 88384 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 181 | 2 | ChEMBL | 438 | 8 | 3 | 9 | 4.4 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2cc(Cl)ccn2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625024 | 88434 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 389 | 8 | 3 | 8 | 3.8 | CC(C)C[C@@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349336 | 88434 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 389 | 8 | 3 | 8 | 3.8 | CC(C)C[C@@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625144 | 88436 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -4 | 2 | ChEMBL | 375 | 7 | 3 | 8 | 3.4 | CC(C)[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349338 | 88436 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -4 | 2 | ChEMBL | 375 | 7 | 3 | 8 | 3.4 | CC(C)[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625501 | 88405 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 7 | 2 | ChEMBL | 390 | 8 | 3 | 9 | 3.2 | CC(C)C[C@H](CO)Nc1nc(SCc2cccnc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349308 | 88405 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 7 | 2 | ChEMBL | 390 | 8 | 3 | 9 | 3.2 | CC(C)C[C@H](CO)Nc1nc(SCc2cccnc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 11857488 | 88410 | None | 4 | Human | Binding | pKi | = | 8.1 | 8.1 | 26 | 2 | ChEMBL | 404 | 8 | 3 | 7 | 4.1 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349312 | 88410 | None | 4 | Human | Binding | pKi | = | 8.1 | 8.1 | 26 | 2 | ChEMBL | 404 | 8 | 3 | 7 | 4.1 | CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 71625273 | 88423 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 21 | 2 | ChEMBL | 403 | 8 | 3 | 8 | 4.1 | Cc1ccccc1CSc1nc(N[C@@H](CO)CC(C)C)c2sc(N)nc2n1 | 10.1021/jm3012273 | |||
| CHEMBL2349325 | 88423 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 21 | 2 | ChEMBL | 403 | 8 | 3 | 8 | 4.1 | Cc1ccccc1CSc1nc(N[C@@H](CO)CC(C)C)c2sc(N)nc2n1 | 10.1021/jm3012273 | |||
| 71625391 | 88431 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 1 | 2 | ChEMBL | 425 | 8 | 3 | 8 | 4.1 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349333 | 88431 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 1 | 2 | ChEMBL | 425 | 8 | 3 | 8 | 4.1 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 9885291 | 98340 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -4 | 2 | ChEMBL | 361 | 7 | 3 | 8 | 3.1 | CC[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL274737 | 98340 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -4 | 2 | ChEMBL | 361 | 7 | 3 | 8 | 3.1 | CC[C@H](CO)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 11857486 | 88411 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 169 | 2 | ChEMBL | 404 | 8 | 3 | 7 | 4.1 | CC(C)C[C@H](CO)Nc1nc(S[C@H](C)c2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349313 | 88411 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 169 | 2 | ChEMBL | 404 | 8 | 3 | 7 | 4.1 | CC(C)C[C@H](CO)Nc1nc(S[C@H](C)c2ccccc2)nc2[nH]c(=O)sc12 | 10.1021/jm3012273 | |||
| 21035680 | 88430 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 69 | 2 | ChEMBL | 485 | 8 | 3 | 8 | 4.7 | CC(C)C[C@H](CO)Nc1nc(SCc2ccc(Br)cc2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349332 | 88430 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 69 | 2 | ChEMBL | 485 | 8 | 3 | 8 | 4.7 | CC(C)C[C@H](CO)Nc1nc(SCc2ccc(Br)cc2F)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625020 | 88400 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 234 | 2 | ChEMBL | 417 | 8 | 2 | 9 | 4.0 | COC(=O)[C@@H](CC(C)C)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349303 | 88400 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 234 | 2 | ChEMBL | 417 | 8 | 2 | 9 | 4.0 | COC(=O)[C@@H](CC(C)C)Nc1nc(SCc2ccccc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625502 | 88406 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | 10 | 2 | ChEMBL | 390 | 8 | 3 | 9 | 3.2 | CC(C)C[C@H](CO)Nc1nc(SCc2ccncc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349309 | 88406 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | 10 | 2 | ChEMBL | 390 | 8 | 3 | 9 | 3.2 | CC(C)C[C@H](CO)Nc1nc(SCc2ccncc2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71624891 | 88398 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 437 | 9 | 3 | 8 | 4.8 | CC(C)C[C@H](CCO)Nc1nc(SCc2ccccc2Cl)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349301 | 88398 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 437 | 9 | 3 | 8 | 4.8 | CC(C)C[C@H](CCO)Nc1nc(SCc2ccccc2Cl)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 58230406 | 88427 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 21 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 3.7 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(C#N)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| CHEMBL2349329 | 88427 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 21 | 2 | ChEMBL | 414 | 8 | 3 | 9 | 3.7 | CC(C)C[C@H](CO)Nc1nc(SCc2cccc(C#N)c2)nc2nc(N)sc12 | 10.1021/jm3012273 | |||
| 71625275 | 88425 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 5 | 2 | ChEMBL | 419 | 9 | 3 | 9 | 3.8 | COc1ccccc1CSc1nc(N[C@@H](CO)CC(C)C)c2sc(N)nc2n1 | 10.1021/jm3012273 | |||
| CHEMBL2349327 | 88425 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 5 | 2 | ChEMBL | 419 | 9 | 3 | 9 | 3.8 | COc1ccccc1CSc1nc(N[C@@H](CO)CC(C)C)c2sc(N)nc2n1 | 10.1021/jm3012273 | |||