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 |
| 10169886 | 174977 | 28 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 872 | 26 | 14 | 12 | -2.3 | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](C)C(=O)O | 10.1021/acs.jmedchem.9b01780 | ||
| CHEMBL4578721 | 174977 | 28 | None | - | 1 | Human | 9.5 | pIC50 | = | 9.5 | Functional | ChEMBL | 872 | 26 | 14 | 12 | -2.3 | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](C)C(=O)O | 10.1021/acs.jmedchem.9b01780 | ||
| 5579 | 525 | 43 | None | 2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 580 | 11 | 2 | 8 | 5.4 | CCNC(=O)NS(=O)(=O)c1sc(cc1c1ccc(cc1)Cn1c(nc(c1C=O)OC)c1ccccc1)CC(C)C | 10.1021/acs.jmedchem.9b01780 | ||
| 9851724 | 525 | 43 | None | 2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 580 | 11 | 2 | 8 | 5.4 | CCNC(=O)NS(=O)(=O)c1sc(cc1c1ccc(cc1)Cn1c(nc(c1C=O)OC)c1ccccc1)CC(C)C | 10.1021/acs.jmedchem.9b01780 | ||
| CHEMBL4303593 | 525 | 43 | None | 2 | 2 | Human | 7.7 | pIC50 | = | 7.7 | Functional | ChEMBL | 580 | 11 | 2 | 8 | 5.4 | CCNC(=O)NS(=O)(=O)c1sc(cc1c1ccc(cc1)Cn1c(nc(c1C=O)OC)c1ccccc1)CC(C)C | 10.1021/acs.jmedchem.9b01780 | ||
| 155817498 | 2431 | 0 | None | - | 1 | Rat | 4.4 | pEC50 | = | 4.4 | Functional | Guide to Pharmacology | None | None | None | None | 16336942 | ||||
| 7038 | 2431 | 0 | None | - | 1 | Rat | 4.4 | pEC50 | = | 4.4 | Functional | Guide to Pharmacology | None | None | None | None | 16336942 | ||||
| 155817499 | 875 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | Guide to Pharmacology | None | None | None | None | 18854305 | ||||
| 155817499 | 875 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | Guide to Pharmacology | None | None | None | None | 20479330 | ||||
| 7040 | 875 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | Guide to Pharmacology | None | None | None | None | 18854305 | ||||
| 7040 | 875 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | Guide to Pharmacology | None | None | None | None | 20479330 | ||||
| 155817500 | 874 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 18854305 | ||||
| 155817500 | 874 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 20479330 | ||||
| 7041 | 874 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 18854305 | ||||
| 7041 | 874 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | Guide to Pharmacology | None | None | None | None | 20479330 | ||||
| 7039 | 450 | 0 | None | -1 | 2 | Rat | 6.3 | pEC50 | = | 6.3 | Functional | Guide to Pharmacology | 555 | 8 | 0 | 8 | 3.4 | COc1cc(ccc1S(=O)(=O)N1CC(C(C1)c1cccc(c1)F)CN1CCN(CC1)c1ccccn1)[N+](=O)[O-] | 22003054 | ||
| 89560738 | 450 | 0 | None | -1 | 2 | Rat | 6.3 | pEC50 | = | 6.3 | Functional | Guide to Pharmacology | 555 | 8 | 0 | 8 | 3.4 | COc1cc(ccc1S(=O)(=O)N1CC(C(C1)c1cccc(c1)F)CN1CCN(CC1)c1ccccn1)[N+](=O)[O-] | 22003054 | ||
| 7039 | 450 | 0 | None | 1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | Guide to Pharmacology | 555 | 8 | 0 | 8 | 3.4 | COc1cc(ccc1S(=O)(=O)N1CC(C(C1)c1cccc(c1)F)CN1CCN(CC1)c1ccccn1)[N+](=O)[O-] | 22003054 | ||
| 89560738 | 450 | 0 | None | 1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | Guide to Pharmacology | 555 | 8 | 0 | 8 | 3.4 | COc1cc(ccc1S(=O)(=O)N1CC(C(C1)c1cccc(c1)F)CN1CCN(CC1)c1ccccn1)[N+](=O)[O-] | 22003054 | ||
| 123797 | 2751 | 23 | None | -10 | 3 | Mouse | 6.4 | pEC50 | = | 6.4 | Functional | Guide to Pharmacology | None | None | None | None | 11551509 | ||||
| 1479 | 2751 | 23 | None | -10 | 3 | Mouse | 6.4 | pEC50 | = | 6.4 | Functional | Guide to Pharmacology | None | None | None | None | 11551509 | ||||
| CHEMBL429731 | 2751 | 23 | None | -10 | 3 | Mouse | 6.4 | pEC50 | = | 6.4 | Functional | Guide to Pharmacology | None | None | None | None | 11551509 | ||||
| 11279 | 449 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | Guide to Pharmacology | 572 | 8 | 0 | 7 | 4.1 | COc1cc(ccc1S(=O)(=O)N1CC(C(C1)c1cccc(c1)F)CN1CCN(CC1)c1ccc(cc1)F)[N+](=O)[O-] | 29928987 | ||
| 154733032 | 449 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | Guide to Pharmacology | 572 | 8 | 0 | 7 | 4.1 | COc1cc(ccc1S(=O)(=O)N1CC(C(C1)c1cccc(c1)F)CN1CCN(CC1)c1ccc(cc1)F)[N+](=O)[O-] | 29928987 | ||
| 11280 | 452 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | Guide to Pharmacology | 480 | 3 | 0 | 2 | 6.2 | Fc1cccc(c1C(=O)N1CC2(c3c1ccc(c3)C(C)(C)C)CCN(CC2)CCC(F)(F)F)F | 29928987 | ||
| 15983171 | 452 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | Guide to Pharmacology | 480 | 3 | 0 | 2 | 6.2 | Fc1cccc(c1C(=O)N1CC2(c3c1ccc(c3)C(C)(C)C)CCN(CC2)CCC(F)(F)F)F | 29928987 | ||
| 59004159 | 451 | 0 | None | -1 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 416 | 4 | 0 | 2 | 5.2 | C=CCCN1CCC2(CC1)CN(c1c2cc(Cl)cc1)C(=O)c1c(F)cccc1F | 22003054 | ||
| 7042 | 451 | 0 | None | -1 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | 416 | 4 | 0 | 2 | 5.2 | C=CCCN1CCC2(CC1)CN(c1c2cc(Cl)cc1)C(=O)c1c(F)cccc1F | 22003054 | ||
| 7043 | 453 | 0 | None | -1 | 2 | Rat | 6.5 | pIC50 | = | 6.5 | Functional | Guide to Pharmacology | None | None | None | None | 22003054 | ||||
| 59004159 | 451 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | Guide to Pharmacology | 416 | 4 | 0 | 2 | 5.2 | C=CCCN1CCC2(CC1)CN(c1c2cc(Cl)cc1)C(=O)c1c(F)cccc1F | 22003054 | ||
| 7042 | 451 | 0 | None | 1 | 2 | Human | 6.7 | pIC50 | = | 6.7 | Functional | Guide to Pharmacology | 416 | 4 | 0 | 2 | 5.2 | C=CCCN1CCC2(CC1)CN(c1c2cc(Cl)cc1)C(=O)c1c(F)cccc1F | 22003054 | ||
| 7043 | 453 | 0 | None | 1 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Functional | Guide to Pharmacology | None | None | None | None | 22003054 | ||||
| 5579 | 525 | 43 | None | -2 | 2 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | Guide to Pharmacology | 580 | 11 | 2 | 8 | 5.4 | CCNC(=O)NS(=O)(=O)c1sc(cc1c1ccc(cc1)Cn1c(nc(c1C=O)OC)c1ccccc1)CC(C)C | 15326087 | ||
| 9851724 | 525 | 43 | None | -2 | 2 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | Guide to Pharmacology | 580 | 11 | 2 | 8 | 5.4 | CCNC(=O)NS(=O)(=O)c1sc(cc1c1ccc(cc1)Cn1c(nc(c1C=O)OC)c1ccccc1)CC(C)C | 15326087 | ||
| CHEMBL4303593 | 525 | 43 | None | -2 | 2 | Mouse | 7.3 | pIC50 | = | 7.3 | Functional | Guide to Pharmacology | 580 | 11 | 2 | 8 | 5.4 | CCNC(=O)NS(=O)(=O)c1sc(cc1c1ccc(cc1)Cn1c(nc(c1C=O)OC)c1ccccc1)CC(C)C | 15326087 | ||
| 123805 | 413 | 0 | None | 35 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 46878481 | 413 | 0 | None | 35 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 5578 | 413 | 0 | None | 35 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 582 | 413 | 0 | None | 35 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| CHEMBL3545347 | 413 | 0 | None | 35 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| DB11720 | 413 | 0 | None | 35 | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Functional | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 6081 | 1284 | 0 | None | - | 1 | Mouse | 9.5 | pIC50 | = | 9.5 | Functional | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 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 |
| 123805 | 413 | 0 | None | - | 1 | Mouse | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 46878481 | 413 | 0 | None | - | 1 | Mouse | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 5578 | 413 | 0 | None | - | 1 | Mouse | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 582 | 413 | 0 | None | - | 1 | Mouse | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| CHEMBL3545347 | 413 | 0 | None | - | 1 | Mouse | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| DB11720 | 413 | 0 | None | - | 1 | Mouse | 9.1 | pKd | = | 9.1 | Binding | Guide to Pharmacology | None | None | None | None | 12829792 | ||||
| 123805 | 413 | 0 | None | - | 1 | Mouse | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 21670420 | ||||
| 46878481 | 413 | 0 | None | - | 1 | Mouse | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 21670420 | ||||
| 5578 | 413 | 0 | None | - | 1 | Mouse | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 21670420 | ||||
| 582 | 413 | 0 | None | - | 1 | Mouse | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 21670420 | ||||
| CHEMBL3545347 | 413 | 0 | None | - | 1 | Mouse | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 21670420 | ||||
| DB11720 | 413 | 0 | None | - | 1 | Mouse | 7.3 | pKi | = | 7.3 | Binding | Guide to Pharmacology | None | None | None | None | 21670420 | ||||
| 6081 | 1284 | 0 | None | - | 1 | Mouse | 8.3 | pKi | = | 8.3 | Binding | Guide to Pharmacology | None | None | None | None | 21670420 | ||||