Assay Detail
Binding
CHEMBL757060
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Binding affinity against mu-opiate receptor (human) using [3H]DAMGO radioligand
46
Total Activities
46
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Expert |
Publication
From hit to lead. Combining two complementary methods for focused library design. Application to mu opiate ligands.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 46 | 7.25 | 9.05 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL115222 | — | — | 1 | 9.05 |
| CHEMBL2096625 | — | — | 1 | 9.00 |
| CHEMBL895 | NALBUPHINE | 4.0 | 1 | 9.00 |
| CHEMBL114379 | — | — | 1 | 8.92 |
| CHEMBL596 | FENTANYL | 4.0 | 1 | 8.89 |
| CHEMBL324297 | — | — | 1 | 8.82 |
| CHEMBL1707 | LOPERAMIDE HYDROCHLORIDE | 4.0 | 1 | 8.82 |
| CHEMBL2368861 | BUPRENORPHINE HYDROCHLORIDE | 4.0 | 1 | 8.77 |
| CHEMBL80 | NALOXONE | 4.0 | 1 | 8.70 |
| CHEMBL115652 | — | — | 1 | 8.70 |
| CHEMBL420863 | — | — | 1 | 8.62 |
| CHEMBL651 | METHADONE | 4.0 | 1 | 8.39 |
| CHEMBL325842 | — | — | 1 | 8.20 |
| CHEMBL112191 | — | — | 1 | 7.80 |
| CHEMBL326962 | — | — | 1 | 7.78 |
| CHEMBL115229 | — | — | 1 | 7.71 |
| CHEMBL325750 | — | — | 1 | 7.60 |
| CHEMBL115280 | — | — | 1 | 7.08 |
| CHEMBL115444 | — | — | 1 | 6.83 |
| CHEMBL114825 | — | — | 1 | 6.75 |
| CHEMBL114280 | — | — | 1 | 6.63 |
| CHEMBL607 | MEPERIDINE | 4.0 | 1 | 6.50 |
| CHEMBL369475 | CODEINE MONOHYDRATE | — | 1 | 6.28 |
| CHEMBL111918 | — | — | 1 | 6.13 |
| CHEMBL332697 | — | — | 1 | 6.02 |
| CHEMBL115549 | — | — | 1 | 5.98 |
| CHEMBL326320 | — | — | 1 | 5.91 |
| CHEMBL325674 | — | — | 1 | 5.83 |
| CHEMBL115076 | — | — | 1 | 5.76 |
| CHEMBL420500 | — | — | 1 | 5.64 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL115222 | — | IC50 | = | 0.9 | nM | 9.05 |
| CHEMBL2096625 | — | IC50 | = | 1.0 | nM | 9.00 |
| CHEMBL895 | NALBUPHINE | IC50 | = | 1.0 | nM | 9.00 |
| CHEMBL114379 | — | IC50 | = | 1.2 | nM | 8.92 |
| CHEMBL596 | FENTANYL | IC50 | = | 1.3 | nM | 8.89 |
| CHEMBL324297 | — | IC50 | = | 1.5 | nM | 8.82 |
| CHEMBL1707 | LOPERAMIDE HYDROCHLORIDE | IC50 | = | 1.5 | nM | 8.82 |
| CHEMBL2368861 | BUPRENORPHINE HYDROCHLORIDE | IC50 | = | 1.7 | nM | 8.77 |
| CHEMBL80 | NALOXONE | IC50 | = | 2.0 | nM | 8.70 |
| CHEMBL115652 | — | IC50 | = | 2.0 | nM | 8.70 |
| CHEMBL420863 | — | IC50 | = | 2.4 | nM | 8.62 |
| CHEMBL651 | METHADONE | IC50 | = | 4.1 | nM | 8.39 |
| CHEMBL325842 | — | IC50 | = | 6.3 | nM | 8.20 |
| CHEMBL112191 | — | IC50 | = | 16.0 | nM | 7.80 |
| CHEMBL326962 | — | IC50 | = | 16.7 | nM | 7.78 |
| CHEMBL115229 | — | IC50 | = | 19.3 | nM | 7.71 |
| CHEMBL325750 | — | IC50 | = | 24.9 | nM | 7.60 |
| CHEMBL115280 | — | IC50 | = | 83.5 | nM | 7.08 |
| CHEMBL115444 | — | IC50 | = | 147.0 | nM | 6.83 |
| CHEMBL114825 | — | IC50 | = | 179.0 | nM | 6.75 |
| CHEMBL114280 | — | IC50 | = | 235.0 | nM | 6.63 |
| CHEMBL607 | MEPERIDINE | IC50 | = | 315.0 | nM | 6.50 |
| CHEMBL369475 | CODEINE MONOHYDRATE | IC50 | = | 520.0 | nM | 6.28 |
| CHEMBL111918 | — | IC50 | = | 735.0 | nM | 6.13 |
| CHEMBL332697 | — | IC50 | = | 960.0 | nM | 6.02 |
| CHEMBL115549 | — | IC50 | = | 1050.0 | nM | 5.98 |
| CHEMBL326320 | — | IC50 | = | 1235.0 | nM | 5.91 |
| CHEMBL325674 | — | IC50 | = | 1470.0 | nM | 5.83 |
| CHEMBL115076 | — | IC50 | = | 1730.0 | nM | 5.76 |
| CHEMBL420500 | — | IC50 | = | 2285.0 | nM | 5.64 |
| CHEMBL325697 | — | IC50 | = | 2285.0 | nM | 5.64 |
| CHEMBL333843 | — | IC50 | = | 2480.0 | nM | 5.61 |
| CHEMBL115284 | — | IC50 | = | 2590.0 | nM | 5.59 |
| CHEMBL419214 | — | IC50 | = | 2890.0 | nM | 5.54 |
| CHEMBL324479 | — | IC50 | = | 4955.0 | nM | 5.30 |
| CHEMBL114327 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL324170 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL324257 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL326538 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL324471 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL325874 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL114204 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL113811 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL114940 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL114824 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL324142 | — | IC50 | > | 10000.0 | nM | - |