Assay Detail
Binding
CHEMBL5622150
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Inhibition of human recombinant CYP1B1 assessed as fluorescence of resorufin
29
Total Activities
29
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Discovery of 4'-trifluoromethylchalcones as novel, potent and selective hCYP1B1 inhibitors without concomitant AhR activation.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 29 | 7.44 | 8.73 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL283196 | ALPHA-NAPHTHOFLAVONE | — | 1 | 8.73 |
| CHEMBL5624912 | — | — | 1 | 8.45 |
| CHEMBL58557 | — | — | 1 | 8.33 |
| CHEMBL5631026 | — | — | 1 | 8.19 |
| CHEMBL5630901 | — | — | 1 | 8.11 |
| CHEMBL5630146 | — | — | 1 | 8.00 |
| CHEMBL5414115 | — | — | 1 | 7.98 |
| CHEMBL5624595 | — | — | 1 | 7.96 |
| CHEMBL5631046 | — | — | 1 | 7.92 |
| CHEMBL5630137 | — | — | 1 | 7.86 |
| CHEMBL5630143 | — | — | 1 | 7.68 |
| CHEMBL5624509 | — | — | 1 | 7.62 |
| CHEMBL571956 | — | — | 1 | 7.58 |
| CHEMBL450678 | — | — | 1 | 7.51 |
| CHEMBL5625150 | — | — | 1 | 7.46 |
| CHEMBL5624463 | — | — | 1 | 7.45 |
| CHEMBL464697 | — | — | 1 | 7.44 |
| CHEMBL227561 | — | — | 1 | 7.37 |
| CHEMBL5631027 | — | — | 1 | 7.25 |
| CHEMBL5624485 | — | — | 1 | 7.21 |
| CHEMBL5630516 | — | — | 1 | 7.21 |
| CHEMBL5631062 | — | — | 1 | 7.13 |
| CHEMBL1375292 | — | — | 1 | 6.96 |
| CHEMBL34398 | 4'-METHOXYCHALCONE | — | 1 | 6.75 |
| CHEMBL5630778 | — | — | 1 | 6.71 |
| CHEMBL286151 | — | — | 1 | 6.55 |
| CHEMBL7976 | CHALCONE | — | 1 | 6.52 |
| CHEMBL463017 | — | — | 1 | 5.98 |
| CHEMBL276473 | 4'-HYDROXYCHALCONE | — | 1 | 5.95 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL283196 | ALPHA-NAPHTHOFLAVONE | IC50 | = | 1.88 | nM | 8.73 |
| CHEMBL5624912 | — | IC50 | = | 3.58 | nM | 8.45 |
| CHEMBL58557 | — | IC50 | = | 4.72 | nM | 8.33 |
| CHEMBL5631026 | — | IC50 | = | 6.53 | nM | 8.19 |
| CHEMBL5630901 | — | IC50 | = | 7.86 | nM | 8.11 |
| CHEMBL5630146 | — | IC50 | = | 10.05 | nM | 8.00 |
| CHEMBL5414115 | — | IC50 | = | 10.56 | nM | 7.98 |
| CHEMBL5624595 | — | IC50 | = | 11.1 | nM | 7.96 |
| CHEMBL5631046 | — | IC50 | = | 12.1 | nM | 7.92 |
| CHEMBL5630137 | — | IC50 | = | 13.86 | nM | 7.86 |
| CHEMBL5630143 | — | IC50 | = | 20.99 | nM | 7.68 |
| CHEMBL5624509 | — | IC50 | = | 23.81 | nM | 7.62 |
| CHEMBL571956 | — | IC50 | = | 26.16 | nM | 7.58 |
| CHEMBL450678 | — | IC50 | = | 31.0 | nM | 7.51 |
| CHEMBL5625150 | — | IC50 | = | 34.28 | nM | 7.46 |
| CHEMBL5624463 | — | IC50 | = | 35.33 | nM | 7.45 |
| CHEMBL464697 | — | IC50 | = | 36.0 | nM | 7.44 |
| CHEMBL227561 | — | IC50 | = | 43.0 | nM | 7.37 |
| CHEMBL5631027 | — | IC50 | = | 55.81 | nM | 7.25 |
| CHEMBL5624485 | — | IC50 | = | 61.67 | nM | 7.21 |
| CHEMBL5630516 | — | IC50 | = | 60.91 | nM | 7.21 |
| CHEMBL5631062 | — | IC50 | = | 73.36 | nM | 7.13 |
| CHEMBL1375292 | — | IC50 | = | 110.0 | nM | 6.96 |
| CHEMBL34398 | 4'-METHOXYCHALCONE | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL5630778 | — | IC50 | = | 196.5 | nM | 6.71 |
| CHEMBL286151 | — | IC50 | = | 280.0 | nM | 6.55 |
| CHEMBL7976 | CHALCONE | IC50 | = | 305.0 | nM | 6.52 |
| CHEMBL463017 | — | IC50 | = | 1058.0 | nM | 5.98 |
| CHEMBL276473 | 4'-HYDROXYCHALCONE | IC50 | = | 1130.0 | nM | 5.95 |