Assay Detail
ADMET
CHEMBL1780345
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Inhibition of CYP1A1 EROD activity assessed as inhibition of deethylation of 7-ethoxyresorufin to resorufin
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Comparative CYP1A1 and CYP1B1 substrate and inhibitor profile of dietary flavonoids.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 14 | 6.46 | 7.38 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL117 | CHRYSIN | — | 1 | 7.38 |
| CHEMBL243664 | ACACETIN | — | 1 | 7.35 |
| CHEMBL90568 | DIOSMETIN | — | 1 | 7.05 |
| CHEMBL487402 | EUPATORIN | — | 1 | 6.68 |
| CHEMBL164 | MYRICETIN | — | 1 | 6.43 |
| CHEMBL28 | APIGENIN | — | 1 | 6.41 |
| CHEMBL124885 | — | — | 1 | 6.20 |
| CHEMBL50 | QUERCETIN | 3.0 | 1 | 6.18 |
| CHEMBL150 | KAEMPFEROL | 1.0 | 1 | 6.12 |
| CHEMBL151 | LUTEOLIN | 2.0 | 1 | 6.05 |
| CHEMBL8260 | BAICALEIN | 2.0 | 1 | 5.91 |
| CHEMBL55415 | SCUTELLAREIN | — | 1 | 5.79 |
| CHEMBL210635 | GENKWANIN | — | 1 | - |
| CHEMBL72637 | CIRSILIOL | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL117 | CHRYSIN | Ki | = | 42.0 | nM | 7.38 |
| CHEMBL243664 | ACACETIN | Ki | = | 45.0 | nM | 7.35 |
| CHEMBL90568 | DIOSMETIN | Ki | = | 89.0 | nM | 7.05 |
| CHEMBL487402 | EUPATORIN | Ki | = | 210.0 | nM | 6.68 |
| CHEMBL164 | MYRICETIN | Ki | = | 370.0 | nM | 6.43 |
| CHEMBL28 | APIGENIN | Ki | = | 390.0 | nM | 6.41 |
| CHEMBL124885 | — | Ki | = | 630.0 | nM | 6.20 |
| CHEMBL50 | QUERCETIN | Ki | = | 660.0 | nM | 6.18 |
| CHEMBL150 | KAEMPFEROL | Ki | = | 750.0 | nM | 6.12 |
| CHEMBL151 | LUTEOLIN | Ki | = | 890.0 | nM | 6.05 |
| CHEMBL8260 | BAICALEIN | Ki | = | 1220.0 | nM | 5.91 |
| CHEMBL55415 | SCUTELLAREIN | Ki | = | 1640.0 | nM | 5.79 |
| CHEMBL210635 | GENKWANIN | Ki | > | 2340.0 | nM | - |
| CHEMBL72637 | CIRSILIOL | Ki | > | 800.0 | nM | - |