Assay Detail
ADMET
CHEMBL970953
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Inhibition of human liver microsome CYP3A4 in assessed as [14C]formaldehyde formation
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Tissue | Liver |
| Subcellular | Microsome |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Potent CYP3A4 inhibitory constituents of Piper cubeba.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 21 | 5.17 | 6.36 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL480295 | ETHOXYCLUSIN | — | 1 | 6.36 |
| CHEMBL157101 | KETOCONAZOLE | 4.0 | 1 | 6.14 |
| CHEMBL469916 | — | — | 1 | 6.10 |
| CHEMBL482233 | — | — | 1 | 6.08 |
| CHEMBL479701 | — | — | 1 | 6.08 |
| CHEMBL471067 | — | — | 1 | 6.00 |
| CHEMBL469917 | — | — | 1 | 5.96 |
| CHEMBL482034 | — | — | 1 | 5.13 |
| CHEMBL520915 | — | — | 1 | 5.11 |
| CHEMBL242011 | HINOKININ | — | 1 | 5.10 |
| CHEMBL501260 | — | — | 1 | 5.06 |
| CHEMBL399831 | — | — | 1 | 5.04 |
| CHEMBL486597 | DIHYDROCUBEBIN | — | 1 | 5.02 |
| CHEMBL513023 | MEDIORESINOL | — | 1 | 4.86 |
| CHEMBL479314 | — | — | 1 | 4.83 |
| CHEMBL480296 | — | — | 1 | 4.82 |
| CHEMBL481233 | — | — | 1 | 4.54 |
| CHEMBL450829 | — | — | 1 | 4.13 |
| CHEMBL156339 | MAGNOSALIN | — | 1 | 4.07 |
| CHEMBL333306 | TRANS-ASARONE | — | 1 | 4.04 |
| CHEMBL501119 | — | — | 1 | 4.01 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL480295 | ETHOXYCLUSIN | IC50 | = | 440.0 | nM | 6.36 |
| CHEMBL157101 | KETOCONAZOLE | IC50 | = | 720.0 | nM | 6.14 |
| CHEMBL469916 | — | IC50 | = | 800.0 | nM | 6.10 |
| CHEMBL482233 | — | IC50 | = | 830.0 | nM | 6.08 |
| CHEMBL479701 | — | IC50 | = | 830.0 | nM | 6.08 |
| CHEMBL471067 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL469917 | — | IC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL482034 | — | IC50 | = | 7400.0 | nM | 5.13 |
| CHEMBL520915 | — | IC50 | = | 7700.0 | nM | 5.11 |
| CHEMBL242011 | HINOKININ | IC50 | = | 8000.0 | nM | 5.10 |
| CHEMBL501260 | — | IC50 | = | 8800.0 | nM | 5.06 |
| CHEMBL399831 | — | IC50 | = | 9100.0 | nM | 5.04 |
| CHEMBL486597 | DIHYDROCUBEBIN | IC50 | = | 9500.0 | nM | 5.02 |
| CHEMBL513023 | MEDIORESINOL | IC50 | = | 13700.0 | nM | 4.86 |
| CHEMBL479314 | — | IC50 | = | 14900.0 | nM | 4.83 |
| CHEMBL480296 | — | IC50 | = | 15000.0 | nM | 4.82 |
| CHEMBL481233 | — | IC50 | = | 28700.0 | nM | 4.54 |
| CHEMBL450829 | — | IC50 | = | 74000.0 | nM | 4.13 |
| CHEMBL156339 | MAGNOSALIN | IC50 | = | 85400.0 | nM | 4.07 |
| CHEMBL333306 | TRANS-ASARONE | IC50 | = | 92300.0 | nM | 4.04 |
| CHEMBL501119 | — | IC50 | = | 98200.0 | nM | 4.01 |