Assay Detail
ADMET
CHEMBL1743432
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Mechanism based inhibition of human cytochrome P450 3A4 measured by (14C)formaldehyde production from (N-methyl-14C)-erythromycin
10
Total Activities
5
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Expert |
Publication
Cytochrome p450 enzymes mechanism based inhibitors: common sub-structures and reactivity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 5 | 6.88 | 7.27 |
| Kinact | 5 | - | - |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL469916 | — | — | 2 | 7.27 |
| CHEMBL479701 | — | — | 2 | 7.09 |
| CHEMBL486597 | DIHYDROCUBEBIN | — | 2 | 6.85 |
| CHEMBL471067 | — | — | 2 | 6.75 |
| CHEMBL242011 | HINOKININ | — | 2 | 6.43 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL469916 | — | Ki | = | 54.0 | nM | 7.27 |
| CHEMBL479701 | — | Ki | = | 82.0 | nM | 7.09 |
| CHEMBL486597 | DIHYDROCUBEBIN | Ki | = | 142.0 | nM | 6.85 |
| CHEMBL471067 | — | Ki | = | 177.0 | nM | 6.75 |
| CHEMBL242011 | HINOKININ | Ki | = | 373.0 | nM | 6.43 |
| CHEMBL479701 | — | Kinact | = | 0.253 | min-1 | - |
| CHEMBL469916 | — | Kinact | = | 0.31 | min-1 | - |
| CHEMBL486597 | DIHYDROCUBEBIN | Kinact | = | 0.225 | min-1 | - |
| CHEMBL242011 | HINOKININ | Kinact | = | 0.315 | min-1 | - |
| CHEMBL471067 | — | Kinact | = | 0.32 | min-1 | - |