Assay Detail
Binding
CHEMBL1909138
Review assay metadata, readout intent, target linkage, and publication context from the same page.
DRUGMATRIX: CYP450, 3A4 enzyme inhibition (substrate: 7-Benzyloxy-4-(trifluoromethyl)-coumarin)
1742
Total Activities
871
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Cell Type | BTI-TN-5B1-4 |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
DrugMatrix in vitro pharmacology data
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 871 | 6.13 | 7.80 |
| Ki | 871 | - | - |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL157101 | KETOCONAZOLE | 4.0 | 2 | 7.80 |
| CHEMBL163 | RITONAVIR | 4.0 | 2 | 7.80 |
| CHEMBL104 | CLOTRIMAZOLE | 4.0 | 2 | 7.80 |
| CHEMBL808 | ECONAZOLE | 4.0 | 2 | 7.30 |
| CHEMBL1221 | SULCONAZOLE | 4.0 | 2 | 7.16 |
| CHEMBL1262 | OXICONAZOLE | 4.0 | 2 | 7.05 |
| CHEMBL91 | MICONAZOLE | 4.0 | 2 | 7.00 |
| CHEMBL1729 | CISAPRIDE | 4.0 | 2 | 6.52 |
| CHEMBL5483011 | INDINAVIR | 3.0 | 2 | 6.40 |
| CHEMBL1385840 | ERGOCORNINE | — | 2 | 6.30 |
| CHEMBL1403281 | ERGOCRYPTINE | — | 2 | 6.22 |
| CHEMBL61 | PODOFILOX | 4.0 | 2 | 6.22 |
| CHEMBL165 | RESVERATROL | 3.0 | 2 | 6.22 |
| CHEMBL60889 | MOSAPRIDE | 3.0 | 2 | 6.16 |
| CHEMBL934 | METYRAPONE | 4.0 | 2 | 6.10 |
| CHEMBL456807 | PHENYLHYDRAZINE | — | 2 | 6.05 |
| CHEMBL460291 | LACIDIPINE | 3.0 | 2 | 6.05 |
| CHEMBL64391 | ITRACONAZOLE | 4.0 | 2 | 6.05 |
| CHEMBL116 | AMPRENAVIR | 4.0 | 2 | 6.00 |
| CHEMBL442 | ERGOTAMINE | 4.0 | 2 | 6.00 |
| CHEMBL553025 | VINORELBINE | 4.0 | 2 | 6.00 |
| CHEMBL269732 | TACROLIMUS ANHYDROUS | 4.0 | 2 | 6.00 |
| CHEMBL115769 | — | — | 2 | 6.00 |
| CHEMBL84 | TOPOTECAN | 4.0 | 2 | 5.82 |
| CHEMBL23 | DILTIAZEM | 4.0 | 2 | 5.74 |
| CHEMBL493 | BROMOCRIPTINE | 4.0 | 2 | 5.70 |
| CHEMBL3545252 | DOCETAXEL | 4.0 | 2 | 5.70 |
| CHEMBL1089 | PHENELZINE | 4.0 | 2 | 5.70 |
| CHEMBL584 | NELFINAVIR | 4.0 | 2 | 5.70 |
| CHEMBL413 | SIROLIMUS | 4.0 | 2 | 5.70 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL104 | CLOTRIMAZOLE | IC50 | = | 16.0 | nM | 7.80 |
| CHEMBL163 | RITONAVIR | IC50 | = | 16.0 | nM | 7.80 |
| CHEMBL157101 | KETOCONAZOLE | IC50 | = | 16.0 | nM | 7.80 |
| CHEMBL808 | ECONAZOLE | IC50 | = | 50.0 | nM | 7.30 |
| CHEMBL1221 | SULCONAZOLE | IC50 | = | 70.0 | nM | 7.16 |
| CHEMBL1262 | OXICONAZOLE | IC50 | = | 90.0 | nM | 7.05 |
| CHEMBL91 | MICONAZOLE | IC50 | = | 100.0 | nM | 7.00 |
| CHEMBL1729 | CISAPRIDE | IC50 | = | 300.0 | nM | 6.52 |
| CHEMBL5483011 | INDINAVIR | IC50 | = | 400.0 | nM | 6.40 |
| CHEMBL1385840 | ERGOCORNINE | IC50 | = | 500.0 | nM | 6.30 |
| CHEMBL165 | RESVERATROL | IC50 | = | 600.0 | nM | 6.22 |
| CHEMBL61 | PODOFILOX | IC50 | = | 600.0 | nM | 6.22 |
| CHEMBL1403281 | ERGOCRYPTINE | IC50 | = | 600.0 | nM | 6.22 |
| CHEMBL60889 | MOSAPRIDE | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL934 | METYRAPONE | IC50 | = | 800.0 | nM | 6.10 |
| CHEMBL460291 | LACIDIPINE | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL64391 | ITRACONAZOLE | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL456807 | PHENYLHYDRAZINE | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL269732 | TACROLIMUS ANHYDROUS | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL115769 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL553025 | VINORELBINE | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL116 | AMPRENAVIR | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL442 | ERGOTAMINE | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL84 | TOPOTECAN | IC50 | = | 1521.1 | nM | 5.82 |
| CHEMBL23 | DILTIAZEM | IC50 | = | 1836.6 | nM | 5.74 |
| CHEMBL3545252 | DOCETAXEL | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL493 | BROMOCRIPTINE | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL413 | SIROLIMUS | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL1089 | PHENELZINE | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL584 | NELFINAVIR | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL1255837 | DIHYDROERGOCRISTINE MESYLATE | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL1221512 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL64894 | GENTIAN VIOLET | IC50 | = | 3633.7 | nM | 5.44 |
| CHEMBL21731 | MAPROTILINE | IC50 | = | 4322.0 | nM | 5.36 |
| CHEMBL12131 | CLOSANTEL | IC50 | = | 5000.0 | nM | 5.30 |
| CHEMBL1732 | DIHYDROERGOTAMINE | IC50 | = | 5000.0 | nM | 5.30 |
| CHEMBL252556 | IDEBENONE | IC50 | = | 7000.0 | nM | 5.16 |
| CHEMBL1016 | CANDESARTAN | IC50 | = | 9000.0 | nM | 5.05 |
| CHEMBL1201151 | MESTRANOL | IC50 | - | — | - | |
| CHEMBL1201139 | MEGESTROL ACETATE | Ki | - | — | - | |
| CHEMBL80 | NALOXONE | Ki | - | — | - | |
| CHEMBL1201139 | MEGESTROL ACETATE | IC50 | - | — | - | |
| CHEMBL1354199 | METHSCOPOLAMINE BROMIDE | Ki | - | — | - | |
| CHEMBL1237 | LISINOPRIL ANHYDROUS | IC50 | - | — | - | |
| CHEMBL86 | METOCLOPRAMIDE | IC50 | - | — | - | |
| CHEMBL86 | METOCLOPRAMIDE | Ki | - | — | - | |
| CHEMBL1201193 | LEVOBUPIVACAINE | Ki | - | — | - | |
| CHEMBL6437 | MIANSERIN | IC50 | - | — | - | |
| CHEMBL6437 | MIANSERIN | Ki | - | — | - | |
| CHEMBL1237 | LISINOPRIL ANHYDROUS | Ki | - | — | - |