Assay Detail
ADMET
CHEMBL5037545
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Inhibition of CYP3A4 in human liver microsomes using ketoconazole as substrate incubated for 5 mins in presence of NADPH by LC-MS/MS analysis
19
Total Activities
19
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Tissue | Liver |
| Subcellular | Microsomes |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Structure-Guided Optimization Provides a Series of TTK Protein Inhibitors with Potent Antitumor Activity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 19 | 5.80 | 6.55 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4062218 | — | — | 1 | 6.55 |
| CHEMBL5093015 | — | — | 1 | 5.92 |
| CHEMBL5075313 | — | — | 1 | 5.72 |
| CHEMBL5081270 | — | — | 1 | 5.70 |
| CHEMBL5073101 | — | — | 1 | 5.51 |
| CHEMBL5079606 | — | — | 1 | 5.41 |
| CHEMBL4569626 | — | — | 1 | - |
| CHEMBL5086435 | — | — | 1 | - |
| CHEMBL5092826 | — | — | 1 | - |
| CHEMBL5091689 | — | — | 1 | - |
| CHEMBL5084062 | — | — | 1 | - |
| CHEMBL5085278 | — | — | 1 | - |
| CHEMBL5086022 | — | — | 1 | - |
| CHEMBL5087340 | — | — | 1 | - |
| CHEMBL5077627 | — | — | 1 | - |
| CHEMBL5081668 | — | — | 1 | - |
| CHEMBL5085182 | — | — | 1 | - |
| CHEMBL5085753 | — | — | 1 | - |
| CHEMBL5077668 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4062218 | — | IC50 | = | 280.0 | nM | 6.55 |
| CHEMBL5093015 | — | IC50 | = | 1200.0 | nM | 5.92 |
| CHEMBL5075313 | — | IC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL5081270 | — | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL5073101 | — | IC50 | = | 3100.0 | nM | 5.51 |
| CHEMBL5079606 | — | IC50 | = | 3900.0 | nM | 5.41 |
| CHEMBL4569626 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5086435 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5092826 | — | IC50 | - | — | - | |
| CHEMBL5091689 | — | IC50 | - | — | - | |
| CHEMBL5084062 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5085278 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5086022 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5087340 | — | IC50 | - | — | - | |
| CHEMBL5077627 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5081668 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5085182 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5085753 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL5077668 | — | IC50 | > | 5000.0 | nM | - |