Assay Detail
ADMET
CHEMBL4156816
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human CYP3A4
34
Total Activities
34
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Design, Synthesis, and Pharmacological Evaluation of Second-Generation Tetrahydroisoquinoline-Based CXCR4 Antagonists with Favorable ADME Properties.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 34 | 5.50 | 5.85 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4169504 | — | — | 1 | 5.85 |
| CHEMBL4176285 | — | — | 1 | 5.75 |
| CHEMBL4161949 | — | — | 1 | 5.66 |
| CHEMBL4169875 | — | — | 1 | 5.50 |
| CHEMBL4167145 | — | — | 1 | 5.47 |
| CHEMBL4167324 | — | — | 1 | 5.37 |
| CHEMBL4168418 | — | — | 1 | 5.25 |
| CHEMBL4159234 | — | — | 1 | 5.17 |
| CHEMBL4164970 | — | — | 1 | - |
| CHEMBL4165854 | — | — | 1 | - |
| CHEMBL3091687 | — | — | 1 | - |
| CHEMBL4163467 | — | — | 1 | - |
| CHEMBL4171365 | — | — | 1 | - |
| CHEMBL4176701 | — | — | 1 | - |
| CHEMBL4166081 | — | — | 1 | - |
| CHEMBL4161589 | — | — | 1 | - |
| CHEMBL4176403 | — | — | 1 | - |
| CHEMBL4172898 | — | — | 1 | - |
| CHEMBL4173777 | — | — | 1 | - |
| CHEMBL4177338 | — | — | 1 | - |
| CHEMBL4166059 | — | — | 1 | - |
| CHEMBL4173977 | — | — | 1 | - |
| CHEMBL4162609 | — | — | 1 | - |
| CHEMBL4170542 | — | — | 1 | - |
| CHEMBL4175201 | — | — | 1 | - |
| CHEMBL4171755 | — | — | 1 | - |
| CHEMBL4163874 | — | — | 1 | - |
| CHEMBL4168391 | — | — | 1 | - |
| CHEMBL4175596 | — | — | 1 | - |
| CHEMBL4160496 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4169504 | — | IC50 | = | 1420.0 | nM | 5.85 |
| CHEMBL4176285 | — | IC50 | = | 1780.0 | nM | 5.75 |
| CHEMBL4161949 | — | IC50 | = | 2210.0 | nM | 5.66 |
| CHEMBL4169875 | — | IC50 | = | 3160.0 | nM | 5.50 |
| CHEMBL4167145 | — | IC50 | = | 3350.0 | nM | 5.47 |
| CHEMBL4167324 | — | IC50 | = | 4230.0 | nM | 5.37 |
| CHEMBL4168418 | — | IC50 | = | 5620.0 | nM | 5.25 |
| CHEMBL4159234 | — | IC50 | = | 6790.0 | nM | 5.17 |
| CHEMBL4163467 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4172669 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4171365 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4176701 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4166081 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4161589 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4176403 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4172898 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4173777 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4165854 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4177130 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4169280 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4162011 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL3091687 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4164970 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4177338 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4166059 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4173977 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4162609 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4170542 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4175201 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4171755 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4163874 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4168391 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4175596 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4160496 | — | IC50 | > | 20000.0 | nM | - |