Assay Detail
ADMET
CHEMBL4156813
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of recombinant human CYP2D6 expressed in insect cells microsomes using AMMC as substrate preincubated for 30 mins followed by NADP addition and measured after 45 mins by fluorescence analysis
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 | 4.95 | 6.50 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3091687 | — | — | 1 | 6.50 |
| CHEMBL4167145 | — | — | 1 | 6.29 |
| CHEMBL4169875 | — | — | 1 | 5.60 |
| CHEMBL4176285 | — | — | 1 | 5.24 |
| CHEMBL4167324 | — | — | 1 | 5.21 |
| CHEMBL4161949 | — | — | 1 | 5.19 |
| CHEMBL4171755 | — | — | 1 | 5.09 |
| CHEMBL4165854 | — | — | 1 | 5.07 |
| CHEMBL4168418 | — | — | 1 | 5.07 |
| CHEMBL4159234 | — | — | 1 | 4.96 |
| CHEMBL4177130 | — | — | 1 | 4.92 |
| CHEMBL4176403 | — | — | 1 | 4.85 |
| CHEMBL4171365 | — | — | 1 | 4.17 |
| CHEMBL4166081 | — | — | 1 | 4.00 |
| CHEMBL4169504 | — | — | 1 | 4.00 |
| CHEMBL4176701 | — | — | 1 | 4.00 |
| CHEMBL4161589 | — | — | 1 | 4.00 |
| CHEMBL4175596 | — | — | 1 | - |
| CHEMBL4170542 | — | — | 1 | - |
| CHEMBL4162609 | — | — | 1 | - |
| CHEMBL4173977 | — | — | 1 | - |
| CHEMBL4175201 | — | — | 1 | - |
| CHEMBL4166059 | — | — | 1 | - |
| CHEMBL4177338 | — | — | 1 | - |
| CHEMBL4163874 | — | — | 1 | - |
| CHEMBL4168391 | — | — | 1 | - |
| CHEMBL4160496 | — | — | 1 | - |
| CHEMBL4164970 | — | — | 1 | - |
| CHEMBL4163467 | — | — | 1 | - |
| CHEMBL4172898 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3091687 | — | IC50 | = | 320.0 | nM | 6.50 |
| CHEMBL4167145 | — | IC50 | = | 508.0 | nM | 6.29 |
| CHEMBL4169875 | — | IC50 | = | 2520.0 | nM | 5.60 |
| CHEMBL4176285 | — | IC50 | = | 5720.0 | nM | 5.24 |
| CHEMBL4167324 | — | IC50 | = | 6090.0 | nM | 5.21 |
| CHEMBL4161949 | — | IC50 | = | 6480.0 | nM | 5.19 |
| CHEMBL4171755 | — | IC50 | = | 8130.0 | nM | 5.09 |
| CHEMBL4165854 | — | IC50 | = | 8570.0 | nM | 5.07 |
| CHEMBL4168418 | — | IC50 | = | 8450.0 | nM | 5.07 |
| CHEMBL4159234 | — | IC50 | = | 11000.0 | nM | 4.96 |
| CHEMBL4177130 | — | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL4176403 | — | IC50 | = | 14200.0 | nM | 4.85 |
| CHEMBL4171365 | — | IC50 | = | 67800.0 | nM | 4.17 |
| CHEMBL4161589 | — | IC50 | = | 100000.0 | nM | 4.00 |
| CHEMBL4176701 | — | IC50 | = | 100000.0 | nM | 4.00 |
| CHEMBL4166081 | — | IC50 | = | 100000.0 | nM | 4.00 |
| CHEMBL4169504 | — | IC50 | = | 100000.0 | nM | 4.00 |
| CHEMBL4172669 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4162011 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4169280 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4173777 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4172898 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4163467 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4164970 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4160496 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4168391 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4163874 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4177338 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4166059 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4175201 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4173977 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4162609 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4170542 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL4175596 | — | IC50 | > | 20000.0 | nM | - |