Assay Detail
ADMET
CHEMBL5048796
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Inhibition of recombinant human CYP2D6 using AMMC as substrate preincubated for 30 mins followed by substrate addition measured after 45 mins by fluorescence based assay
25
Total Activities
25
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
Synthesis and Evaluation of Novel Tetrahydronaphthyridine CXCR4 Antagonists with Improved Drug-like Profiles.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 25 | 5.23 | 6.50 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3091687 | — | — | 1 | 6.50 |
| CHEMBL5070403 | — | — | 1 | 6.16 |
| CHEMBL5087754 | — | — | 1 | 5.57 |
| CHEMBL5085636 | — | — | 1 | 5.57 |
| CHEMBL5079518 | — | — | 1 | 5.55 |
| CHEMBL5076569 | — | — | 1 | 5.40 |
| CHEMBL5079671 | — | — | 1 | 5.36 |
| CHEMBL5086715 | — | — | 1 | 5.01 |
| CHEMBL5080863 | — | — | 1 | 5.00 |
| CHEMBL5082441 | — | — | 1 | 5.00 |
| CHEMBL5070958 | — | — | 1 | 4.92 |
| CHEMBL5093818 | — | — | 1 | 4.89 |
| CHEMBL5092098 | — | — | 1 | 4.89 |
| CHEMBL5079186 | — | — | 1 | 4.89 |
| CHEMBL5078032 | — | — | 1 | 4.82 |
| CHEMBL5091696 | — | — | 1 | 4.75 |
| CHEMBL5078984 | — | — | 1 | 4.70 |
| CHEMBL5084366 | — | — | 1 | - |
| CHEMBL5083811 | — | — | 1 | - |
| CHEMBL5085511 | — | — | 1 | - |
| CHEMBL5077132 | — | — | 1 | - |
| CHEMBL5083458 | — | — | 1 | - |
| CHEMBL5092949 | — | — | 1 | - |
| CHEMBL5081505 | — | — | 1 | - |
| CHEMBL5082142 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3091687 | — | IC50 | = | 320.0 | nM | 6.50 |
| CHEMBL5070403 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL5087754 | — | IC50 | = | 2700.0 | nM | 5.57 |
| CHEMBL5085636 | — | IC50 | = | 2700.0 | nM | 5.57 |
| CHEMBL5079518 | — | IC50 | = | 2800.0 | nM | 5.55 |
| CHEMBL5076569 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL5079671 | — | IC50 | = | 4400.0 | nM | 5.36 |
| CHEMBL5086715 | — | IC50 | = | 9700.0 | nM | 5.01 |
| CHEMBL5080863 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL5082441 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL5070958 | — | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL5093818 | — | IC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL5092098 | — | IC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL5079186 | — | IC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL5078032 | — | IC50 | = | 15000.0 | nM | 4.82 |
| CHEMBL5091696 | — | IC50 | = | 18000.0 | nM | 4.75 |
| CHEMBL5078984 | — | IC50 | = | 20000.0 | nM | 4.70 |
| CHEMBL5084366 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL5083811 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL5085511 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL5077132 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL5083458 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL5092949 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL5081505 | — | IC50 | > | 20000.0 | nM | - |
| CHEMBL5082142 | — | IC50 | > | 20000.0 | nM | - |