Assay Detail
ADMET
CHEMBL1670542
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Inhibition of CYP3A4
9
Total Activities
9
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Spirodiketopiperazine-based CCR5 antagonist: discovery of an antiretroviral drug candidate.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 9 | 4.78 | 5.03 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL536743 | — | — | 1 | 5.03 |
| CHEMBL537424 | — | — | 1 | 4.71 |
| CHEMBL1170878 | — | — | 1 | 4.60 |
| CHEMBL559168 | — | — | 1 | - |
| CHEMBL536754 | — | — | 1 | - |
| CHEMBL1668019 | APLAVIROC HYDROCHLORIDE | 3.0 | 1 | - |
| CHEMBL1668020 | — | — | 1 | - |
| CHEMBL1668021 | — | — | 1 | - |
| CHEMBL1668022 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL536743 | — | IC50 | = | 9300.0 | nM | 5.03 |
| CHEMBL537424 | — | IC50 | = | 19700.0 | nM | 4.71 |
| CHEMBL1170878 | — | IC50 | = | 24900.0 | nM | 4.60 |
| CHEMBL559168 | — | IC50 | > | 30000.0 | nM | - |
| CHEMBL536754 | — | IC50 | > | 30000.0 | nM | - |
| CHEMBL1668019 | APLAVIROC HYDROCHLORIDE | IC50 | > | 30000.0 | nM | - |
| CHEMBL1668020 | — | IC50 | > | 30000.0 | nM | - |
| CHEMBL1668021 | — | IC50 | > | 30000.0 | nM | - |
| CHEMBL1668022 | — | IC50 | > | 30000.0 | nM | - |