Assay Detail
Binding
CHEMBL3782661
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Binding affinity to human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells by isothermal titration calorimetry
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Discovery of Benzo[cd]indol-2(1H)-ones as Potent and Specific BET Bromodomain Inhibitors: Structure-Based Virtual Screening, Optimization, and Biological Evaluation.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 14 | 6.47 | 7.47 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1957266 | — | — | 1 | 7.47 |
| CHEMBL3781471 | — | — | 1 | 6.91 |
| CHEMBL3780429 | — | — | 1 | 6.86 |
| CHEMBL3779929 | — | — | 1 | 6.75 |
| CHEMBL3780901 | — | — | 1 | 6.66 |
| CHEMBL3781449 | — | — | 1 | 6.65 |
| CHEMBL3781254 | — | — | 1 | 6.59 |
| CHEMBL3780059 | — | — | 1 | 6.56 |
| CHEMBL3780508 | — | — | 1 | 6.41 |
| CHEMBL3780128 | — | — | 1 | 6.41 |
| CHEMBL3782048 | — | — | 1 | 6.38 |
| CHEMBL3780398 | — | — | 1 | 5.91 |
| CHEMBL3234253 | — | — | 1 | 5.63 |
| CHEMBL3780381 | — | — | 1 | 5.43 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1957266 | — | Kd | = | 34.0 | nM | 7.47 |
| CHEMBL3781471 | — | Kd | = | 124.0 | nM | 6.91 |
| CHEMBL3780429 | — | Kd | = | 137.0 | nM | 6.86 |
| CHEMBL3779929 | — | Kd | = | 180.0 | nM | 6.75 |
| CHEMBL3780901 | — | Kd | = | 218.0 | nM | 6.66 |
| CHEMBL3781449 | — | Kd | = | 224.0 | nM | 6.65 |
| CHEMBL3781254 | — | Kd | = | 255.0 | nM | 6.59 |
| CHEMBL3780059 | — | Kd | = | 275.0 | nM | 6.56 |
| CHEMBL3780508 | — | Kd | = | 392.0 | nM | 6.41 |
| CHEMBL3780128 | — | Kd | = | 390.0 | nM | 6.41 |
| CHEMBL3782048 | — | Kd | = | 421.0 | nM | 6.38 |
| CHEMBL3780398 | — | Kd | = | 1234.0 | nM | 5.91 |
| CHEMBL3234253 | — | Kd | = | 2340.0 | nM | 5.63 |
| CHEMBL3780381 | — | Kd | = | 3751.0 | nM | 5.43 |