Molecule Details
| InChIKey | KGERZPVQIRYWRK-GDLZYMKVSA-N |
|---|---|
| Compound Name | Bms-986158 |
| Canonical SMILES | Cc1nnn(C)c1-c1cnc2c3ccc(C(C)(C)O)cc3n([C@H](c3ccccc3)C3CCOCC3)c2c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.98 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB15435 |
|---|---|
| Drug Name | BMS-986158 |
| CAS Number | 1800340-40-2 |
| Groups | investigational |
| ATC Codes | nan |
| Description | BMS-986158 is under investigation in clinical trial NCT02419417 (Study of BMS-986158 in Subjects With Select Advanced Cancers). |
Cross-references: BindingDB: 297146 ChemSpider: 58828664 PDB: YWA
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P01106 | MYC | Homo sapiens | Human | PF00010 PF02344 PF01056 | 9.2 | IC50 | ChEMBL;BindingDB |
| O60885 | BRD4 | Homo sapiens | Human | PF17035 PF17105 PF00439 | 9.0 | IC50 | ChEMBL;BindingDB |
| Q15059 | BRD3 | Homo sapiens | Human | PF17035 PF00439 | 9.0 | IC50 | ChEMBL;BindingDB |
| P25440 | BRD2 | Homo sapiens | Human | PF17035 PF00439 | 8.8 | IC50 | ChEMBL;BindingDB |