Molecule Details
| InChIKey | HVFFRODVHZGRAZ-UHFFFAOYSA-N |
|---|---|
| Compound Name | 6-but-3-enyl-4-[3-(difluoromethoxy)-5-(morpholine-4-carbonyl)phenyl]-1H-pyrrolo[2,3-c]pyridin-7-one |
| Canonical SMILES | C=CCCn1cc(-c2cc(OC(F)F)cc(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.88 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P21675 | TAF1 | Homo sapiens | Human | PF00439 PF12157 PF09247 PF15288 | 8.2 | IC50 | ChEMBL;BindingDB |
| Q9BXF3 | CECR2 | Homo sapiens | Human | PF00439 | 7.1 | IC50 | ChEMBL;BindingDB |
| O60885 | BRD4 | Homo sapiens | Human | PF17035 PF17105 PF00439 | 6.2 | IC50 | ChEMBL;BindingDB |
| Q9H8M2 | BRD9 | Homo sapiens | Human | PF00439 PF12024 | 6.0 | IC50 | ChEMBL;BindingDB |