Molecule Details
| InChIKey | AJQWHEHMQASSNJ-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-[5-(1-benzothiophen-2-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine |
| Canonical SMILES | Nc1nccc(-c2c[nH]c3ncc(-c4cc5ccccc5s4)cc23)n1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.5 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P20248 | CCNA2 | Homo sapiens | Human | PF02984 PF00134 PF16500 | 7.9 | IC50 | ChEMBL |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 7.9 | IC50 | ChEMBL;BindingDB |
| O60563 | CCNT1 | Homo sapiens | Human | PF00134 PF21797 | 7.1 | IC50 | ChEMBL;BindingDB |
| P50750 | CDK9 | Homo sapiens | Human | PF00069 | 7.1 | IC50 | ChEMBL |