Molecule Details
| InChIKey | UAACCBHMQBQBIY-UHFFFAOYSA-N |
|---|---|
| Compound Name | US20240166635, Example 47a |
| Canonical SMILES | CC1(O)CC(F)(F)CCC1Oc1nc(NC2CCN(S(C)(=O)=O)CC2)ncc1C#N |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.59 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P06493 | CDK1 | Homo sapiens | Human | PF00069 | 7.3 | IC50 | BindingDB |
| P51946 | CCNH | Homo sapiens | Human | PF16899 PF00134 | 7.3 | IC50 | BindingDB |
| O60563 | CCNT1 | Homo sapiens | Human | PF00134 PF21797 | 6.3 | IC50 | BindingDB |
| P11802 | CDK4 | Homo sapiens | Human | PF00069 | 6.3 | IC50 | BindingDB |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 6.3 | IC50 | BindingDB |
| Q00534 | CDK6 | Homo sapiens | Human | PF00069 | 6.3 | IC50 | BindingDB |