Molecule Details
| InChIKey | DJXMWMFZMCZDNH-CQSZACIVSA-N |
|---|---|
| Compound Name | 8-N-[(1R)-2,2-difluorocyclopentyl]-6-(difluoromethyl)-2-N-(1-methylsulfonylpiperidin-4-yl)pyrido[3,4-d]pyrimidine-2,8-diamine |
| Canonical SMILES | CS(=O)(=O)N1CCC(Nc2ncc3cc(C(F)F)nc(N[C@@H]4CCCC4(F)F)c3n2)CC1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.2 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P11802 | CDK4 | Homo sapiens | Human | PF00069 | 9.3 | IC50 | BindingDB |
| P24385 | CCND1 | Homo sapiens | Human | PF02984 PF00134 | 8.9 | IC50 | BindingDB |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 8.4 | IC50 | BindingDB |
| P06493 | CDK1 | Homo sapiens | Human | PF00069 | 8.1 | IC50 | BindingDB |
| O60563 | CCNT1 | Homo sapiens | Human | PF00134 PF21797 | 7.4 | IC50 | BindingDB |
| P51946 | CCNH | Homo sapiens | Human | PF16899 PF00134 | 7.1 | IC50 | BindingDB |