Molecule Details
| InChIKey | LSGWJMLNFPIPPC-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-N-(3H-benzimidazol-5-yl)-2-N-(4-bromophenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine |
| Canonical SMILES | FC(F)(F)c1cnc(Nc2ccc(Br)cc2)nc1Nc1ccc2[nH]cnc2c1 |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.19 |
| Source | ChEMBL;BindingDB;TTD_MultiTarget |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P06493 | CDK1 | Homo sapiens | Human | PF00069 | 8.0 | IC50 | ChEMBL;BindingDB |
| P11802 | CDK4 | Homo sapiens | Human | PF00069 | 7.5 | pIC50 | TTD_MultiTarget |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 7.1 | pIC50 | TTD_MultiTarget |
| P27361 | MAPK3 | Homo sapiens | Human | PF00069 | 6.1 | IC50 | ChEMBL;BindingDB |