Molecule Details
| InChIKey | LSEQOPAXXJYNDG-DEOSSOPVSA-N |
|---|---|
| Compound Name | benzyl N-[(2S)-1-[[4-[[4-(2-chloro-5-methylpyrimidin-4-yl)-N-(2,4-dihydroxybenzoyl)anilino]methyl]phenyl]methylamino]-1-oxopropan-2-yl]carbamate |
| Canonical SMILES | Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CNC(=O)[C@H](C)NC(=O)OCc3ccccc3)cc2)C(=O)c2ccc(O)cc2O)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.12 |
| Source | ChEMBL |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q15118 | PDK1 | Homo sapiens | Human | PF10436 PF02518 | 7.5 | IC50 | ChEMBL |
| Q15119 | PDK2 | Homo sapiens | Human | PF10436 PF02518 | 7.0 | IC50 | ChEMBL |
| Q15120 | PDK3 | Homo sapiens | Human | PF10436 PF02518 | 7.0 | IC50 | ChEMBL |
| Q16654 | PDK4 | Homo sapiens | Human | PF10436 PF02518 | 7.0 | IC50 | ChEMBL |