Molecule Details
| InChIKey | QCZGUQGVICOTKX-ZDUSSCGKSA-N |
|---|---|
| Compound Name | (2S)-N-(cyanomethyl)-4-methyl-2-(phenylformamido)pentanamide |
| Canonical SMILES | CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)NCC#N |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.03 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P25774 | CTSS | Homo sapiens | Human | PF08246 PF00112 | 7.4 | IC50 | BindingDB |
| P43235 | CTSK | Homo sapiens | Human | PF08246 PF00112 | 7.3 | IC50 | BindingDB |
| P07711 | CTSL | Homo sapiens | Human | PF08246 PF00112 | 7.0 | IC50 | ChEMBL;BindingDB |
| Q6DMN0 | CPL | Toxoplasma gondii | Pathogen | PF08246 PF00112 | 6.5 | IC50 | ChEMBL;BindingDB |