Molecule Details
| InChIKey | AVUGRCORGNXBOQ-UHFFFAOYSA-N |
|---|---|
| Compound Name | N-[1-(cyanomethylamino)-1-oxo-3-[3-(1,3,4-thiadiazol-2-yl)phenyl]propan-2-yl]benzamide |
| Canonical SMILES | N#CCNC(=O)C(Cc1cccc(-c2nncs2)c1)NC(=O)c1ccccc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.27 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P25774 | CTSS | Homo sapiens | Human | PF08246 PF00112 | 8.6 | IC50 | BindingDB |
| O60911 | CTSV | Homo sapiens | Human | PF08246 PF00112 | 7.6 | IC50 | BindingDB |
| P07711 | CTSL | Homo sapiens | Human | PF08246 PF00112 | 6.7 | IC50 | BindingDB |
| P43235 | CTSK | Homo sapiens | Human | PF08246 PF00112 | 6.2 | IC50 | BindingDB |