Molecule Details
| InChIKey | FSDWYLVZNOVGAG-OALUTQOASA-N |
|---|---|
| Compound Name | [(1R)-1-[[(2S)-3-[4-(aminomethyl)phenyl]-2-benzamidopropanoyl]amino]-4-(diaminomethylideneamino)butyl]boronic acid |
| Canonical SMILES | N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)c1ccccc1)B(O)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.76 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (2)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| K4FQI5 | West Nile virus | Pathogen | PF07652 | 6.9 | IC50 | ChEMBL | |
| A0A024AXB9 | NS3 | Zika virus | Pathogen | PF20907 | 6.6 | IC50 | ChEMBL;BindingDB |