Molecule Details
| InChIKey | ZUXXBCGSGVJVMR-YEFARLPMSA-N |
|---|---|
| Canonical SMILES | CCCN(NC(=O)[C@@H]1C[C@@H](OCc2ccccc2)CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(C)=O)[C@@H](C)CC)C(C)C)C(=O)NN(C)c1ccccc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.32 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (2)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| A3EZJ3 | NS3 | Hepacivirus hominis | Pathogen | PF07652 PF22027 PF02907 | 6.3 | IC50 | ChEMBL |
| Q9WMX2 | Hepatitis C virus genotype 1b (isolate Con1) | Pathogen | PF07652 PF01543 PF01542 PF01539 PF01560 PF01538 PF01006 PF01001 PF01506 PF08300 PF08301 PF12941 PF22027 PF02907 PF00998 | 6.3 | IC50 | BindingDB |