Molecule Details
| InChIKey | PWHBUXLKTXHYAP-QHCPKHFHSA-N |
|---|---|
| Compound Name | Ethyl {(1S)-5-amino-1-[(5-{4-[(2,3-dihydro-1H-inden-2-ylamino)carbonyl]benzyl}-1,2,4-oxadiazol-3-YL)carbonyl]pentyl}carbamate |
| Canonical SMILES | CCOC(=O)N[C@@H](CCCCN)C(=O)c1noc(Cc2ccc(C(=O)NC3Cc4ccccc4C3)cc2)n1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.48 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q15661 | TPSAB1 | Homo sapiens | Human | PF00089 | 8.6 | Ki | ChEMBL |
| P20231 | TPSB2 | Homo sapiens | Human | PF00089 | 8.5 | Ki | BindingDB |
| P07477 | PRSS1 | Homo sapiens | Human | PF00089 | 6.8 | Ki | ChEMBL |
| P07478 | PRSS2 | Homo sapiens | Human | PF00089 | 6.8 | Ki | ChEMBL |
| P35030 | PRSS3 | Homo sapiens | Human | PF00089 | 6.8 | Ki | ChEMBL |