Molecule Details
| InChIKey | QWLYILUODIZPOK-ZSQFBXSQSA-N |
|---|---|
| Compound Name | [(1R)-1-amino-3-phenylpropyl]-[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]-4-methylpentyl]phosphinic acid |
| Canonical SMILES | COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CP(=O)(O)[C@@H](N)CCc1ccccc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.24 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P15144 | ANPEP | Homo sapiens | Human | PF11838 PF01433 PF17900 | 8.8 | IC50 | ChEMBL;BindingDB |
| Q9NZ08 | ERAP1 | Homo sapiens | Human | PF11838 PF01433 PF17900 | 6.8 | IC50 | ChEMBL;BindingDB |
| Q6P179 | ERAP2 | Homo sapiens | Human | PF11838 PF01433 PF17900 | 6.0 | IC50 | ChEMBL;BindingDB |