Molecule Details
| InChIKey | PXRCDPVYRPKGGI-MRXNPFEDSA-N |
|---|---|
| Compound Name | 3-[3-(5-Benzyl-2-carbamoyl-phenyl)phenyl]-2-methyl-propanoic acid |
| Canonical SMILES | C[C@H](Cc1cccc(-c2cc(Cc3ccccc3)ccc2C(N)=O)c1)C(=O)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 11 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.24 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (11)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P14555 | PLA2G2A | Homo sapiens | Human | PF00068 | 8.0 | IC50 | ChEMBL;BindingDB |
| P04054 | PLA2G1B | Homo sapiens | Human | PF00068 | 7.2 | IC50 | ChEMBL |
| P39877 | PLA2G5 | Homo sapiens | Human | PF00068 | 7.2 | IC50 | ChEMBL |
| Q5R387 | PLA2G2C | Homo sapiens | Human | PF00068 | 7.2 | IC50 | ChEMBL |
| Q9BX93 | PLA2G12B | Homo sapiens | Human | PF06951 | 7.2 | IC50 | ChEMBL;BindingDB |
| Q9BZM1 | PLA2G12A | Homo sapiens | Human | PF06951 | 7.2 | IC50 | ChEMBL |
| Q9BZM2 | PLA2G2F | Homo sapiens | Human | PF00068 | 7.2 | IC50 | ChEMBL |
| Q9NZ20 | PLA2G3 | Homo sapiens | Human | PF05826 | 7.2 | IC50 | ChEMBL |
| Q9NZK7 | PLA2G2E | Homo sapiens | Human | PF00068 | 7.2 | IC50 | ChEMBL |
| Q9UNK4 | PLA2G2D | Homo sapiens | Human | PF00068 | 7.2 | IC50 | ChEMBL |
| O15496 | PLA2G10 | Homo sapiens | Human | PF00068 | 6.4 | IC50 | ChEMBL;BindingDB |