Molecule Details
| InChIKey | KZQWOEXRMPURDP-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-(4-(7-(4-Tetradecylbenzoyl)cyclopenta[d][1,2]oxazin-4-yl)phenoxy)acetic acid |
| Canonical SMILES | CCCCCCCCCCCCCCc1ccc(C(=O)c2ccc3c(-c4ccc(OCC(=O)O)cc4)nocc2-3)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.61 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P30305 | CDC25B | Homo sapiens | Human | PF06617 PF00581 | 6.9 | IC50 | ChEMBL;BindingDB |
| P18031 | PTPN1 | Homo sapiens | Human | PF00102 | 6.8 | IC50 | ChEMBL;BindingDB |
| P08575 | PTPRC | Homo sapiens | Human | PF12567 PF00041 PF12453 PF00102 | 6.8 | IC50 | ChEMBL;BindingDB |
| P36873 | PPP1CC | Homo sapiens | Human | PF00149 PF16891 | 6.7 | IC50 | ChEMBL;BindingDB |
| P10586 | PTPRF | Homo sapiens | Human | PF00041 PF07679 PF00102 | 6.2 | IC50 | ChEMBL;BindingDB |
| P15273 | yopH | Yersinia enterocolitica | Pathogen | PF00102 PF09013 | 6.3 | IC50 | ChEMBL;BindingDB |