Molecule Details
| InChIKey | XNZXFVFJRAJUDY-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-(4-(Methyl(3-(7-propyl-3-(trifluoromethyl)benzo[d]isoxazol-6-yloxy)propyl)amino)-2-(trifluoromethyl)phenyl)acetic acid |
| Canonical SMILES | CCCc1c(OCCCN(C)c2ccc(CC(=O)O)c(C(F)(F)F)c2)ccc2c(C(F)(F)F)noc12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.02 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P55055 | NR1H2 | Homo sapiens | Human | PF00104 PF00105 | 7.7 | IC50 | ChEMBL;BindingDB |
| Q13133 | NR1H3 | Homo sapiens | Human | PF00104 PF00105 | 7.2 | IC50 | ChEMBL;BindingDB |
| Q07869 | PPARA | Homo sapiens | Human | PF00104 PF00105 | 6.8 | IC50 | ChEMBL;BindingDB |
| Q03181 | PPARD | Homo sapiens | Human | PF00104 PF00105 | 6.3 | IC50 | ChEMBL;BindingDB |