Molecule Details
| InChIKey | JPKKWLFMDKVIIR-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-[5-(3,5-Di-tert-butylphenyl)-1-(4-methylsulfonylphenyl)pyrazol-3-yl]benzoic Acid |
| Canonical SMILES | CC(C)(C)c1cc(-c2cc(-c3ccc(C(=O)O)cc3)nn2-c2ccc(S(C)(=O)=O)cc2)cc(C(C)(C)C)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.76 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P13631 | RARG | Homo sapiens | Human | PF00104 PF00105 | 8.4 | Ki | ChEMBL |
| P10276 | RARA | Homo sapiens | Human | PF00104 PF00105 | 6.3 | Ki | ChEMBL;BindingDB |
| P19793 | RXRA | Homo sapiens | Human | PF00104 PF11825 PF00105 | 6.3 | Ki | ChEMBL |
| P10826 | RARB | Homo sapiens | Human | PF00104 PF00105 | 6.0 | Ki | ChEMBL |