Molecule Details
| InChIKey | XSQAICBCYIFUQS-GFCCVEGCSA-N |
|---|---|
| Compound Name | (R)-2-(5-broMo-4-(4-chlorobenzyl)-7-fluoro-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetic acid |
| Canonical SMILES | O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.21 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q13258 | PTGDR | Homo sapiens | Human | PF00001 | 8.8 | IC50 | ChEMBL;BindingDB |
| P21731 | TBXA2R | Homo sapiens | Human | PF00001 | 8.1 | IC50 | ChEMBL;BindingDB |
| P43119 | PTGIR | Homo sapiens | Human | PF00001 | 6.4 | Ki | ChEMBL;BindingDB |
| P43116 | PTGER2 | Homo sapiens | Human | PF00001 | 6.4 | Ki | ChEMBL;BindingDB |
| P43115 | PTGER3 | Homo sapiens | Human | PF00001 | 6.3 | Ki | ChEMBL;BindingDB |