Molecule Details
| InChIKey | WYZWZEOGROVVHK-ZWZTZDBGSA-N |
|---|---|
| Compound Name | (4R,6S,8R)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.06,8]nonadeca-1(15),9,11,16,18-pentaene-2,13-dione |
| Canonical SMILES | C[C@@H]1C[C@@H]2O[C@@H]2C=CC=CC(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.7 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P07900 | HSP90AA1 | Homo sapiens | Human | PF13589 PF00183 | 7.8 | Kd | BindingDB |
| P08238 | HSP90AB1 | Homo sapiens | Human | PF13589 PF00183 | 7.7 | IC50 | BindingDB |
| P35354 | PTGS2 | Homo sapiens | Human | PF03098 | 7.6 | IC50 | BindingDB |
| P02829 | HSP82 | Saccharomyces cerevisiae (strain ATCC 204508 / S288c) | Pathogen | PF13589 PF00183 | 7.7 | Kd | BindingDB |