Molecule Details
| InChIKey | APPXYONGBIXGRO-QPFJYYDMSA-N |
|---|---|
| Canonical SMILES | CC(C)=CCc1c(-c2ccc(O)cc2O)oc2c([C@@H]3C=C(C)C[C@H](c4ccc(O)cc4O)[C@H]3C(=O)c3ccc(O)cc3O)c(O)cc(O)c2c1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.39 |
| Source | ChEMBL |
2D Structure
Activity Profile
Target Activities (2)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P18031 | PTPN1 | Homo sapiens | Human | PF00102 | 6.7 | Ki | ChEMBL |
| A0A045ISB3 | iphP | Mycobacterium tuberculosis | Pathogen | PF13350 | 6.1 | IC50 | ChEMBL |