Molecule Details
| InChIKey | GEZHEQNLKAOMCA-RRZNCOCZSA-N |
|---|---|
| Compound Name | Gambogic Acid |
| Canonical SMILES | CC(C)=CCC[C@]1(C)C=Cc2c(O)c3c(c(CC=C(C)C)c2O1)O[C@]12C(=C[C@@H]4C[C@H]1C(C)(C)O[C@@]2(C/C=C(/C)C(=O)O)C4=O)C3=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.38 |
| Source | ChEMBL |
2D Structure
Activity Profile
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P10415 | BCL2 | Homo sapiens | Human | PF00452 PF02180 | 6.9 | IC50 | ChEMBL |
| Q16548 | BCL2A1 | Homo sapiens | Human | PF00452 | 6.5 | IC50 | ChEMBL |
| P18031 | PTPN1 | Homo sapiens | Human | PF00102 | 6.3 | Ki | ChEMBL |
| Q07817 | BCL2L1 | Homo sapiens | Human | PF00452 PF02180 | 6.3 | IC50 | ChEMBL |
| Q9HD36 | BCL2L10 | Homo sapiens | Human | PF00452 | 6.2 | IC50 | ChEMBL |
| Q07820 | MCL1 | Homo sapiens | Human | PF00452 | 6.1 | IC50 | ChEMBL |