Molecule Details
| InChIKey | RFXNFEOGLCADNR-QOZRZTDLSA-N |
|---|---|
| Compound Name | (4S,7S,10S,13R)-4-[(2S)-butan-2-yl]-7-[(1-methoxyindol-3-yl)methyl]-10-(6-methylideneoctyl)-1,5,8,11-tetrazabicyclo[11.4.0]heptadecane-3,6,9,12-tetrone |
| Canonical SMILES | C=C(CC)CCCCC[C@@H]1NC(=O)[C@H]2CCCCN2CC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC1=O |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | N/A |
| Source | TTD_MultiTarget |
2D Structure
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P56524 | HDAC4 | Homo sapiens | Human | PF12203 PF00850 | Clinical | TTD_MultiTarget | TTD_MultiTarget |
| Q02161 | RHD | Homo sapiens | Human | PF00909 | Clinical | TTD_MultiTarget | TTD_MultiTarget |
| Q13547 | HDAC1 | Homo sapiens | Human | PF00850 | Clinical | TTD_MultiTarget | TTD_MultiTarget |
| Q92769 | HDAC2 | Homo sapiens | Human | PF00850 | Clinical | TTD_MultiTarget | TTD_MultiTarget |