Molecule Details
| InChIKey | OHRURASPPZQGQM-QSVHVVLASA-N |
|---|---|
| Compound Name | Romidepsin (FK228, depsipeptide) |
| Canonical SMILES | C/C=C1\NC(=O)[C@H]2CSSCC/C=C/[C@@H](CC(=O)N[C@H](C(C)C)C(=O)N2)OC(=O)[C@H](C(C)C)NC1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 9 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.17 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (9)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q96DB2 | HDAC11 | Homo sapiens | Human | PF00850 | 9.5 | IC50 | BindingDB |
| O15379 | HDAC3 | Homo sapiens | Human | PF00850 | 9.0 | IC50 | BindingDB |
| Q969S8 | HDAC10 | Homo sapiens | Human | PF00850 | 9.0 | IC50 | BindingDB |
| Q13547 | HDAC1 | Homo sapiens | Human | PF00850 | 8.6 | IC50 | BindingDB |
| Q9BY41 | HDAC8 | Homo sapiens | Human | PF00850 | 8.0 | IC50 | BindingDB |
| Q92769 | HDAC2 | Homo sapiens | Human | PF00850 | 7.3 | IC50 | BindingDB |
| Q9UBN7 | HDAC6 | Homo sapiens | Human | PF00850 PF02148 | 6.7 | IC50 | BindingDB |
| P56524 | HDAC4 | Homo sapiens | Human | PF12203 PF00850 | 6.3 | IC50 | BindingDB |
| Q7K6A1 | Plasmodium falciparum (isolate 3D7) | Pathogen | PF00850 | 9.1 | IC50 | BindingDB |