Molecule Details
| InChIKey | ZEUITGRIYCTCEM-QGZVFWFLSA-N |
|---|---|
| Compound Name | (R)-Duloxetine |
| Canonical SMILES | CNCC[C@@H](Oc1cccc2ccccc12)c1cccs1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.44 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P31645 | SLC6A4 | Homo sapiens | Human | PF03491 PF00209 | 8.6 | IC50 | ChEMBL;BindingDB |
| P23975 | SLC6A2 | Homo sapiens | Human | PF00209 | 7.5 | IC50 | ChEMBL;BindingDB |
| Q12931 | TRAP1 | Homo sapiens | Human | PF13589 PF00183 | 7.5 | IC50 | BindingDB |
| Q01959 | SLC6A3 | Homo sapiens | Human | PF00209 | 6.2 | IC50 | ChEMBL;BindingDB |