Molecule Details
| InChIKey | APTVKHQLUJFYAC-KRWDZBQOSA-N |
|---|---|
| Compound Name | (4S)-4-(4-fluorophenyl)-2,7-dimethyl-3,4-dihydro-1H-isoquinoline |
| Canonical SMILES | Cc1ccc2c(c1)CN(C)C[C@H]2c1ccc(F)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.14 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P23975 | SLC6A2 | Homo sapiens | Human | PF00209 | 8.2 | Ki | ChEMBL;BindingDB |
| Q01959 | SLC6A3 | Homo sapiens | Human | PF00209 | 7.4 | Ki | ChEMBL;BindingDB |
| P31645 | SLC6A4 | Homo sapiens | Human | PF03491 PF00209 | 6.6 | Ki | ChEMBL;BindingDB |
| P10635 | CYP2D6 | Homo sapiens | Human | PF00067 | 6.3 | IC50 | ChEMBL;BindingDB |