Molecule Details
| InChIKey | RBXWTIUJXQLTFC-XZWHSSHBSA-N |
|---|---|
| Compound Name | 5-chloro-N-[[(2S,4R)-4-[4-[[4-(dimethylamino)-4-oxo-3,3-diphenylbutyl]amino]butoxy]pyrrolidin-2-yl]methyl]-3-ethyl-2-hydroxy-6-methoxybenzamide |
| Canonical SMILES | CCc1cc(Cl)c(OC)c(C(=O)NC[C@@H]2C[C@@H](OCCCCNCCC(C(=O)N(C)C)(c3ccccc3)c3ccccc3)CN2)c1O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.28 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P35462 | DRD3 | Homo sapiens | Human | PF00001 | 8.7 | Ki | ChEMBL;BindingDB |
| P14416 | DRD2 | Homo sapiens | Human | PF00001 | 8.0 | Ki | ChEMBL;BindingDB |
| P35372 | OPRM1 | Homo sapiens | Human | PF00001 | 6.2 | Ki | ChEMBL;BindingDB |
| P21917 | DRD4 | Homo sapiens | Human | PF00001 | 6.2 | Ki | ChEMBL;BindingDB |