Molecule Details
| InChIKey | QWEBUPURHNWVEK-QRTARXTBSA-N |
|---|---|
| Compound Name | 3-((1s,2r)-2-(2-Methoxyethyl)cyclopropyl)-5-(((s)-1-methylpyrrolidin-2-yl)methoxy)pyridine |
| Canonical SMILES | COCC[C@H]1C[C@@H]1c1cncc(OC[C@@H]2CCCN2C)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.64 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P43681 | CHRNA4 | Homo sapiens | Human | PF02931 PF02932 | 7.7 | IC50 | ChEMBL;BindingDB |
| P17787 | CHRNB2 | Homo sapiens | Human | PF02931 PF02932 | 7.7 | IC50 | ChEMBL |
| P32297 | CHRNA3 | Homo sapiens | Human | PF02931 PF02932 | 7.6 | IC50 | ChEMBL |
| Q05901 | CHRNB3 | Homo sapiens | Human | PF02931 PF02932 | 7.6 | IC50 | ChEMBL |
| Q15825 | CHRNA6 | Homo sapiens | Human | PF02931 PF02932 | 7.6 | IC50 | ChEMBL |