Molecule Details
| InChIKey | CCEBJZRLEVFTNS-HNNXBMFYSA-N |
|---|---|
| Compound Name | 3-[[(2S)-azetidin-2-yl]methoxy]-5-(6-chlorohex-1-ynyl)-2-methylpyridine |
| Canonical SMILES | Cc1ncc(C#CCCCCCl)cc1OC[C@@H]1CCN1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.94 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q15822 | CHRNA2 | Homo sapiens | Human | PF02931 PF02932 | 8.1 | Ki | ChEMBL |
| P43681 | CHRNA4 | Homo sapiens | Human | PF02931 PF02932 | 6.6 | IC50 | ChEMBL;BindingDB |
| P17787 | CHRNB2 | Homo sapiens | Human | PF02931 PF02932 | 6.6 | Ki | ChEMBL |
| P32297 | CHRNA3 | Homo sapiens | Human | PF02931 PF02932 | 6.5 | Ki | ChEMBL |