Molecule Details
| InChIKey | KMZCUSKKQFNPIY-UHFFFAOYSA-N |
|---|---|
| Compound Name | 1-(3,6-Diazabicyclo[3.1.1]heptan-3-yl)propan-1-one |
| Canonical SMILES | CCC(=O)N1CC2CC(C1)N2 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.02 |
| 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 | 8.2 | Ki | ChEMBL;BindingDB |
| P17787 | CHRNB2 | Homo sapiens | Human | PF02931 PF02932 | 6.7 | Ki | ChEMBL;BindingDB |
| P32297 | CHRNA3 | Homo sapiens | Human | PF02931 PF02932 | 6.7 | Ki | ChEMBL |
| Q05901 | CHRNB3 | Homo sapiens | Human | PF02931 PF02932 | 6.7 | Ki | ChEMBL |
| Q15825 | CHRNA6 | Homo sapiens | Human | PF02931 PF02932 | 6.7 | Ki | ChEMBL |