Molecule Details
| InChIKey | BKRDDYIAVADMIJ-UHFFFAOYSA-N |
|---|---|
| Compound Name | 3-(1,4-Diazabicyclo[3.2.2]nonan-4-yl)-4-fluorodibenzothiophene 5,5-dioxide |
| Canonical SMILES | O=S1(=O)c2ccccc2-c2ccc(N3CCN4CCC3CC4)c(F)c21 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.25 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P17787 | CHRNB2 | Homo sapiens | Human | PF02931 PF02932 | 6.5 | Ki | ChEMBL;BindingDB |
| P43681 | CHRNA4 | Homo sapiens | Human | PF02931 PF02932 | 6.4 | Ki | ChEMBL;BindingDB |
| P32297 | CHRNA3 | Homo sapiens | Human | PF02931 PF02932 | 6.2 | Ki | ChEMBL |
| P02708 | CHRNA1 | Homo sapiens | Human | PF02931 PF02932 | 6.1 | Ki | ChEMBL;BindingDB |
| P30926 | CHRNB4 | Homo sapiens | Human | PF02931 PF02932 | 6.0 | Ki | ChEMBL |