Molecule Details
| InChIKey | WHKGYJCRLQITBW-GQWFFFTNSA-N |
|---|---|
| Canonical SMILES | CC(C)N(CCC(c1ccccc1)c1cc(CCNC(=O)CCCCCNC(=O)COc2ccc([CH+]/C=c3\ccc4n3[B-](F)(F)n3c(ccc3-c3cccs3)C=4)cc2)ccc1O)C(C)C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.07 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P11229 | CHRM1 | Homo sapiens | Human | PF00001 | 8.3 | Ki | BindingDB |
| P08173 | CHRM4 | Homo sapiens | Human | PF00001 | 8.2 | Ki | BindingDB |
| P08172 | CHRM2 | Homo sapiens | Human | PF00001 | 8.1 | Ki | BindingDB |
| P20309 | CHRM3 | Homo sapiens | Human | PF00001 | 8.0 | Ki | BindingDB |
| P08912 | CHRM5 | Homo sapiens | Human | PF00001 | 7.8 | Ki | BindingDB |