Molecule Details
| InChIKey | XKFMBGWHHBCWCD-QMMMGPOBSA-N |
|---|---|
| Compound Name | A-85380 |
| Canonical SMILES | c1cncc(OC[C@@H]2CCN2)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 7 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.64 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (7)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P43681 | CHRNA4 | Homo sapiens | Human | PF02931 PF02932 | 10.3 | Ki | ChEMBL;BindingDB |
| P17787 | CHRNB2 | Homo sapiens | Human | PF02931 PF02932 | 10.3 | Ki | ChEMBL |
| P36544 | CHRNA7 | Homo sapiens | Human | PF02931 PF02932 | 6.8 | Ki | ChEMBL;BindingDB |
| P02708 | CHRNA1 | Homo sapiens | Human | PF02931 PF02932 | 6.5 | Ki | ChEMBL |
| P07510 | CHRNG | Homo sapiens | Human | PF02931 PF02932 | 6.5 | Ki | ChEMBL |
| P11230 | CHRNB1 | Homo sapiens | Human | PF02931 PF02932 | 6.5 | Ki | ChEMBL |
| Q07001 | CHRND | Homo sapiens | Human | PF02931 PF02932 | 6.5 | Ki | ChEMBL |