Molecule Details
| InChIKey | XVNMCGWDHIIBST-HOFKKMOUSA-N |
|---|---|
| Compound Name | US9656988, Example 293 |
| Canonical SMILES | NC(=O)c1ncc(N2CC[C@H]3CCN(C(=O)C4CC4)[C@H]3C2)nc1Nc1ccc(C2CCN(C3CCCC3)CC2)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.26 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P06239 | LCK | Homo sapiens | Human | PF07714 PF00017 PF00018 | 7.3 | IC50 | ChEMBL;BindingDB |
| P52333 | JAK3 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 7.3 | IC50 | ChEMBL;BindingDB |
| Q06187 | BTK | Homo sapiens | Human | PF00779 PF00169 PF07714 PF00017 PF00018 | 7.3 | IC50 | ChEMBL;BindingDB |