Molecule Details
| InChIKey | WLGCCCLQJAMXCP-MUUNZHRXSA-N |
|---|---|
| Compound Name | US11420970, Example 32 |
| Canonical SMILES | COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)(COC4CCC4)C3)cn2)cc1F |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.94 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q9BZ95 | NSD3 | Homo sapiens | Human | PF17907 PF17982 PF23011 PF22908 PF23004 PF00855 PF00856 | 9.0 | IC50 | ChEMBL |
| O96028 | NSD2 | Homo sapiens | Human | PF17907 PF17982 PF00505 PF00628 PF23011 PF22908 PF23004 PF00855 PF00856 | 8.3 | IC50 | ChEMBL;BindingDB |
| Q96L73 | NSD1 | Homo sapiens | Human | PF17907 PF17982 PF00628 PF23011 PF22908 PF23004 PF00855 PF00856 | 6.6 | IC50 | ChEMBL |