Molecule Details
| InChIKey | VMMRDFLDWHFNOX-UHFFFAOYSA-N |
|---|---|
| Compound Name | 6-Methoxy-2-(5-methylfuran-2-yl)-N-((1-methylpiperidin-4-yl)methyl)-7-(3-(pyrrolidin-1-yl)propoxy)quinolin-4-amine |
| Canonical SMILES | COc1cc2c(NCC3CCN(C)CC3)cc(-c3ccc(C)o3)nc2cc1OCCCN1CCCC1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.08 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q96KQ7 | EHMT2 | Homo sapiens | Human | PF00023 PF12796 PF21533 PF05033 PF00856 | 7.8 | IC50 | ChEMBL;BindingDB |
| P26358 | DNMT1 | Homo sapiens | Human | PF01426 PF06464 PF00145 PF12047 PF02008 | 7.5 | IC50 | ChEMBL;BindingDB |
| Q9Y6K1 | DNMT3A | Homo sapiens | Human | PF17980 PF00145 PF22855 PF21255 PF00855 | 7.0 | IC50 | ChEMBL |
| Q9UBC3 | DNMT3B | Homo sapiens | Human | PF17980 PF00145 PF21255 PF00855 | 6.0 | IC50 | ChEMBL |