Molecule Details
| InChIKey | CMMVRTXWYOGXHR-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-[4-[1-(6-Methoxypyrimidin-4-yl)-8-[(3-methyl-2-pyridinyl)methyl]-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-3-yl]phenyl]benzonitrile |
| Canonical SMILES | COc1cc(N2C(=O)N(c3ccc(-c4ccc(C#N)cc4)cc3)C(=O)C23CCN(Cc2ncccc2C)CC3)ncn1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.99 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q96KS0 | EGLN2 | Homo sapiens | Human | PF13640 | 9.0 | IC50 | ChEMBL;BindingDB |
| Q9GZT9 | EGLN1 | Homo sapiens | Human | PF13640 PF01753 | 8.8 | IC50 | ChEMBL;BindingDB |
| Q9H6Z9 | EGLN3 | Homo sapiens | Human | PF13640 | 7.8 | IC50 | ChEMBL;BindingDB |
| Q12809 | KCNH2 | Homo sapiens | Human | PF00027 PF00520 PF13426 | 6.4 | IC50 | ChEMBL;BindingDB |