Molecule Details
| InChIKey | MFGCZGTWZJWFGN-XMMPIXPASA-N |
|---|---|
| Compound Name | (2S)-2-amino-1-[3-[2-[6-(2-ethyl-4-hydroxyphenyl)-1H-indazol-3-yl]-1H-imidazol-5-yl]-2,5-dihydropyrrol-1-yl]-3-hydroxy-3-methylbutan-1-one |
| Canonical SMILES | CCc1cc(O)ccc1-c1ccc2c(-c3nc(C4=CCN(C(=O)[C@@H](N)C(C)(C)O)C4)c[nH]3)n[nH]c2c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 9.26 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P23458 | JAK1 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 9.3 | Ki | BindingDB |
| P29597 | TYK2 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 9.3 | Ki | BindingDB |
| P52333 | JAK3 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 9.3 | Ki | BindingDB |