Molecule Details
| InChIKey | CTNCYOQZDOTTFX-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-[(2,6-Difluorophenyl)methylamino]-2-[[1-(2-methoxyethyl)pyrazol-4-yl]methyl]pyrimidine-5-carboxamide |
| Canonical SMILES | COCCn1cc(Cc2ncc(C(N)=O)c(NCc3c(F)cccc3F)n2)cn1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.71 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P52333 | JAK3 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 9.7 | IC50 | ChEMBL;BindingDB |
| O60674 | JAK2 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 8.9 | IC50 | ChEMBL;BindingDB |
| P23458 | JAK1 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 7.5 | IC50 | ChEMBL;BindingDB |