Molecule Details
| InChIKey | MLAIONZVQZBMNT-UHFFFAOYSA-N |
|---|---|
| Compound Name | 1-(pyridin-4-ylmethyl)-N-(4-(trifluoromethoxy)phenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Canonical SMILES | FC(F)(F)Oc1ccc(Nc2ncnc3c2cnn3Cc2ccncc2)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.3 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P11274 | BCR | Homo sapiens | Human | PF09036 PF00168 PF19057 PF00620 PF00621 | 6.4 | Kd | ChEMBL |
| P00519 | ABL1 | Homo sapiens | Human | PF08919 PF07714 PF00017 PF00018 | 6.4 | Kd | ChEMBL;BindingDB |
| A9UEZ6 | BCR/ABL fusion | Homo sapiens | Human | PF09036 PF08919 PF07714 PF00621 PF00017 | 6.1 | IC50 | BindingDB |