Molecule Details
| InChIKey | QBQZTCRZECEEGK-UHFFFAOYSA-N |
|---|---|
| Compound Name | 5-(4-(Benzyloxy)-3-ethoxybenzyl)pyrimidine-2,4-diamine |
| Canonical SMILES | CCOc1cc(Cc2cnc(N)nc2N)ccc1OCc1ccccc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.01 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P00382 | dhfrI | Escherichia coli | Pathogen | PF00186 | 7.3 | Ki | ChEMBL;BindingDB |
| P13922 | Plasmodium falciparum (isolate K1 / Thailand) | Pathogen | PF00186 PF00303 | 7.2 | Ki | ChEMBL;BindingDB | |
| P00381 | folA | Lacticaseibacillus casei | Pathogen | PF00186 | 6.5 | Ki | ChEMBL;BindingDB |