Molecule Details
| InChIKey | NXCCIJQEAKMFGW-UHFFFAOYSA-N |
|---|---|
| Compound Name | [N-(2,4-Diaminopteridin-6-YL)-methyl]-dibenz[B,F]azepine |
| Canonical SMILES | Nc1nc(N)c2nc(CN3c4ccccc4C=Cc4ccccc43)cnc2n1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.57 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB08406 |
|---|---|
| Drug Name | [N-(2,4-DIAMINOPTERIDIN-6-YL)-METHYL]-DIBENZ[B,F]AZEPINE |
| CAS Number | nan |
| Groups | experimental |
| ATC Codes | nan |
| Description | nan |
Cross-references: BindingDB: 18506 CHEMBL301769 ChemSpider: 394026 PDB: PMD PubChem:446744 PubChem:99444877 ZINC: ZINC000002043425
Target Activities (3)
DrugBank Target Actions (1)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P00374 | DHFR | Dihydrofolate reductase | binder | targets |