PDB ligand accession: TQ3
DrugBank: DB04163
PubChem:
ChEMBL:
InChI Key: BUFDQCGCADQQQY-UHFFFAOYSA-N
SMILES: c1ccc(cc1)Sc2cccc3c2c(nc(n3)N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1IA1 | Download | Experimental | e1ia1A1 e1ia1B1 | Dihydrofolate reductases Dihydrofolate reductases | LigPlot |