Ligand name: ethyl 4-(5-{[(2,4-diaminoquinazolin-6-yl)methyl]amino}-2-methoxyphenoxy)butanoate
PDB ligand accession: DQ1
DrugBank: n/a
PubChem: 16038397
ChEMBL: CHEMBL1165388
InChI Key: YUHXPHNBJFUHSN-UHFFFAOYSA-N
SMILES: CCOC(=O)CCCOc1cc(ccc1OC)NCc2ccc3c(c2)c(nc(n3)N)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazanaphthalenes
      • Subclass: Benzodiazines

List of PDB structures and/or AlphaFold models with target protein Q8T5T8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3KJS	Download	Experimental	e3kjsA2 e3kjsB2 e3kjsC3 e3kjsD2	Dihydrofolate reductases Dihydrofolate reductases Dihydrofolate reductases Dihydrofolate reductases	LigPlot