Ligand name: N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}propanamide
PDB ligand accession: YUN
DrugBank: n/a
PubChem: 4709
ChEMBL: CHEMBL188762
InChI Key: WUPUZEMRHDROEO-UHFFFAOYSA-N
SMILES: CCC(=O)Nc1ccc2c(c1)c(ncn2)Nc3cccc(c3)Br
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 P00533

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4LL0	Download	Experimental	e4ll0A2 e4ll0B1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
4LRM	Download	Experimental	e4lrmA1 e4lrmB1 e4lrmC1 e4lrmD1 e4lrmE1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot