Ligand name: (2R)-N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-(3-morpholin-4-ylpropoxy)quinazolin-6-yl]-1-(2-fluoranylethanoyl)pyrrolidine-2-carboxamide
PDB ligand accession: 8LU
DrugBank: n/a
PubChem: 137348724
ChEMBL: n/a
InChI Key: NMRZVTKIRUUAHS-XMMPIXPASA-N
SMILES: c1cc(c(cc1Nc2c3cc(c(cc3ncn2)OCCCN4CCOCC4)NC(=O)C5CCCN5C(=O)CF)Cl)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

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
5Y25	Download	Experimental	e5y25A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot