Ligand name: 3-amino-7-{(3R)-3-[(1S)-1-aminoethyl]pyrrolidin-1-yl}-1-cyclopropyl-6-fluoro-8-methylquinazoline-2,4(1H,3H)-dione
PDB ligand accession: PDQ
DrugBank: n/a
PubChem: 11325896
ChEMBL: CHEMBL383917
InChI Key: SMONLCFJGCJROJ-WDEREUQCSA-N
SMILES: Cc1c2c(cc(c1N3CCC(C3)C(C)N)F)C(=O)N(C(=O)N2C4CC4)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 Q59961

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3LTN	Download	Experimental	e3ltnB5 e3ltnA5 e3ltnC2 e3ltnB5 e3ltnA5 e3ltnD2	HTH HTH HAD domain-related HTH HTH HAD domain-related	LigPlot
4Z4Q	Download	Experimental	e4z4qA4 e4z4qB2 e4z4qA5 e4z4qA4 e4z4qB2 e4z4qB4	HTH HTH HAD domain-related HTH HTH HAD domain-related	LigPlot
3RAF	Download	Experimental	e3rafB5 e3rafA5 e3rafC1 e3rafB5 e3rafA5 e3rafD1	HTH HTH HAD domain-related HTH HTH HAD domain-related	LigPlot