Ligand name: 4-{[1-METHYL-2,4-DIOXO-6-(3-PHENYLPROP-1-YN-1-YL)-1,4-DIHYDROQUINAZOLIN-3(2H)-YL]METHYL}BENZOIC ACID
PDB ligand accession: GG1
DrugBank: DB07827
PubChem: 10224181
ChEMBL: CHEMBL496942
InChI Key: FLTYDFYSVZBKOB-UHFFFAOYSA-N
SMILES: CN1c2ccc(cc2C(=O)N(C1=O)Cc3ccc(cc3)C(=O)O)C#CCc4ccccc4
Drug action: n/a

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P45452

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2OZR	Download	Experimental	e2ozrA1 e2ozrB1 e2ozrC1 e2ozrD1 e2ozrE1 e2ozrF1 e2ozrG1 e2ozrH1	Zincin-like Zincin-like Zincin-like Zincin-like Zincin-like Zincin-like Zincin-like Zincin-like	LigPlot