Ligand name: 5-[(3-ethynylphenyl)amino]pyrimido[4,5-c]quinoline-8-carboxylic acid
PDB ligand accession: E1B
DrugBank: n/a
PubChem: 53326156
ChEMBL: CHEMBL1682283
InChI Key: HJGFPNFAFSFDNN-UHFFFAOYSA-N
SMILES: C#Cc1cccc(c1)Nc2c3c(cncn3)c4ccc(cc4n2)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Quinoline carboxylic acids

List of PDB structures and/or AlphaFold models with target protein P68400

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3PE2	Download	Experimental	e3pe2A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot