Ligand name: (2E)-3-[4-({6-[(4-methoxyphenyl)amino]-7H-purin-2-yl}amino)-3,5-dimethylphenyl]prop-2-enenitrile
PDB ligand accession: G73
DrugBank: n/a
PubChem: 129906950
ChEMBL: n/a
InChI Key: IDEUQSZAIWGGSN-SNAWJCMRSA-N
SMILES: Cc1cc(cc(c1Nc2nc3c(c(n2)Nc4ccc(cc4)OC)[nH]cn3)C)C=CC#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Imidazopyrimidines
      • Subclass: Purines and purine derivatives

List of PDB structures and/or AlphaFold models with target protein P03366

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4I2P	Download	Experimental	e4i2pB5 e4i2pA5 e4i2pA8	Alpha-beta plaits Ribonuclease H-like Alpha-beta plaits	LigPlot