Ligand name: 4-(3-chlorophenyl)-5-{2-[(3-hydroxyphenyl)amino]pyrimidin-4-yl}-2-{[2-(piperidin-1-yl)ethyl]amino}thiophene-3-carbonitrile
PDB ligand accession: E94
DrugBank: n/a
PubChem: 60147039
ChEMBL: n/a
InChI Key: PNULACZBCYZZLG-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)Cl)c2c(c(sc2c3ccnc(n3)Nc4cccc(c4)O)NCCN5CCCCC5)C#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Thiophenes
      • Subclass: Aminothiophenes

List of PDB structures and/or AlphaFold models with target protein P28482

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4FV7	Download	Experimental	e4fv7A2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot