Ligand name: 1-[4-({[6-amino-5-(4-phenoxyphenyl)pyrimidin-4-yl]amino}methyl)piperidin-1-yl]prop-2-en-1-one
PDB ligand accession: MZJ
DrugBank: DB15170
PubChem: 71479709
ChEMBL: CHEMBL4072833
InChI Key: QUIWHXQETADMGN-UHFFFAOYSA-N
SMILES: C=CC(=O)N1CCC(CC1)CNc2c(c(ncn2)N)c3ccc(cc3)Oc4ccccc4
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Diphenylethers

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein Q06187

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6OMU	Download	Experimental	e6omuA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot