Ligand name: 3-{4-amino-1-[(3R)-1-propanoylpiperidin-3-yl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-N-[4-(propan-2-yl)phenyl]benzamide
PDB ligand accession: 13L
DrugBank: n/a
PubChem: 72200986
ChEMBL: n/a
InChI Key: OQUNLLPGZMGVNR-HSZRJFAPSA-N
SMILES: CCC(=O)N1CCCC(C1)n2c3c(c(n2)c4cccc(c4)C(=O)Nc5ccc(cc5)C(C)C)c(ncn3)N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q08881

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4HCU	Download	Experimental	e4hcuA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot