Ligand name: (R)-1-(3-(4-amino-3-(1-methyl-1H-indol-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one
PDB ligand accession: 6HJ
DrugBank: n/a
PubChem: 137348469
ChEMBL: CHEMBL4094959
InChI Key: KFYRXHYWURCCBT-CQSZACIVSA-N
SMILES: Cn1cc(c2c1cccc2)c3c4c(ncnc4n(n3)C5CCCN(C5)C(=O)C=C)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: N-alkylindoles

List of PDB structures and/or AlphaFold models with target protein P00533

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5J9Z	Download	Experimental	e5j9zA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot