Ligand name: trans-4-[(4-{4-[4-(methylsulfonyl)piperidin-1-yl]-1H-indol-1-yl}pyrimidin-2-yl)amino]cyclohexanol
PDB ligand accession: 1J2
DrugBank: n/a
PubChem: n/a
ChEMBL: CHEMBL2392833
InChI Key: VUQJMYORHRVTLM-IYARVYRRSA-N
SMILES: CS(=O)(=O)C1CCN(CC1)c2cccc3c2ccn3c4ccnc(n4)NC5CCC(CC5)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein A1L4K2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4IZY	Download	Experimental	e4izyA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot