Ligand name: 3-[(3~{S})-3-[(7-chloranyl-9~{H}-pyrimido[4,5-b]indol-4-yl)-methyl-amino]piperidin-1-yl]propanenitrile
PDB ligand accession: SZW
DrugBank: n/a
PubChem: 155289352
ChEMBL: CHEMBL5081917
InChI Key: DLORPOXOKVMFDB-AWEZNQCLSA-N
SMILES: CN(c1c2c3ccc(cc3[nH]c2ncn1)Cl)C4CCCN(C4)CCC#N
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 P49841

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7B6F	Download	Experimental	e7b6fA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot