Ligand name: 5-methyl-1-(4-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrido[3,2-b]indole-3-carbonitrile
PDB ligand accession: IY1
DrugBank: n/a
PubChem: 755493
ChEMBL: CHEMBL4225010
InChI Key: TZEXGCXFOXXFKH-UHFFFAOYSA-N
SMILES: Cn1c2ccccc2c3c1C=C(C(=O)N3c4ccc(cc4)[N+](=O)[O-])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 P03366

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6O9E	Download	Experimental	e6o9eC4 e6o9eA2	Alpha-beta plaits Alpha-beta plaits	LigPlot