Ligand name: 4-(1~{H}-indol-3-yl)butan-2-one
PDB ligand accession: 9BF
DrugBank: n/a
PubChem: 246918
ChEMBL: CHEMBL4518504
InChI Key: ZJCUUXGLZWBCIL-UHFFFAOYSA-N
SMILES: CC(=O)CCc1c[nH]c2c1cccc2
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 A0A1P8VSI6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5ZFJ	Download	Experimental	e5zfjA1 e5zfjB1 e5zfjC1 e5zfjD1	jelly-roll jelly-roll jelly-roll jelly-roll	LigPlot