Ligand name: 3,6-dihydropyridin-1(2H)-yl(5-methyl-1H-indol-2-yl)methanone
PDB ligand accession: WDW
DrugBank: n/a
PubChem: 73352188
ChEMBL: CHEMBL2413862
InChI Key: QRPYFEVBXZYSAL-UHFFFAOYSA-N
SMILES: Cc1ccc2c(c1)cc([nH]2)C(=O)N3CCC=CC3
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P42330

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4WDW	Download	Experimental	e4wdwA1 e4wdwB1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot