Ligand name: VARENICLINE
PDB ligand accession: QMR
DrugBank: DB01273
PubChem: 5310966
ChEMBL: CHEMBL1076903
InChI Key: JQSHBVHOMNKWFT-DTORHVGOSA-N
SMILES: c1cnc2cc3c(cc2n1)C4CC3CNC4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzazepines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein I6L8L2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4AFG	Download	Experimental	e4afgA1 e4afgB1 e4afgA1 e4afgE1 e4afgE1 e4afgD1 e4afgC1 e4afgD1 e4afgC1 e4afgB1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot