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 Q8WSF8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5AIN	Download	Experimental	e5ainB1 e5ainA1 e5ainB1 e5ainC1 e5ainC1 e5ainD1 e5ainD1 e5ainE1 e5ainA1 e5ainE1	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
4AFT	Download	Experimental	e4aftA1 e4aftB1 e4aftC1 e4aftB1 e4aftD1 e4aftC1 e4aftD1 e4aftE1 e4aftA1 e4aftE1	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