Ligand name: 2-azanyl-4,4-dimethyl-6,7-dihydro-5~{H}-1-benzothiophene-3-carbonitrile
PDB ligand accession: LXK
DrugBank: n/a
PubChem: 79841256
ChEMBL: CHEMBL5219175
InChI Key: RANGIXHAOGTFIH-UHFFFAOYSA-N
SMILES: CC1(CCCc2c1c(c(s2)N)C#N)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Thiophenes
      • Subclass: Aminothiophenes

List of PDB structures and/or AlphaFold models with target protein P01116

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8AFC	Download	Experimental	e8afcA1	P-loop domains-like	LigPlot