Ligand name: N-(6-(4-(2h-tetrazol-5-yl)benzyl)-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2,4-dichloro-5-(morpholinosulfonyl)benzamide
PDB ligand accession: 2GN
DrugBank: n/a
PubChem: 72203912
ChEMBL: CHEMBL2408267
InChI Key: KXJHJZRFLLSTJD-UHFFFAOYSA-N
SMILES: c1cc(ccc1CN2CCc3c(sc(c3C#N)NC(=O)c4cc(c(cc4Cl)Cl)S(=O)(=O)N5CCOCC5)C2)c6n[nH]nn6
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Tetrazoles

List of PDB structures and/or AlphaFold models with target protein Q8DNV6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3ZM6	Download	Experimental	e3zm6A1 e3zm6A2 e3zm6A3	P-loop domains-like MurD-like peptide ligases, peptide-binding domain MurF and HprK N-domain-like	LigPlot