Ligand name: [(2~{S})-2-(6-chloranyl-7-methyl-1~{H}-benzimidazol-2-yl)-2-methyl-pyrrolidin-1-yl]-[5-methoxy-2-(1,2,3-triazol-2-yl)phenyl]methanone
PDB ligand accession: NS2
DrugBank: DB15031
PubChem: 91801202
ChEMBL: CHEMBL4297590
InChI Key: NBGABHGMJVIVBW-QHCPKHFHSA-N
SMILES: Cc1c(ccc2c1[nH]c(n2)C3(CCCN3C(=O)c4cc(ccc4n5nccn5)OC)C)Cl
Drug action: antagonist

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein O43613

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6TP3	Download	Experimental	e6tp3A1 e6tp3B1	Family A G protein-coupled receptor-like Family A G protein-coupled receptor-like	LigPlot