Ligand name: 2-methoxyethyl propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate
PDB ligand accession: NIW
DrugBank: n/a
PubChem: 529928
ChEMBL: n/a
InChI Key: SJJUCKCPGPCJQM-UHFFFAOYSA-N
SMILES: Cc1c(c(c(c(n1)C)C(=O)OC(C)C)c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Phenylpyridines

List of PDB structures and/or AlphaFold models with target protein Q96RI1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5YXL	Download	Experimental	e5yxlA1 e5yxlC1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot