Ligand name: 5-(4,4-DIMETHYL-2-THIOXO-1,4-DIHYDRO-2H-3,1-BENZOXAZIN-6-YL)-1-METHYL-1H-PYRROLE-2-CARBONITRILE
PDB ligand accession: T98
DrugBank: DB04787
PubChem: 4369524
ChEMBL: CHEMBL539163
InChI Key: PYVFWTPEBMRKSR-UHFFFAOYSA-N
SMILES: CC1(c2cc(ccc2NC(=S)O1)c3ccc(n3C)C#N)C
Drug action: agonist

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzoxazines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P06401

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1ZUC	Download	Experimental	e1zucB1 e1zucA1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot