Ligand name: N-(4-{[4-(methylsulfonyl)-2-nitrophenyl]amino}phenyl)acetamide
PDB ligand accession: 04T
DrugBank: n/a
PubChem: 3854043
ChEMBL: CHEMBL4112856
InChI Key: JXZXJHWSQKISBZ-UHFFFAOYSA-N
SMILES: CC(=O)Nc1ccc(cc1)Nc2ccc(cc2[N+](=O)[O-])S(=O)(=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Aniline and substituted anilines

List of PDB structures and/or AlphaFold models with target protein P30838

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4H80	Download	Experimental	e4h80A1 e4h80A2 e4h80B2 e4h80A2 e4h80B1 e4h80B2 e4h80C1 e4h80C2 e4h80G1 e4h80D1 e4h80D2 e4h80E1 e4h80D1 e4h80E1 e4h80E2 e4h80F1 e4h80F2 e4h80H2 e4h80C2 e4h80G1 e4h80G2 e4h80F2 e4h80H1 e4h80H2	ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot