Ligand name: N-(4-chlorophenyl)-N'-{(S)-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl][(2S)-piperidin-2-yl]methyl}ethanediamide
PDB ligand accession: 0KW
DrugBank: n/a
PubChem: 71295747
ChEMBL: n/a
InChI Key: CXKXTRRHRJSSBG-RDJZCZTQSA-N
SMILES: Cc1c(sc(n1)C(C2CCCCN2)NC(=O)C(=O)Nc3ccc(cc3)Cl)CCO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q0ED31

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4DKV	Download	Experimental	e4dkvA1 e4dkvA2 e4dkvB1 e4dkvB2	gp120 inner domain Ribosomal protein L31e-like Ribosomal protein L31e-like gp120 inner domain	LigPlot