Ligand name: 5-(4-chlorophenyl)-N-{(S)-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl][(2R)-piperidin-2-yl]methyl}-1H-pyrrole-2-carboxamide
PDB ligand accession: 3ZM
DrugBank: n/a
PubChem: 91864545
ChEMBL: n/a
InChI Key: FITIBROTOQOZHT-XLIONFOSSA-N
SMILES: Cc1c(sc(n1)C(C2CCCCN2)NC(=O)c3ccc([nH]3)c4ccc(cc4)Cl)CO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrroles
      • Subclass: Substituted pyrroles

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
4RZ8	Download	Experimental	e4rz8A1 e4rz8A2 e4rz8B1 e4rz8B2 e4rz8C1 e4rz8C2 e4rz8B1 e4rz8D1 e4rz8D2	Ribosomal protein L31e-like gp120 inner domain gp120 inner domain Ribosomal protein L31e-like gp120 inner domain Ribosomal protein L31e-like gp120 inner domain Ribosomal protein L31e-like gp120 inner domain	LigPlot