Ligand name: 1-(3-{[2-(benzyloxy)-5-chloro-3-(prop-2-en-1-yl)benzyl]amino}propyl)-3-thiophen-3-ylurea
PDB ligand accession: 2EE
DrugBank: n/a
PubChem: 73659156
ChEMBL: n/a
InChI Key: PTVMLFAESGWFGV-UHFFFAOYSA-N
SMILES: C=CCc1cc(cc(c1OCc2ccccc2)CNCCCNC(=O)Nc3ccsc3)Cl
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q38C91

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4MW6	Download	Experimental	e4mw6B1	HUP domain-like	LigPlot