Ligand name: ETHYLISOTHIOUREA
PDB ligand accession: ITU
DrugBank: DB02234
PubChem: 5139
ChEMBL: CHEMBL321691
InChI Key: VFIZBHJTOHUOEK-UHFFFAOYSA-N
SMILES: CCSC(=N)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organosulfur compounds
    • Class: Isothioureas
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P29473

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1NSE	Download	Experimental	e1nseA1 e1nseB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot
1DMK	Download	Experimental	e1dmkA1 e1dmkB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot
1DMI	Download	Experimental	e1dmiA1 e1dmiB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot
3NSE	Download	Experimental	e3nseA1 e3nseB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot
1DMJ	Download	Experimental	e1dmjA1 e1dmjB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot