BDBM50058457 2-Methyl-1-(4-nitro-phenyl)-isothiourea; hydriodide::CHEMBL542857

SMILES: CS\C([NH-])=[NH+]\c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=HSFSRXRKIQKRSH-UHFFFAOYSA-O

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50058457   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50058457 (2-Methyl-1-(4-nitro-phenyl)-isothiourea; hydriodid...) Show SMILES CS\C([NH-])=[NH+]\c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C8H8N3O2S/c1-14-8(9)10-6-2-4-7(5-3-6)11(12)13/h2-5H,1H3,(H-,9,10)/q-1/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against human neuronal nitric oxide synthase in brain (nNOS).				J Med Chem 40: 1901-5 (1997) Article DOI: 10.1021/jm960785c BindingDB Entry DOI: 10.7270/Q2SJ1M94
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50058457 (2-Methyl-1-(4-nitro-phenyl)-isothiourea; hydriodid...) Show SMILES CS\C([NH-])=[NH+]\c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C8H8N3O2S/c1-14-8(9)10-6-2-4-7(5-3-6)11(12)13/h2-5H,1H3,(H-,9,10)/q-1/p+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against human vascular endothelial nitric oxide synthase.				J Med Chem 40: 1901-5 (1997) Article DOI: 10.1021/jm960785c BindingDB Entry DOI: 10.7270/Q2SJ1M94
					More data for this Ligand-Target Pair