Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 367.3 BDBM50329991

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50329991 (2-(6-(2-fluorophenyl)pyridin-3-yl)-6-(methylsulfon...) Show SMILES CS(=O)(=O)c1ccc2nc([nH]c2c1)-c1ccc(nc1)-c1ccccc1F Show InChI InChI=1S/C19H14FN3O2S/c1-26(24,25)13-7-9-17-18(10-13)23-19(22-17)12-6-8-16(21-11-12)14-4-2-3-5-15(14)20/h2-11H,1H3,(H,22,23)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 20: 6366-9 (2010) Article DOI: 10.1016/j.bmcl.2010.09.094 BindingDB Entry DOI: 10.7270/Q20V8D1P
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Rattus norvegicus (Rat))	BDBM50329991 (2-(6-(2-fluorophenyl)pyridin-3-yl)-6-(methylsulfon...) Show SMILES CS(=O)(=O)c1ccc2nc([nH]c2c1)-c1ccc(nc1)-c1ccccc1F Show InChI InChI=1S/C19H14FN3O2S/c1-26(24,25)13-7-9-17-18(10-13)23-19(22-17)12-6-8-16(21-11-12)14-4-2-3-5-15(14)20/h2-11H,1H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of rat SCD1				Bioorg Med Chem Lett 20: 6366-9 (2010) Article DOI: 10.1016/j.bmcl.2010.09.094 BindingDB Entry DOI: 10.7270/Q20V8D1P
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase 5 (Homo sapiens (Human))	BDBM50329991 (2-(6-(2-fluorophenyl)pyridin-3-yl)-6-(methylsulfon...) Show SMILES CS(=O)(=O)c1ccc2nc([nH]c2c1)-c1ccc(nc1)-c1ccccc1F Show InChI InChI=1S/C19H14FN3O2S/c1-26(24,25)13-7-9-17-18(10-13)23-19(22-17)12-6-8-16(21-11-12)14-4-2-3-5-15(14)20/h2-11H,1H3,(H,22,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of human SCD5				Bioorg Med Chem Lett 20: 6366-9 (2010) Article DOI: 10.1016/j.bmcl.2010.09.094 BindingDB Entry DOI: 10.7270/Q20V8D1P
					More data for this Ligand-Target Pair