Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 381.4 BDBM50329981

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

Found 1 hit 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
Acyl-CoA desaturase 1 (Rattus norvegicus (Rat))	BDBM50329981 (2-(6-(2-fluorophenyl)pyridin-3-yl)-1-methyl-6-(met...) Show SMILES Cn1c(nc2ccc(cc12)S(C)(=O)=O)-c1ccc(nc1)-c1ccccc1F Show InChI InChI=1S/C20H16FN3O2S/c1-24-19-11-14(27(2,25)26)8-10-18(19)23-20(24)13-7-9-17(22-12-13)15-5-3-4-6-16(15)21/h3-12H,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem 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 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
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