Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 418.4 BDBM50298897

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))	BDBM50298897 (CHEMBL573828 | N-(2-(3-methyl-2-oxo-7-(3-(trifluor...) Show SMILES CC(=O)NCCn1c2cc(NCc3cccc(c3)C(F)(F)F)ccc2nc(C)c1=O Show InChI InChI=1S/C21H21F3N4O2/c1-13-20(30)28(9-8-25-14(2)29)19-11-17(6-7-18(19)27-13)26-12-15-4-3-5-16(10-15)21(22,23)24/h3-7,10-11,26H,8-9,12H2,1-2H3,(H,25,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	162	n/a	n/a	n/a	n/a	n/a	n/a
Gilead Sciences, Inc. Curated by ChEMBL					Assay Description Inhibition of stearoyl-CoA delta9 desaturase in rat microsome				Bioorg Med Chem Lett 19: 4070-4 (2009) Article DOI: 10.1016/j.bmcl.2009.06.017 BindingDB Entry DOI: 10.7270/Q2959HN8
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