Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 467.4 BDBM50429978

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))	BDBM50429978 (CHEMBL2334638) Show SMILES CC(C)CCNC(=O)c1ccc2nc([nH]c2c1)-c1ccc(Oc2ccccc2C(F)(F)F)cc1 Show InChI InChI=1S/C26H24F3N3O2/c1-16(2)13-14-30-25(33)18-9-12-21-22(15-18)32-24(31-21)17-7-10-19(11-8-17)34-23-6-4-3-5-20(23)26(27,28)29/h3-12,15-16H,13-14H2,1-2H3,(H,30,33)(H,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	434	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Deutschland GmbH Curated by ChEMBL					Assay Description Inhibition of SCD1 in Wistar rat liver microsomes using [14C] stearic acid as substrate incubated for 10 mins prior to substrate addition measured af...				Bioorg Med Chem Lett 23: 1817-22 (2013) Article DOI: 10.1016/j.bmcl.2013.01.030 BindingDB Entry DOI: 10.7270/Q2251KJJ
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