Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 479.4 BDBM50429972

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))	BDBM50429972 (CHEMBL2334644) Show SMILES CC(C)CCNC(=O)c1ccc2nc([nH]c2c1)-c1ccc(cc1)C(=O)c1ccccc1C(F)(F)F Show InChI InChI=1S/C27H24F3N3O2/c1-16(2)13-14-31-26(35)19-11-12-22-23(15-19)33-25(32-22)18-9-7-17(8-10-18)24(34)20-5-3-4-6-21(20)27(28,29)30/h3-12,15-16H,13-14H2,1-2H3,(H,31,35)(H,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.86E+3	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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