Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 513.5 BDBM50429969

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))	BDBM50429969 (CHEMBL2334647) Show SMILES FC(F)(F)c1ccccc1C(=O)N1CCN(CC1)c1nc2ccc(NC(=O)Cc3cccs3)cc2[nH]1 Show InChI InChI=1S/C25H22F3N5O2S/c26-25(27,28)19-6-2-1-5-18(19)23(35)32-9-11-33(12-10-32)24-30-20-8-7-16(14-21(20)31-24)29-22(34)15-17-4-3-13-36-17/h1-8,13-14H,9-12,15H2,(H,29,34)(H,30,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20E+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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