Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 527.9 BDBM50429986

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))	BDBM50429986 (CHEMBL2334630) Show SMILES FC(F)(F)c1ccccc1Oc1ccc2nc([nH]c2c1)-c1cccc(c1)C(=O)NCc1ccc(Cl)s1 Show InChI InChI=1S/C26H17ClF3N3O2S/c27-23-11-9-18(36-23)14-31-25(34)16-5-3-4-15(12-16)24-32-20-10-8-17(13-21(20)33-24)35-22-7-2-1-6-19(22)26(28,29)30/h1-13H,14H2,(H,31,34)(H,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.21E+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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