Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 436.4 BDBM50371062

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 (Mus musculus)	BDBM50371062 (CHEMBL227203) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1C(F)(F)F Show InChI InChI=1S/C22H27F3N4O2/c1-15(2)9-12-26-21(30)18-7-8-20(28-27-18)29-13-10-16(11-14-29)31-19-6-4-3-5-17(19)22(23,24)25/h3-8,15-16H,9-14H2,1-2H3,(H,26,30)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
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