Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 435.5 BDBM50425295

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))	BDBM50425295 (CHEMBL2315509) Show SMILES CCc1ccccc1CN1CCC2(CCN(CC2)C(=O)CNC(C)=O)Oc2ccccc12 Show InChI InChI=1S/C26H33N3O3/c1-3-21-8-4-5-9-22(21)19-29-17-14-26(32-24-11-7-6-10-23(24)29)12-15-28(16-13-26)25(31)18-27-20(2)30/h4-11H,3,12-19H2,1-2H3,(H,27,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of rat SCD1 by rat microsomal assay				Bioorg Med Chem Lett 23: 791-6 (2013) Article DOI: 10.1016/j.bmcl.2012.11.075 BindingDB Entry DOI: 10.7270/Q26H4JQ6
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