Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 497.6 BDBM50425268

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))	BDBM50425268 (CHEMBL2315482) Show SMILES CC(C)(C)c1ccc(CC(=O)N2CCC3(CC2)CCN(CCc2cccnc2)c2ccccc2O3)cc1 Show InChI InChI=1S/C32H39N3O2/c1-31(2,3)27-12-10-25(11-13-27)23-30(36)35-21-16-32(17-22-35)15-20-34(19-14-26-7-6-18-33-24-26)28-8-4-5-9-29(28)37-32/h4-13,18,24H,14-17,19-23H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	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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