Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 444.5 BDBM50445740

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)	BDBM50445740 (CHEMBL3104403) Show SMILES Cc1nc(sc1C(=O)NCc1ccccc1)-n1ccc(NC(=O)c2ccccc2)cc1=O Show InChI InChI=1S/C24H20N4O3S/c1-16-21(23(31)25-15-17-8-4-2-5-9-17)32-24(26-16)28-13-12-19(14-20(28)29)27-22(30)18-10-6-3-7-11-18/h2-14H,15H2,1H3,(H,25,31)(H,27,30)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Xenon Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of SCD1 in mouse liver microsomes				Bioorg Med Chem Lett 24: 526-31 (2014) Article DOI: 10.1016/j.bmcl.2013.12.035 BindingDB Entry DOI: 10.7270/Q20003J1
					More data for this Ligand-Target Pair