Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 365.4 BDBM50371072

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)	BDBM50371072 (CHEMBL226693) Show SMILES CCCc1nc(no1)-c1ccc(nn1)N1CCC(CC1)Oc1ccccc1 Show InChI InChI=1S/C20H23N5O2/c1-2-6-19-21-20(24-27-19)17-9-10-18(23-22-17)25-13-11-16(12-14-25)26-15-7-4-3-5-8-15/h3-5,7-10,16H,2,6,11-14H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.33E+3	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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