Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 378.4 BDBM50448685

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))	BDBM50448685 (CHEMBL3127659) Show SMILES Cn1cc(cn1)-c1ccc(nn1)N1CCC(CC1)N1CCc2c1cccc2F Show InChI InChI=1S/C21H23FN6/c1-26-14-15(13-23-26)19-5-6-21(25-24-19)27-10-7-16(8-11-27)28-12-9-17-18(22)3-2-4-20(17)28/h2-6,13-14,16H,7-12H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	678	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Research and Development, LLC Curated by ChEMBL					Assay Description Inhibition of SCD1 in Sprague-Dawley rat liver microsomes using stearoyl-[9,10-3H]-CoA as substrate				Bioorg Med Chem Lett 24: 1437-41 (2014) Article DOI: 10.1016/j.bmcl.2013.12.075 BindingDB Entry DOI: 10.7270/Q26M38BM
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