Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 384.7 BDBM50338527

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))	BDBM50338527 (1-(4-chloro-3-(trifluoromethyl)benzyl)-N-(1-methyl...) Show SMILES Cn1cnc(NC(=O)c2cn(Cc3ccc(Cl)c(c3)C(F)(F)F)cn2)n1 Show InChI InChI=1S/C15H12ClF3N6O/c1-24-7-21-14(23-24)22-13(26)12-6-25(8-20-12)5-9-2-3-11(16)10(4-9)15(17,18)19/h2-4,6-8H,5H2,1H3,(H,22,23,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of rat liver SCD1 using [3H]-stearoylCoA				Bioorg Med Chem Lett 21: 1621-5 (2011) Article DOI: 10.1016/j.bmcl.2011.01.113 BindingDB Entry DOI: 10.7270/Q2571C9J
					More data for this Ligand-Target Pair