Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 448.4 BDBM50298900

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))	BDBM50298900 ((R)-2-hydroxy-N-(2-(3-methyl-2-oxo-7-(3-(trifluoro...) Show SMILES C[C@@H](O)C(=O)NCCn1c2cc(NCc3cccc(c3)C(F)(F)F)ccc2nc(C)c1=O |r| Show InChI InChI=1S/C22H23F3N4O3/c1-13-21(32)29(9-8-26-20(31)14(2)30)19-11-17(6-7-18(19)28-13)27-12-15-4-3-5-16(10-15)22(23,24)25/h3-7,10-11,14,27,30H,8-9,12H2,1-2H3,(H,26,31)/t14-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gilead Sciences, Inc. Curated by ChEMBL					Assay Description Inhibition of stearoyl-CoA delta9 desaturase in rat microsome				Bioorg Med Chem Lett 19: 4070-4 (2009) Article DOI: 10.1016/j.bmcl.2009.06.017 BindingDB Entry DOI: 10.7270/Q2959HN8
					More data for this Ligand-Target Pair