Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 442.4 BDBM50364030

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))	BDBM50364030 (CHEMBL1950408) Show SMILES OC(=O)c1cncc(c1)-c1ccc(cc1)N1CCC(CC1)Oc1ccccc1C(F)(F)F Show InChI InChI=1S/C24H21F3N2O3/c25-24(26,27)21-3-1-2-4-22(21)32-20-9-11-29(12-10-20)19-7-5-16(6-8-19)17-13-18(23(30)31)15-28-14-17/h1-8,13-15,20H,9-12H2,(H,30,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of rat SCD1				Bioorg Med Chem Lett 21: 7281-6 (2011) Article DOI: 10.1016/j.bmcl.2011.10.040 BindingDB Entry DOI: 10.7270/Q2G44QQZ
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