Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Squalene synthase' and Ligand = 'BDBM50315415'   

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
Squalene synthase (Rattus norvegicus)	BDBM50315415 ((5-(3-Phenylsulfonylfuroxan-4-yloxy)-1-hydroxypent...) Show SMILES OC(CCCCOc1no[n+]([O-])c1S(=O)(=O)c1ccccc1)([P+](O)(O)[O-])[P+](O)(O)[O-] Show InChI InChI=1S/C13H18N2O12P2S/c16-13(28(18,19)20,29(21,22)23)8-4-5-9-26-11-12(15(17)27-14-11)30(24,25)10-6-2-1-3-7-10/h1-3,6-7,16H,4-5,8-9H2,(H2,18,19,20)(H2,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.95E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Torino Curated by ChEMBL					Assay Description Inhibition of squalene synthase in rat liver microsomes assessed as conversion of [1-3H]FPP to [3H]squalene level after 60 mins by liquid scintillati...				Bioorg Med Chem 18: 2428-38 (2010) Article DOI: 10.1016/j.bmc.2010.02.058 BindingDB Entry DOI: 10.7270/Q2V124ZP
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