Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50260602'   

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
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50260602 (CHEMBL493369 | N-(4-(trifluoromethoxy)phenethyl)-N...) Show SMILES CN(CCN1CCCC1)CCc1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C16H23F3N2O/c1-20(12-13-21-9-2-3-10-21)11-8-14-4-6-15(7-5-14)22-16(17,18)19/h4-7H,2-3,8-13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Displacement of [3H](+)pentazocine from opioid sigma1 receptor in rat brain homogenate				J Med Chem 51: 3322-5 (2008) Article DOI: 10.1021/jm7013666 BindingDB Entry DOI: 10.7270/Q24749N1
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