Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50072417'   

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 (Homo sapiens (Human))	BDBM50072417 (CHEMBL3409380) Show SMILES CN(CCCN1C(=O)COc2ccc(Br)cc12)Cc1ccccc1 Show InChI InChI=1S/C19H21BrN2O2/c1-21(13-15-6-3-2-4-7-15)10-5-11-22-17-12-16(20)8-9-18(17)24-14-19(22)23/h2-4,6-9,12H,5,10-11,13-14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ Lille Nord de France Curated by ChEMBL					Assay Description Displacement of [3H](+)Pentazocine from sigma 1 receptor in human Jurkat cells after 120 mins by liquid scintillation counting analysis				Eur J Med Chem 92: 575-82 (2015) Article DOI: 10.1016/j.ejmech.2014.01.013 BindingDB Entry DOI: 10.7270/Q2ZC84JZ
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