Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50359595'   

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)	BDBM50359595 (CHEMBL1927702) Show SMILES [O-][N+](=O)c1ccc2CCN(CCCCN3C(=O)c4ccccc4C3=O)Cc2c1 Show InChI InChI=1S/C21H21N3O4/c25-20-18-5-1-2-6-19(18)21(26)23(20)11-4-3-10-22-12-9-15-7-8-17(24(27)28)13-16(15)14-22/h1-2,5-8,13H,3-4,9-12,14H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	87.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin School of Medicine and Public Health Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma 1 receptor in rat liver membrane after 1.5 hrs by scintillation counting				Bioorg Med Chem 19: 7435-40 (2011) Article DOI: 10.1016/j.bmc.2011.10.046 BindingDB Entry DOI: 10.7270/Q22F7NWW
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