Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50331307'   

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 (Cavia porcellus (Guinea pig))	BDBM50331307 (CHEMBL1289058 | trans-7-(Benzyloxy)-3-(4-phenylcyc...) Show SMILES OC1CN(CCc2cc(OCc3ccccc3)ccc12)[C@H]1CC[C@@H](CC1)c1ccccc1 |r,wU:23.29,wD:20.22,(25.44,6.92,;25.82,5.49,;27.33,5.24,;28.09,3.82,;27.44,2.39,;25.93,2.03,;24.66,3.02,;23.36,2.28,;22.08,3.02,;20.8,2.28,;19.51,3.02,;18.23,2.27,;16.94,3.01,;15.66,2.26,;15.66,.78,;16.94,.03,;18.24,.78,;22.07,4.5,;23.34,5.25,;24.65,4.52,;29.69,3.83,;30.49,2.44,;32.1,2.44,;32.9,3.82,;32.1,5.22,;30.48,5.22,;34.5,3.82,;35.29,2.43,;36.9,2.43,;37.7,3.81,;36.89,5.21,;35.29,5.2,)| Show InChI InChI=1S/C29H33NO2/c31-29-20-30(26-13-11-24(12-14-26)23-9-5-2-6-10-23)18-17-25-19-27(15-16-28(25)29)32-21-22-7-3-1-4-8-22/h1-10,15-16,19,24,26,29,31H,11-14,17-18,20-21H2/t24-,26-,29?	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	386	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut für Pharmazeutische und Medizinische Chemie der Westfälischen Wilhelms-Universität Münster Curated by ChEMBL					Assay Description Displacement of [3H]-(+)-pentazocine from sigma1 receptor guinea pig brain after 180 mins scintillation counting				Bioorg Med Chem 18: 8005-15 (2010) Article DOI: 10.1016/j.bmc.2010.09.026 BindingDB Entry DOI: 10.7270/Q28W3DJB
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