Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50006983'   

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))	BDBM50006983 (CHEMBL55873 | N-Adamantan-1-yl-N'-(4-methoxy-2-met...) Show SMILES COc1ccc(N=C(N)NC23CC4CC(CC(C4)C2)C3)c(C)c1 |w:6.5,TLB:17:16:19:12.11.13,17:12:19:16.18.15,13:14:18:12.11.17,THB:13:12:18:14.19.15| Show InChI InChI=1S/C19H27N3O/c1-12-5-16(23-2)3-4-17(12)21-18(20)22-19-9-13-6-14(10-19)8-15(7-13)11-19/h3-5,13-15H,6-11H2,1-2H3,(H3,20,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Institutions Curated by ChEMBL					Assay Description Displacement of [3H]-DTG from sigma opioid receptor of homogenized guinea pig whole brain				J Med Chem 34: 1867-70 (1991) BindingDB Entry DOI: 10.7270/Q21N802D
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