Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50010799'   

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))	BDBM50010799 (CHEMBL81824 | N-(2-Methyl-4-nitro-phenyl)-N'-o-tol...) Show SMILES Cc1ccccc1[N-]C(N)=[NH+]c1ccc(cc1C)[N+]([O-])=O Show InChI InChI=1S/C15H15N4O2/c1-10-5-3-4-6-13(10)17-15(16)18-14-8-7-12(19(20)21)9-11(14)2/h3-9H,1-2H3,(H2-,16,17,18)/q-1/p+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
University of Oregon Curated by ChEMBL					Assay Description In vitro inhibitory activity against [3H]DTG binding to Sigma opioid receptor in guinea pig brain membrane homogenates				J Med Chem 33: 2421-9 (1990) BindingDB Entry DOI: 10.7270/Q25Q4WQ3
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50010799 (CHEMBL81824 | N-(2-Methyl-4-nitro-phenyl)-N'-o-tol...) Show SMILES Cc1ccccc1[N-]C(N)=[NH+]c1ccc(cc1C)[N+]([O-])=O Show InChI InChI=1S/C15H15N4O2/c1-10-5-3-4-6-13(10)17-15(16)18-14-8-7-12(19(20)21)9-11(14)2/h3-9H,1-2H3,(H2-,16,17,18)/q-1/p+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
University of Oregon Curated by ChEMBL					Assay Description In vitro inhibitory activity against [3H]- (+)-3-PPP binding to Sigma opioid receptor in guinea pig brain membrane homogenates				J Med Chem 33: 2421-9 (1990) BindingDB Entry DOI: 10.7270/Q25Q4WQ3
					More data for this Ligand-Target Pair