Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50159022'   

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))	BDBM50159022 (1-Benzyl-4-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethy...) Show SMILES C(C1COc2ccccc2O1)N1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C20H24N2O2/c1-2-6-17(7-3-1)14-21-10-12-22(13-11-21)15-18-16-23-19-8-4-5-9-20(19)24-18/h1-9,18H,10-16H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15.4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Modena and Reggio Emilia Curated by ChEMBL					Assay Description Inhibitory constant against sigma receptor type 1 using 3 nM [3H]pentazocine				J Med Chem 48: 266-73 (2005) Article DOI: 10.1021/jm049433t BindingDB Entry DOI: 10.7270/Q2JH3MZW
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50159022 (1-Benzyl-4-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethy...) Show SMILES C(C1COc2ccccc2O1)N1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C20H24N2O2/c1-2-6-17(7-3-1)14-21-10-12-22(13-11-21)15-18-16-23-19-8-4-5-9-20(19)24-18/h1-9,18H,10-16H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Modena e Reggio Emilia Curated by ChEMBL					Assay Description Displacement of [3H]-(+)-pentazocine from sigma-1 receptor in guinea pig brain membranes after 150 mins by liquid scintillation counting method				Eur J Med Chem 112: 1-19 (2016) Article DOI: 10.1016/j.ejmech.2016.01.059 BindingDB Entry DOI: 10.7270/Q23J3FTB
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50159022 (1-Benzyl-4-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethy...) Show SMILES C(C1COc2ccccc2O1)N1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C20H24N2O2/c1-2-6-17(7-3-1)14-21-10-12-22(13-11-21)15-18-16-23-19-8-4-5-9-20(19)24-18/h1-9,18H,10-16H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Modena and Reggio Emilia Curated by ChEMBL					Assay Description Inhibitory constant against sigma receptor type 2 using 3 nM [3H]ditolylguanidine				J Med Chem 48: 266-73 (2005) Article DOI: 10.1021/jm049433t BindingDB Entry DOI: 10.7270/Q2JH3MZW
					More data for this Ligand-Target Pair