Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50032424'   

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))	BDBM50032424 (3-Benzyl-9-iodo-6,11-dimethyl-1,2,3,4,5,6-hexahydr...) Show SMILES CC1C2Cc3cc(I)c(O)cc3C1(C)CCN2Cc1ccccc1 |TLB:10:11:1:16.14.15,17:16:1:11.4.3| Show InChI InChI=1S/C21H24INO/c1-14-19-11-16-10-18(22)20(24)12-17(16)21(14,2)8-9-23(19)13-15-6-4-3-5-7-15/h3-7,10,12,14,19,24H,8-9,11,13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	231	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Binding affinity was measured on Sigma receptor type 1 using [3H]- pentazocine as radioligand				J Med Chem 38: 2986-9 (1995) BindingDB Entry DOI: 10.7270/Q2XK8DMX
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50032424 (3-Benzyl-9-iodo-6,11-dimethyl-1,2,3,4,5,6-hexahydr...) Show SMILES CC1C2Cc3cc(I)c(O)cc3C1(C)CCN2Cc1ccccc1 |TLB:10:11:1:16.14.15,17:16:1:11.4.3| Show InChI InChI=1S/C21H24INO/c1-14-19-11-16-10-18(22)20(24)12-17(16)21(14,2)8-9-23(19)13-15-6-4-3-5-7-15/h3-7,10,12,14,19,24H,8-9,11,13H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	597	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Binding affinity was measured on Sigma receptor type 2 using [3H]- DTG as radioligand				J Med Chem 38: 2986-9 (1995) BindingDB Entry DOI: 10.7270/Q2XK8DMX
					More data for this Ligand-Target Pair