Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50321787'   

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))	BDBM50321787 ((1-benzyl-6'-methoxy-6',7'-dihydrospiro[piperidine...) Show SMILES CO[C@H]1Cc2sc(cc2C2(CCN(Cc3ccccc3)CC2)O1)[C@H](O)c1ccccc1 |r| Show InChI InChI=1S/C26H29NO3S/c1-29-24-17-22-21(16-23(31-22)25(28)20-10-6-3-7-11-20)26(30-24)12-14-27(15-13-26)18-19-8-4-2-5-9-19/h2-11,16,24-25,28H,12-15,17-18H2,1H3/t24-,25-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut f£r Pharmazeutische und Medizinische Chemie der Universit£t M£nster Curated by ChEMBL					Assay Description Displacement of [3H]-(+)pentazocine from guinea pig brain sigma 1-type opioid receptor after 120 mins by scintillation counting analysis				J Med Chem 55: 5350-60 (2012) Article DOI: 10.1021/jm300302p BindingDB Entry DOI: 10.7270/Q2VX0HMZ
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50321787 ((1-benzyl-6'-methoxy-6',7'-dihydrospiro[piperidine...) Show SMILES CO[C@H]1Cc2sc(cc2C2(CCN(Cc3ccccc3)CC2)O1)[C@H](O)c1ccccc1 |r| Show InChI InChI=1S/C26H29NO3S/c1-29-24-17-22-21(16-23(31-22)25(28)20-10-6-3-7-11-20)26(30-24)12-14-27(15-13-26)18-19-8-4-2-5-9-19/h2-11,16,24-25,28H,12-15,17-18H2,1H3/t24-,25-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut f£r Pharmazeutische und Medizinische Chemie der Universit£t M£nster Curated by ChEMBL					Assay Description Displacement of [3H]-(+)-pentazocine from sigma 1 receptor in guinea pig brain membrane				Eur J Med Chem 45: 3116-24 (2010) Article DOI: 10.1016/j.ejmech.2010.03.048 BindingDB Entry DOI: 10.7270/Q2XD11V4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50321787 ((1-benzyl-6'-methoxy-6',7'-dihydrospiro[piperidine...) Show SMILES CO[C@H]1Cc2sc(cc2C2(CCN(Cc3ccccc3)CC2)O1)[C@H](O)c1ccccc1 |r| Show InChI InChI=1S/C26H29NO3S/c1-29-24-17-22-21(16-23(31-22)25(28)20-10-6-3-7-11-20)26(30-24)12-14-27(15-13-26)18-19-8-4-2-5-9-19/h2-11,16,24-25,28H,12-15,17-18H2,1H3/t24-,25-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut f£r Pharmazeutische und Medizinische Chemie der Universit£t M£nster Curated by ChEMBL					Assay Description Displacement of [3H]-(+)-pentazocine from sigma 1 receptor in guinea pig brain membrane				Eur J Med Chem 45: 3116-24 (2010) Article DOI: 10.1016/j.ejmech.2010.03.048 BindingDB Entry DOI: 10.7270/Q2XD11V4
					More data for this Ligand-Target Pair