Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50099823'   

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))	BDBM50099823 (4-Bromo-1-methoxy-naphthalene-2-carboxylic acid (1...) Show SMILES COc1c(cc(Br)c2ccccc12)C(=O)N[C@@H]1CCN(C1)C1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 |wU:26.29,24.33,22.25,wD:28.32,16.17,TLB:19:21:23:26.30.25,THB:27:28:23:26.30.25,27:26:23:21.28.29,(6.46,-4.72,;7.8,-5.49,;7.81,-7.03,;9.14,-7.8,;9.14,-9.35,;7.81,-10.12,;7.8,-11.66,;6.48,-9.35,;5.14,-10.12,;3.82,-9.35,;3.82,-7.8,;5.14,-7.04,;6.48,-7.81,;10.47,-7.03,;10.46,-5.49,;11.79,-7.8,;13.12,-7,;13.1,-5.49,;15.76,-5.49,;15.76,-7.03,;14.45,-7.77,;17.08,-7.8,;18.27,-6.51,;18.27,-5.04,;19.61,-4.56,;21.01,-5.13,;20.99,-6.67,;19.99,-7.94,;18.58,-7.38,;18.58,-5.79,;19.6,-7,)| Show InChI InChI=1S/C26H31BrN2O2/c1-31-25-21-5-3-2-4-20(21)23(27)13-22(25)26(30)28-19-6-7-29(14-19)24-17-9-15-8-16(11-17)12-18(24)10-15/h2-5,13,15-19,24H,6-12,14H2,1H3,(H,28,30)/t15-,16+,17-,18+,19-,24?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wake Forest University School of Medicine Curated by ChEMBL					Assay Description Binding affinity for sigma-1 receptor measured on guinea pig brain membranes using [3H]-(+)-pentazocine as radioligand.				J Med Chem 44: 1815-26 (2001) BindingDB Entry DOI: 10.7270/Q2NK3DBZ
					More data for this Ligand-Target Pair