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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50111634'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50111634
PNG
(6-{2-[4-(3,4-Dichloro-benzyl)-piperazin-1-yl]-ethy...)
Show SMILES Cn1c2ccc(CCN3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)cc2sc1=O
Show InChI InChI=1S/C21H23Cl2N3OS/c1-24-19-5-3-15(13-20(19)28-21(24)27)6-7-25-8-10-26(11-9-25)14-16-2-4-17(22)18(23)12-16/h2-5,12-13H,6-11,14H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
5n/an/an/an/an/an/an/an/a



Université de Lille 2

Curated by ChEMBL


Assay Description
In vitro binding affinity for Sigma opioid receptor by displacement of [3H]-DTG


Bioorg Med Chem Lett 12: 1149-52 (2002)


BindingDB Entry DOI: 10.7270/Q2G44PM6
More data for this
Ligand-Target Pair