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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM93156'   
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


(Cavia porcellus (Guinea pig))
BDBM93156
PNG
(6-(but-1-en-2-yl)-3-[4-(piperidin-1-yl)butyl]-2,3-...)
Show SMILES CCC(=C)c1ccc2n(CCCCN3CCCCC3)c(=O)sc2c1
Show InChI InChI=1S/C20H28N2OS/c1-3-16(2)17-9-10-18-19(15-17)24-20(23)22(18)14-8-7-13-21-11-5-4-6-12-21/h9-10,15H,2-8,11-14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

2.90n/an/an/an/an/an/an/an/a



Universite de Lille



Assay Description
Binding assay using sigma receptors.


Medicinal Chemistry Research 14: 158-168 (2005)


BindingDB Entry DOI: 10.7270/Q2S75DZK
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM93156
PNG
(6-(but-1-en-2-yl)-3-[4-(piperidin-1-yl)butyl]-2,3-...)
Show SMILES CCC(=C)c1ccc2n(CCCCN3CCCCC3)c(=O)sc2c1
Show InChI InChI=1S/C20H28N2OS/c1-3-16(2)17-9-10-18-19(15-17)24-20(23)22(18)14-8-7-13-21-11-5-4-6-12-21/h9-10,15H,2-8,11-14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

13n/an/an/an/an/an/an/an/a



Universite de Lille



Assay Description
Binding assay using sigma receptors.


Medicinal Chemistry Research 14: 158-168 (2005)


BindingDB Entry DOI: 10.7270/Q2S75DZK
More data for this
Ligand-Target Pair