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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 = 'BDBM50032423'   
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))
BDBM50032423
PNG
(7-Chloro-6,11-dimethyl-3-(3-methyl-but-2-enyl)-1,2...)
Show SMILES [#6]-[#6]1-[#6]-2-[#6]-c3ccc(-[#8])c(Cl)c3C1([#6])[#6]-[#6]-[#7]-2-[#6]\[#6]=[#6](/[#6])-[#6] |TLB:9:11:1:16.14.15,17:16:1:11.4.3|
Show InChI InChI=1S/C19H26ClNO/c1-12(2)7-9-21-10-8-19(4)13(3)15(21)11-14-5-6-16(22)18(20)17(14)19/h5-7,13,15,22H,8-11H2,1-4H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.62n/an/an/an/an/an/an/an/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)
BDBM50032423
PNG
(7-Chloro-6,11-dimethyl-3-(3-methyl-but-2-enyl)-1,2...)
Show SMILES [#6]-[#6]1-[#6]-2-[#6]-c3ccc(-[#8])c(Cl)c3C1([#6])[#6]-[#6]-[#7]-2-[#6]\[#6]=[#6](/[#6])-[#6] |TLB:9:11:1:16.14.15,17:16:1:11.4.3|
Show InChI InChI=1S/C19H26ClNO/c1-12(2)7-9-21-10-8-19(4)13(3)15(21)11-14-5-6-16(22)18(20)17(14)19/h5-7,13,15,22H,8-11H2,1-4H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.96E+3n/an/an/an/an/an/an/an/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