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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 = 'BDBM50159016'   
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))
BDBM50159016
PNG
(4-Benzyl-1-(7-methoxy-1,2,3,4-tetrahydro-naphthale...)
Show SMILES COc1ccc2CCC(CN3CCC(Cc4ccccc4)CC3)Cc2c1
Show InChI InChI=1S/C24H31NO/c1-26-24-10-9-22-8-7-21(16-23(22)17-24)18-25-13-11-20(12-14-25)15-19-5-3-2-4-6-19/h2-6,9-10,17,20-21H,7-8,11-16,18H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9.40n/an/an/an/an/an/an/an/a



Universit£ di Modena and Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibitory constant against sigma receptor type 1 using 3 nM [3H]pentazocine


J Med Chem 48: 266-73 (2005)


Article DOI: 10.1021/jm049433t
BindingDB Entry DOI: 10.7270/Q2JH3MZW
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50159016
PNG
(4-Benzyl-1-(7-methoxy-1,2,3,4-tetrahydro-naphthale...)
Show SMILES COc1ccc2CCC(CN3CCC(Cc4ccccc4)CC3)Cc2c1
Show InChI InChI=1S/C24H31NO/c1-26-24-10-9-22-8-7-21(16-23(22)17-24)18-25-13-11-20(12-14-25)15-19-5-3-2-4-6-19/h2-6,9-10,17,20-21H,7-8,11-16,18H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Universit£ di Modena and Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibitory constant against sigma receptor type 2 using 3 nM [3H]ditolylguanidine


J Med Chem 48: 266-73 (2005)


Article DOI: 10.1021/jm049433t
BindingDB Entry DOI: 10.7270/Q2JH3MZW
More data for this
Ligand-Target Pair