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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sigma intracellular receptor 2' and Ligand = 'BDBM50523097'   
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 intracellular receptor 2


(Homo sapiens (Human))
BDBM50523097
PNG
(CHEMBL4533305)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccccn1
Show InChI InChI=1S/C20H24FN3O/c21-18-9-7-17(8-10-18)19(25)5-3-12-23-13-4-14-24(16-15-23)20-6-1-2-11-22-20/h1-2,6-11H,3-5,12-16H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
32n/an/an/an/an/an/an/an/a



Florida A&M University

Curated by ChEMBL


Assay Description
Displacement [3H]-DTG from sigma 2 receptor (unknown origin) expressed in HEK cell membranes


Bioorg Med Chem 27: 2421-2426 (2019)


Article DOI: 10.1016/j.bmc.2019.01.035
BindingDB Entry DOI: 10.7270/Q2FJ2M62
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Homo sapiens (Human))
BDBM50523097
PNG
(CHEMBL4533305)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccccn1
Show InChI InChI=1S/C20H24FN3O/c21-18-9-7-17(8-10-18)19(25)5-3-12-23-13-4-14-24(16-15-23)20-6-1-2-11-22-20/h1-2,6-11H,3-5,12-16H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
32n/an/an/an/an/an/an/an/a



Florida A&M University

Curated by ChEMBL


Assay Description
Displacement [3H]-DTG from sigma 2 receptor (unknown origin) expressed in HEK cell membranes


Bioorg Med Chem 27: 2421-2426 (2019)


Article DOI: 10.1016/j.bmc.2019.01.035
BindingDB Entry DOI: 10.7270/Q2FJ2M62
More data for this
Ligand-Target Pair