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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Sigma intracellular receptor 2' and Ligand = 'BDBM349543'   
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))
BDBM349543
PNG
(US10207991, Ex. Cpd. No. 59 | US10611728, Example ...)
Show SMILES CN(C)C(=O)c1cccc2CN(Cc12)C(C)(C)CCc1ccc(O)c(OC(C)(C)C)c1
Show InChI InChI=1S/C26H36N2O3/c1-25(2,3)31-23-15-18(11-12-22(23)29)13-14-26(4,5)28-16-19-9-8-10-20(21(19)17-28)24(30)27(6)7/h8-12,15,29H,13-14,16-17H2,1-7H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
57n/an/an/an/an/an/an/an/a



COGNITION THERAPEUTICS, INC.

US Patent


Assay Description
The affinity of candidate sigma-2 ligand compounds at sigma-1 and sigma-2 receptors was also determined by displacement of different known labeled si...


US Patent US10207991 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JRG
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM349543
PNG
(US10207991, Ex. Cpd. No. 59 | US10611728, Example ...)
Show SMILES CN(C)C(=O)c1cccc2CN(Cc12)C(C)(C)CCc1ccc(O)c(OC(C)(C)C)c1
Show InChI InChI=1S/C26H36N2O3/c1-25(2,3)31-23-15-18(11-12-22(23)29)13-14-26(4,5)28-16-19-9-8-10-20(21(19)17-28)24(30)27(6)7/h8-12,15,29H,13-14,16-17H2,1-7H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
57n/an/an/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q2H13641
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Homo sapiens (Human))
BDBM349543
PNG
(US10207991, Ex. Cpd. No. 59 | US10611728, Example ...)
Show SMILES CN(C)C(=O)c1cccc2CN(Cc12)C(C)(C)CCc1ccc(O)c(OC(C)(C)C)c1
Show InChI InChI=1S/C26H36N2O3/c1-25(2,3)31-23-15-18(11-12-22(23)29)13-14-26(4,5)28-16-19-9-8-10-20(21(19)17-28)24(30)27(6)7/h8-12,15,29H,13-14,16-17H2,1-7H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
57n/an/an/an/an/an/an/an/a



COGNITION THERAPEUTICS, INC.

US Patent


Assay Description
Radioligand binding assays for Sigma-1 receptors and Sigma-2 receptors were carried out by a commercial contract research organization. For Sigma-1 b...


US Patent US10611728 (2020)


BindingDB Entry DOI: 10.7270/Q2ZG6W8R
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Homo sapiens (Human))
BDBM349543
PNG
(US10207991, Ex. Cpd. No. 59 | US10611728, Example ...)
Show SMILES CN(C)C(=O)c1cccc2CN(Cc12)C(C)(C)CCc1ccc(O)c(OC(C)(C)C)c1
Show InChI InChI=1S/C26H36N2O3/c1-25(2,3)31-23-15-18(11-12-22(23)29)13-14-26(4,5)28-16-19-9-8-10-20(21(19)17-28)24(30)27(6)7/h8-12,15,29H,13-14,16-17H2,1-7H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
57n/an/an/an/an/an/an/an/a



COGNITION THERAPEUTICS, INC.

US Patent


Assay Description
Radioligand binding assays for Sigma-1 receptors and Sigma-2 receptors were carried out by a commercial contract research organization. For Sigma-1 b...


US Patent US9796672 (2017)


BindingDB Entry DOI: 10.7270/Q2X92DFN
More data for this
Ligand-Target Pair