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Compile Data Set for Download or QSAR

Found 80 hits with Last Name = 'priede' and Initial = 'm'   
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
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501863
PNG
(US11028067, Example 4)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ccncc1)[N+]([O-])=O
Show InChI InChI=1S/C11H9N3O5S/c1-19-10-3-2-9(14(15)16)11(13-10)20(17,18)8-4-6-12-7-5-8/h2-7H,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.854n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522169
PNG
(US11161815, Example 25)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1ccc(OC(F)(F)F)cc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.03n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522162
PNG
(US11161815, Example 18)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCN1CCCCC1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.52n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501865
PNG
(US11028067, Example 6)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ncc[nH]1)[N+]([O-])=O
Show InChI InChI=1S/C9H8N4O5S/c1-18-7-3-2-6(13(14)15)8(12-7)19(16,17)9-10-4-5-11-9/h2-5H,1H3,(H,10,11)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.99n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522165
PNG
(US11161815, Example 21)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1ccc(Cl)cc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.35n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522166
PNG
(US11161815, Example 22)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1ccc(F)cc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.05n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501860
PNG
(US11028067, Example 1 | US11028067, Example 8)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ccccn1)[N+]([O-])=O
Show InChI InChI=1S/C11H9N3O5S/c1-19-9-6-5-8(14(15)16)11(13-9)20(17,18)10-4-2-3-7-12-10/h2-7H,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.5n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522173
PNG
(US11161815, Example 29)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1ccco1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.78n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501866
PNG
(US11028067, Example 7)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1nc(C)cs1)[N+]([O-])=O
Show InChI InChI=1S/C10H9N3O5S2/c1-6-5-19-10(11-6)20(16,17)9-7(13(14)15)3-4-8(12-9)18-2/h3-5H,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.90n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522164
PNG
(US11161815, Example 20)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1cccc(Cl)c1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 7.16n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522171
PNG
(US11161815, Example 27)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCCc1ccccc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 7.33n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522163
PNG
(US11161815, Example 19)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1ccccc1Cl)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 7.60n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501864
PNG
(US11028067, Example 5)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ncccn1)[N+]([O-])=O
Show InChI InChI=1S/C10H8N4O5S/c1-19-8-4-3-7(14(15)16)9(13-8)20(17,18)10-11-5-2-6-12-10/h2-6H,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 10.8n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522156
PNG
(US11161815, Example 12)
Show SMILES CCCCCCCCS(=O)(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 12.3n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522167
PNG
(US11161815, Example 23)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1ccc(C)cc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 14.5n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522145
PNG
(US11161815, Example 1)
Show SMILES COc1ccc(c(n1)S(=O)(=O)Cc1ccccc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 18.2n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522170
PNG
(US11161815, Example 26)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCc1ccccc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 18.8n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522172
PNG
(US11161815, Example 28)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCOc1ccccc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 20.3n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522168
PNG
(US11161815, Example 24)
Show SMILES COc1ccc(CS(=O)(=O)c2nc(OC)ccc2[N+]([O-])=O)cc1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 25.3n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501860
PNG
(US11028067, Example 1 | US11028067, Example 8)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ccccn1)[N+]([O-])=O
Show InChI InChI=1S/C11H9N3O5S/c1-19-9-6-5-8(14(15)16)11(13-9)20(17,18)10-4-2-3-7-12-10/h2-7H,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 26.8n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522148
PNG
(US11161815, Example 4)
Show SMILES [O-][N+](=O)c1ccc(Cl)nc1S(=O)(=O)Cc1ccccc1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 39.2n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522150
PNG
(US11161815, Example 6)
Show SMILES CCCCCCS(=O)(=O)c1nc(Cl)ccc1[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 56n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501861
PNG
(US11028067, Example 2)
Show SMILES [O-][N+](=O)c1ccc(Cl)nc1S(=O)(=O)c1ccccn1
Show InChI InChI=1S/C10H6ClN3O4S/c11-8-5-4-7(14(15)16)10(13-8)19(17,18)9-3-1-2-6-12-9/h1-6H
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 56.9n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522160
PNG
(US11161815, Example 16)
Show SMILES COC(=O)CCS(=O)(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 60.6n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522174
PNG
(US11161815, Example 30)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCc1cnccn1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 66.9n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522176
PNG
(US11161815, Example 32)
Show SMILES COc1ccc(c(n1)S(=O)Cc1ccccc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 76.5n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522158
PNG
(US11161815, Example 14)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCCCC(F)(F)F)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 96.9n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522161
PNG
(US11161815, Example 17)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCCO)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 103n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522159
PNG
(US11161815, Example 15)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCNC(C)=O)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 122n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522154
PNG
(US11161815, Example 10)
Show SMILES CCS(=O)(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 124n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522175
PNG
(US11161815, Example 31)
Show SMILES CCS(=O)c1nc(OC)ccc1N(O)=O
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 131n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522157
PNG
(US11161815, Example 13)
Show SMILES COc1ccc(c(n1)S(=O)(=O)C1CC1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 160n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522149
PNG
(US11161815, Example 5)
Show SMILES [O-][N+](=O)c1ccc(Cl)nc1S(=O)(=O)C1CCCC1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
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n/an/a 181n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522152
PNG
(US11161815, Example 8)
Show SMILES CN(C)c1ccc(c(n1)S(=O)(=O)C1CCCC1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
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antibodypedia
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n/an/a 188n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522155
PNG
(US11161815, Example 11)
Show SMILES COc1ccc(c(n1)S(=O)(=O)C(C)C)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 204n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522151
PNG
(US11161815, Example 7)
Show SMILES CN(C)c1ccc(c(n1)S(=O)(=O)Cc1ccccc1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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n/an/a 276n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522153
PNG
(US11161815, Example 9)
Show SMILES CCCCCCS(=O)(=O)c1nc(ccc1[N+]([O-])=O)N(C)C
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 333n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522147
PNG
(US11161815, Example 3)
Show SMILES CCCCCCS(=O)(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 489n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522177
PNG
(US11161815, Example 33)
Show SMILES CCCCCCCCS(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 500n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM501862
PNG
(US11028067, Example 3)
Show SMILES CN(C)c1ccc(c(n1)S(=O)(=O)c1ccccn1)[N+]([O-])=O
Show InChI InChI=1S/C12H12N4O4S/c1-15(2)10-7-6-9(16(17)18)12(14-10)21(19,20)11-5-3-4-8-13-11/h3-8H,1-2H3
PDB

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n/an/a 558n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522146
PNG
(US11161815, Example 2)
Show SMILES COc1ccc(c(n1)S(=O)(=O)C1CCCC1)[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
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US Patent
n/an/a 1.03E+3n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM522150
PNG
(US11161815, Example 6)
Show SMILES CCCCCCS(=O)(=O)c1nc(Cl)ccc1[N+]([O-])=O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 8.76E+3n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM501861
PNG
(US11028067, Example 2)
Show SMILES [O-][N+](=O)c1ccc(Cl)nc1S(=O)(=O)c1ccccn1
Show InChI InChI=1S/C10H6ClN3O4S/c11-8-5-4-7(14(15)16)10(13-8)19(17,18)9-3-1-2-6-12-9/h1-6H
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 9.89E+3n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM501863
PNG
(US11028067, Example 4)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ccncc1)[N+]([O-])=O
Show InChI InChI=1S/C11H9N3O5S/c1-19-10-3-2-9(14(15)16)11(13-10)20(17,18)8-4-6-12-7-5-8/h2-7H,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 1.12E+4n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM522148
PNG
(US11161815, Example 4)
Show SMILES [O-][N+](=O)c1ccc(Cl)nc1S(=O)(=O)Cc1ccccc1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.81E+4n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM522149
PNG
(US11161815, Example 5)
Show SMILES [O-][N+](=O)c1ccc(Cl)nc1S(=O)(=O)C1CCCC1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.05E+4n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM501860
PNG
(US11028067, Example 1 | US11028067, Example 8)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ccccn1)[N+]([O-])=O
Show InChI InChI=1S/C11H9N3O5S/c1-19-9-6-5-8(14(15)16)11(13-9)20(17,18)10-4-2-3-7-12-10/h2-7H,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.42E+4n/an/an/an/an/an/a



Oblique Therapeutics AB

US Patent


Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


US Patent US11028067 (2021)


BindingDB Entry DOI: 10.7270/Q2Q81H65
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM522177
PNG
(US11161815, Example 33)
Show SMILES CCCCCCCCS(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 8.54E+4n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM522159
PNG
(US11161815, Example 15)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCNC(C)=O)[N+]([O-])=O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM522174
PNG
(US11161815, Example 30)
Show SMILES COc1ccc(c(n1)S(=O)(=O)CCc1cnccn1)[N+]([O-])=O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Small molecule inhibition of recombinant thioredoxin reductase 1 (TrxR1) and gluthathione reductase (GR) was examined in 96-well plate format. 30 nM ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2G73HWC
More data for this
Ligand-Target Pair
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