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Compile Data Set for Download or QSAR

Found 38 hits Enz. Inhib. hit(s) with all data for entry = 50047795   
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
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190499
PNG
(CHEMBL3827985)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2cccc(Cl)c2)cc1
Show InChI InChI=1S/C19H18ClN3OS/c1-21(2)15-9-7-13(8-10-15)11-17-18(24)23(19(25)22(17)3)16-6-4-5-14(20)12-16/h4-12H,1-3H3/b17-11-
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350n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190499
PNG
(CHEMBL3827985)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2cccc(Cl)c2)cc1
Show InChI InChI=1S/C19H18ClN3OS/c1-21(2)15-9-7-13(8-10-15)11-17-18(24)23(19(25)22(17)3)16-6-4-5-14(20)12-16/h4-12H,1-3H3/b17-11-
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840n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190343
PNG
(CHEMBL3827795)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2ccccc2)cc1
Show InChI InChI=1S/C19H19N3OS/c1-20(2)15-11-9-14(10-12-15)13-17-18(23)22(19(24)21(17)3)16-7-5-4-6-8-16/h4-13H,1-3H3/b17-13-
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880n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190331
PNG
(CHEMBL3828176)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C20H21N3OS/c1-14-5-9-17(10-6-14)23-19(24)18(22(4)20(23)25)13-15-7-11-16(12-8-15)21(2)3/h5-13H,1-4H3/b18-13-
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1.02E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190390
PNG
(CHEMBL3828444)
Show SMILES Oc1cc(nn1-c1ccccn1)-c1ccccc1
Show InChI InChI=1S/C14H11N3O/c18-14-10-12(11-6-2-1-3-7-11)16-17(14)13-8-4-5-9-15-13/h1-10,18H
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1.45E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190343
PNG
(CHEMBL3827795)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2ccccc2)cc1
Show InChI InChI=1S/C19H19N3OS/c1-20(2)15-11-9-14(10-12-15)13-17-18(23)22(19(24)21(17)3)16-7-5-4-6-8-16/h4-13H,1-3H3/b17-13-
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1.95E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190331
PNG
(CHEMBL3828176)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C20H21N3OS/c1-14-5-9-17(10-6-14)23-19(24)18(22(4)20(23)25)13-15-7-11-16(12-8-15)21(2)3/h5-13H,1-4H3/b18-13-
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2.33E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190497
PNG
(CHEMBL3827227)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1ccc2CCCc2c1
Show InChI InChI=1S/C20H18N2O3S/c1-21-16(11-14-6-3-7-17(23)18(14)24)19(25)22(20(21)26)15-9-8-12-4-2-5-13(12)10-15/h3,6-11,23-24H,2,4-5H2,1H3/b16-11-
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2.36E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190330
PNG
(CHEMBL3828737)
Show SMILES CCc1ccc(cc1)N1C(=O)\C(=C\c2ccc(O)cc2O)N(C)C1=S
Show InChI InChI=1S/C19H18N2O3S/c1-3-12-4-7-14(8-5-12)21-18(24)16(20(2)19(21)25)10-13-6-9-15(22)11-17(13)23/h4-11,22-23H,3H2,1-2H3/b16-10-
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2.39E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190328
PNG
(CHEMBL3827342)
Show SMILES CCc1ccc(cc1)N1C(=S)N(C)\C(=C/c2ccc(cc2)N(C)C)C1=O
Show InChI InChI=1S/C21H23N3OS/c1-5-15-6-12-18(13-7-15)24-20(25)19(23(4)21(24)26)14-16-8-10-17(11-9-16)22(2)3/h6-14H,5H2,1-4H3/b19-14-
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2.63E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190390
PNG
(CHEMBL3828444)
Show SMILES Oc1cc(nn1-c1ccccn1)-c1ccccc1
Show InChI InChI=1S/C14H11N3O/c18-14-10-12(11-6-2-1-3-7-11)16-17(14)13-8-4-5-9-15-13/h1-10,18H
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3.12E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190328
PNG
(CHEMBL3827342)
Show SMILES CCc1ccc(cc1)N1C(=S)N(C)\C(=C/c2ccc(cc2)N(C)C)C1=O
Show InChI InChI=1S/C21H23N3OS/c1-5-15-6-12-18(13-7-15)24-20(25)19(23(4)21(24)26)14-16-8-10-17(11-9-16)22(2)3/h6-14H,5H2,1-4H3/b19-14-
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4.39E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190347
PNG
(CHEMBL3827481)
Show SMILES CN1C(=S)N(C2CCCCC2)C(=O)\C1=C\c1cccc(O)c1O
Show InChI InChI=1S/C17H20N2O3S/c1-18-13(10-11-6-5-9-14(20)15(11)21)16(22)19(17(18)23)12-7-3-2-4-8-12/h5-6,9-10,12,20-21H,2-4,7-8H2,1H3/b13-10-
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6.35E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190498
PNG
(CHEMBL3827096)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1ccc2CCCc2c1
Show InChI InChI=1S/C20H18N2O3S/c1-21-17(10-14-6-8-16(23)11-18(14)24)19(25)22(20(21)26)15-7-5-12-3-2-4-13(12)9-15/h5-11,23-24H,2-4H2,1H3/b17-10-
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6.58E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190497
PNG
(CHEMBL3827227)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1ccc2CCCc2c1
Show InChI InChI=1S/C20H18N2O3S/c1-21-16(11-14-6-3-7-17(23)18(14)24)19(25)22(20(21)26)15-9-8-12-4-2-5-13(12)10-15/h3,6-11,23-24H,2,4-5H2,1H3/b16-11-
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6.63E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190498
PNG
(CHEMBL3827096)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1ccc2CCCc2c1
Show InChI InChI=1S/C20H18N2O3S/c1-21-17(10-14-6-8-16(23)11-18(14)24)19(25)22(20(21)26)15-7-5-12-3-2-4-13(12)9-15/h5-11,23-24H,2-4H2,1H3/b17-10-
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6.83E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190347
PNG
(CHEMBL3827481)
Show SMILES CN1C(=S)N(C2CCCCC2)C(=O)\C1=C\c1cccc(O)c1O
Show InChI InChI=1S/C17H20N2O3S/c1-18-13(10-11-6-5-9-14(20)15(11)21)16(22)19(17(18)23)12-7-3-2-4-8-12/h5-6,9-10,12,20-21H,2-4,7-8H2,1H3/b13-10-
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7.39E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190503
PNG
(CHEMBL3827569)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1cccc(Cl)c1
Show InChI InChI=1S/C17H13ClN2O3S/c1-19-13(8-10-4-2-7-14(21)15(10)22)16(23)20(17(19)24)12-6-3-5-11(18)9-12/h2-9,21-22H,1H3/b13-8-
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7.65E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190391
PNG
(CHEMBL3826995)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2ccc3CCCc3c2)cc1
Show InChI InChI=1S/C22H23N3OS/c1-23(2)18-10-7-15(8-11-18)13-20-21(26)25(22(27)24(20)3)19-12-9-16-5-4-6-17(16)14-19/h7-14H,4-6H2,1-3H3/b20-13-
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8.04E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190330
PNG
(CHEMBL3828737)
Show SMILES CCc1ccc(cc1)N1C(=O)\C(=C\c2ccc(O)cc2O)N(C)C1=S
Show InChI InChI=1S/C19H18N2O3S/c1-3-12-4-7-14(8-5-12)21-18(24)16(20(2)19(21)25)10-13-6-9-15(22)11-17(13)23/h4-11,22-23H,3H2,1-2H3/b16-10-
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8.40E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190503
PNG
(CHEMBL3827569)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1cccc(Cl)c1
Show InChI InChI=1S/C17H13ClN2O3S/c1-19-13(8-10-4-2-7-14(21)15(10)22)16(23)20(17(19)24)12-6-3-5-11(18)9-12/h2-9,21-22H,1H3/b13-8-
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9.31E+3n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190346
PNG
(CHEMBL3827497)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C3CCCCC3)C2=O)cc1
Show InChI InChI=1S/C19H25N3OS/c1-20(2)15-11-9-14(10-12-15)13-17-18(23)22(19(24)21(17)3)16-7-5-4-6-8-16/h9-13,16H,4-8H2,1-3H3/b17-13-
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1.23E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190391
PNG
(CHEMBL3826995)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C2=O)c2ccc3CCCc3c2)cc1
Show InChI InChI=1S/C22H23N3OS/c1-23(2)18-10-7-15(8-11-18)13-20-21(26)25(22(27)24(20)3)19-12-9-16-5-4-6-17(16)14-19/h7-14H,4-6H2,1-3H3/b20-13-
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PubMed
1.31E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190344
PNG
(CHEMBL3828498)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1ccccc1
Show InChI InChI=1S/C17H14N2O3S/c1-18-13(10-11-6-5-9-14(20)15(11)21)16(22)19(17(18)23)12-7-3-2-4-8-12/h2-10,20-21H,1H3/b13-10-
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PubMed
2.40E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190348
PNG
(CHEMBL3827421)
Show SMILES CN1C(=S)N(C2CCCCC2)C(=O)\C1=C\c1ccc(O)cc1O
Show InChI InChI=1S/C17H20N2O3S/c1-18-14(9-11-7-8-13(20)10-15(11)21)16(22)19(17(18)23)12-5-3-2-4-6-12/h7-10,12,20-21H,2-6H2,1H3/b14-9-
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2.60E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190329
PNG
(CHEMBL3827065)
Show SMILES CCc1ccc(cc1)N1C(=O)\C(=C\c2cccc(O)c2O)N(C)C1=S
Show InChI InChI=1S/C19H18N2O3S/c1-3-12-7-9-14(10-8-12)21-18(24)15(20(2)19(21)25)11-13-5-4-6-16(22)17(13)23/h4-11,22-23H,3H2,1-2H3/b15-11-
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2.64E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190341
PNG
(CHEMBL3827688)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1ccc(C)cc1
Show InChI InChI=1S/C18H16N2O3S/c1-11-6-8-13(9-7-11)20-17(23)14(19(2)18(20)24)10-12-4-3-5-15(21)16(12)22/h3-10,21-22H,1-2H3/b14-10-
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2.70E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190342
PNG
(CHEMBL3828713)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1ccc(C)cc1
Show InChI InChI=1S/C18H16N2O3S/c1-11-3-6-13(7-4-11)20-17(23)15(19(2)18(20)24)9-12-5-8-14(21)10-16(12)22/h3-10,21-22H,1-2H3/b15-9-
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PubMed
2.71E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190345
PNG
(CHEMBL3827574)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1ccccc1
Show InChI InChI=1S/C17H14N2O3S/c1-18-14(9-11-7-8-13(20)10-15(11)21)16(22)19(17(18)23)12-5-3-2-4-6-12/h2-10,20-21H,1H3/b14-9-
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2.77E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190329
PNG
(CHEMBL3827065)
Show SMILES CCc1ccc(cc1)N1C(=O)\C(=C\c2cccc(O)c2O)N(C)C1=S
Show InChI InChI=1S/C19H18N2O3S/c1-3-12-7-9-14(10-8-12)21-18(24)15(20(2)19(21)25)11-13-5-4-6-16(22)17(13)23/h4-11,22-23H,3H2,1-2H3/b15-11-
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2.79E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190327
PNG
(CHEMBL3828285)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1cccc(Cl)c1
Show InChI InChI=1S/C17H13ClN2O3S/c1-19-14(7-10-5-6-13(21)9-15(10)22)16(23)20(17(19)24)12-4-2-3-11(18)8-12/h2-9,21-22H,1H3/b14-7-
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3.38E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190345
PNG
(CHEMBL3827574)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1ccccc1
Show InChI InChI=1S/C17H14N2O3S/c1-18-14(9-11-7-8-13(20)10-15(11)21)16(22)19(17(18)23)12-5-3-2-4-6-12/h2-10,20-21H,1H3/b14-9-
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3.38E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190327
PNG
(CHEMBL3828285)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1cccc(Cl)c1
Show InChI InChI=1S/C17H13ClN2O3S/c1-19-14(7-10-5-6-13(21)9-15(10)22)16(23)20(17(19)24)12-4-2-3-11(18)8-12/h2-9,21-22H,1H3/b14-7-
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3.45E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190342
PNG
(CHEMBL3828713)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1ccc(O)cc1O)c1ccc(C)cc1
Show InChI InChI=1S/C18H16N2O3S/c1-11-3-6-13(7-4-11)20-17(23)15(19(2)18(20)24)9-12-5-8-14(21)10-16(12)22/h3-10,21-22H,1-2H3/b15-9-
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3.46E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190346
PNG
(CHEMBL3827497)
Show SMILES CN(C)c1ccc(\C=C2/N(C)C(=S)N(C3CCCCC3)C2=O)cc1
Show InChI InChI=1S/C19H25N3OS/c1-20(2)15-11-9-14(10-12-15)13-17-18(23)22(19(24)21(17)3)16-7-5-4-6-8-16/h9-13,16H,4-8H2,1-3H3/b17-13-
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3.56E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))
BDBM50190348
PNG
(CHEMBL3827421)
Show SMILES CN1C(=S)N(C2CCCCC2)C(=O)\C1=C\c1ccc(O)cc1O
Show InChI InChI=1S/C17H20N2O3S/c1-18-14(9-11-7-8-13(20)10-15(11)21)16(22)19(17(18)23)12-5-3-2-4-6-12/h7-10,12,20-21H,2-6H2,1H3/b14-9-
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3.76E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX4 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190344
PNG
(CHEMBL3828498)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1ccccc1
Show InChI InChI=1S/C17H14N2O3S/c1-18-13(10-11-6-5-9-14(20)15(11)21)16(22)19(17(18)23)12-7-3-2-4-8-12/h2-10,20-21H,1H3/b13-10-
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4.97E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair
NADPH oxidase 1


(Homo sapiens (Human))
BDBM50190341
PNG
(CHEMBL3827688)
Show SMILES CN1C(=S)N(C(=O)\C1=C\c1cccc(O)c1O)c1ccc(C)cc1
Show InChI InChI=1S/C18H16N2O3S/c1-11-6-8-13(9-7-11)20-17(23)14(19(2)18(20)24)10-12-4-3-5-15(21)16(12)22/h3-10,21-22H,1-2H3/b14-10-
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5.03E+4n/an/an/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human NOX1 expressed in Drosophila DUOX knockdown model assessed as decrease in ROS production by lucigenin chemiluminescence assay


Bioorg Med Chem 24: 4144-4151 (2016)


Article DOI: 10.1016/j.bmc.2016.06.056
BindingDB Entry DOI: 10.7270/Q2XK8HHT
More data for this
Ligand-Target Pair