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Compile Data Set for Download or QSAR

Found 53 hits of ic50 data for polymerid = 50004574   
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 4


(Homo sapiens (Human))		BDBM50576853
PNG
(CHEMBL4859206)
Show SMILES Oc1ccccc1-c1nc(no1)-c1ccc(cc1)C(F)(F)F
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n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human NADPH oxidase 4 by quantitative sandwich enzyme immunoassay technique

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113475
BindingDB Entry DOI: 10.7270/Q2JH3R1F
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50576853
PNG
(CHEMBL4859206)
Show SMILES Oc1ccccc1-c1nc(no1)-c1ccc(cc1)C(F)(F)F
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TBA

Assay Description
Inhibition of human NADPH oxidase 4 by quantitative sandwich enzyme immunoassay technique

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113475
BindingDB Entry DOI: 10.7270/Q2JH3R1F
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50576851
PNG
(CHEMBL1876217)
Show SMILES Oc1ccccc1-c1nc(no1)-c1ccccc1
KEGG

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TBA

Assay Description
Inhibition of human NADPH oxidase 4 by quantitative sandwich enzyme immunoassay technique

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113475
BindingDB Entry DOI: 10.7270/Q2JH3R1F
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50576851
PNG
(CHEMBL1876217)
Show SMILES Oc1ccccc1-c1nc(no1)-c1ccccc1
KEGG

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TBA

Assay Description
Inhibition of human NADPH oxidase 4 by quantitative sandwich enzyme immunoassay technique

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113475
BindingDB Entry DOI: 10.7270/Q2JH3R1F
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50576852
PNG
(CHEMBL4849098)
Show SMILES Oc1ccccc1-c1nc(Cc2ccccc2)no1
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TBA

Assay Description
Inhibition of human NADPH oxidase 4 by quantitative sandwich enzyme immunoassay technique

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113475
BindingDB Entry DOI: 10.7270/Q2JH3R1F
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50576852
PNG
(CHEMBL4849098)
Show SMILES Oc1ccccc1-c1nc(Cc2ccccc2)no1
KEGG

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n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human NADPH oxidase 4 by quantitative sandwich enzyme immunoassay technique

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113475
BindingDB Entry DOI: 10.7270/Q2JH3R1F
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM2579
PNG
((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)
Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1
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n/an/a 71n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human NADPH oxidase 4 by quantitative sandwich enzyme immunoassay technique

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113475
BindingDB Entry DOI: 10.7270/Q2JH3R1F
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326495
PNG
(2,3,8,9-tetrahydroxy-5-(2-hydroxy-5-nitrobenzyl)ph...)
Show SMILES Oc1ccc(cc1Cn1c2cc(O)c(O)cc2c2cc(O)c(O)cc2c1=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N2O8/c23-15-2-1-10(22(29)30)3-9(15)8-21-14-7-19(27)17(25)5-12(14)11-4-16(24)18(26)6-13(11)20(21)28/h1-7,23-27H,8H2
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n/an/a 170n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326485
PNG
(CHEMBL1243033 | N-4-(3-Amino-phenyl)-benzo[4,5]thi...)
Show SMILES Nc1cccc(Nc2ncnc3c4cc(N)ccc4sc23)c1
Show InChI InChI=1S/C16H13N5S/c17-9-2-1-3-11(6-9)21-16-15-14(19-8-20-16)12-7-10(18)4-5-13(12)22-15/h1-8H,17-18H2,(H,19,20,21)
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n/an/a 240n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326494
PNG
(2,3,8,9-tetrahydroxy-5-(3-nitrobenzyl)phenanthridi...)
Show SMILES Oc1cc2n(Cc3cccc(c3)[N+]([O-])=O)c(=O)c3cc(O)c(O)cc3c2cc1O
Show InChI InChI=1S/C20H14N2O7/c23-16-5-12-13-6-17(24)19(26)8-15(13)21(20(27)14(12)7-18(16)25)9-10-2-1-3-11(4-10)22(28)29/h1-8,23-26H,9H2
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n/an/a 260n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50455025
PNG
(CHEMBL4208156)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H15F3N2O4S/c1-26-14-6-8-15(9-7-14)27(24,25)22-11-10-21(16(22)23)13-4-2-12(3-5-13)17(18,19)20/h2-9H,10-11H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Emory University

Curated by ChEMBL


Assay Description
Inhibition of Nox4 in HASMCs assessed as reduction in TGFbeta-induced increase in smooth muscle alpha actin level pretreated for 30 mins followed by ...

Bioorg Med Chem 26: 989-998 (2018)


Article DOI: 10.1016/j.bmc.2017.12.023
BindingDB Entry DOI: 10.7270/Q2VD722W
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326493
PNG
(2-((2,3,8,9-tetrahydroxy-6-oxophenanthridin-5(6H)-...)
Show SMILES Oc1cc2n(Cc3ccccc3C#N)c(=O)c3cc(O)c(O)cc3c2cc1O
Show InChI InChI=1S/C21H14N2O5/c22-9-11-3-1-2-4-12(11)10-23-16-8-20(27)18(25)6-14(16)13-5-17(24)19(26)7-15(13)21(23)28/h1-8,24-27H,10H2
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n/an/a 590n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50065271
PNG
(3-(4-hydroxy-3,5-diisopropylbenzylidene)indolin-2-...)
Show SMILES CC(C)c1cc(\C=C2/C(=O)Nc3ccccc23)cc(C(C)C)c1O
Show InChI InChI=1S/C21H23NO2/c1-12(2)16-9-14(10-17(13(3)4)20(16)23)11-18-15-7-5-6-8-19(15)22-21(18)24/h5-13,23H,1-4H3,(H,22,24)/b18-11-
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n/an/a 630n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM318940
PNG
(US10173988, Compound inventive)
Show SMILES Cc1ccc(cc1)N1CCN(Cc2nc(N)nc(Nc3ccc(C)c(C)c3)n2)CC1
Show InChI InChI=1S/C23H29N7/c1-16-4-8-20(9-5-16)30-12-10-29(11-13-30)15-21-26-22(24)28-23(27-21)25-19-7-6-17(2)18(3)14-19/h4-9,14H,10-13,15H2,1-3H3,(H3,24,25,26,27,28)
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US Patent
n/an/a 670n/an/an/an/an/an/a



GLUCOX BIOTECH AB

US Patent


Assay Description
Cells: HEK (CJ Nox4) stably expressing Nox4 was purchased from Redoxis AB (Lund). The adherent cells were cultivated in RPMI 1640 with L-Glutamine we...

US Patent US10173988 (2019)


BindingDB Entry DOI: 10.7270/Q2WH2S3G
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50606914
PNG
(CHEMBL5218591)
Show SMILES Cc1ccc(cc1)N1CCN(CC1)c1nc(N)nc(Nc2ccc(C)c(C)c2)n1
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n/an/a 680n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2022.114645
BindingDB Entry DOI: 10.7270/Q2SQ94GB
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 680n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326483
PNG
(2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-5-methoxy-4H...)
Show SMILES COc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12
Show InChI InChI=1S/C16H12O7/c1-22-11-5-8(17)6-12-13(11)14(20)15(21)16(23-12)7-2-3-9(18)10(19)4-7/h2-6,17-19,21H,1H3
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n/an/a 740n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326491
PNG
(3-(3,4-dihydroxyphenyl)-2,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1ccc2c(O)c(-c3ccc(O)c(O)c3)c(=O)oc2c1
Show InChI InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(20)13(14(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-19H
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n/an/a 790n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50318294
PNG
(CHEMBL1098724 | miquelianin)
Show SMILES OC[C@H]1O[C@H](Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-25,27-30H,6H2/t13-,15-,17+,18-,21-/m1/s1
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n/an/a 830n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM318937
PNG
(US10173988, Compound B)
Show SMILES COc1cccc(c1)N1CCN(Cc2nc(N)nc(Nc3ccc(C)c(Cl)c3)n2)CC1
Show InChI InChI=1S/C22H26ClN7O/c1-15-6-7-16(12-19(15)23)25-22-27-20(26-21(24)28-22)14-29-8-10-30(11-9-29)17-4-3-5-18(13-17)31-2/h3-7,12-13H,8-11,14H2,1-2H3,(H3,24,25,26,27,28)
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US Patent
n/an/a 840n/an/an/an/an/an/a



GLUCOX BIOTECH AB

US Patent


Assay Description
Cells: HEK (CJ Nox4) stably expressing Nox4 was purchased from Redoxis AB (Lund). The adherent cells were cultivated in RPMI 1640 with L-Glutamine we...

US Patent US10173988 (2019)


BindingDB Entry DOI: 10.7270/Q2WH2S3G
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM7459
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H
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n/an/a 850n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326482
PNG
((N'1E,N'2E)-N'1,N'2-bis(2,3-dihydroxybenzylidene)o...)
Show SMILES Oc1cccc(C=NNC(=O)C(=O)NN=Cc2cccc(O)c2O)c1O |w:14.13,7.7|
Show InChI InChI=1S/C16H14N4O6/c21-11-5-1-3-9(13(11)23)7-17-19-15(25)16(26)20-18-8-10-4-2-6-12(22)14(10)24/h1-8,21-24H,(H,19,25)(H,20,26)
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n/an/a 910n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50043337
PNG
(2-Hydroxy-5-(2-hydroxy-benzylamino)-benzoic acid |...)
Show SMILES OC(=O)c1cc(NCc2ccccc2O)ccc1O
Show InChI InChI=1S/C14H13NO4/c16-12-4-2-1-3-9(12)8-15-10-5-6-13(17)11(7-10)14(18)19/h1-7,15-17H,8H2,(H,18,19)
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n/an/a 960n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326490
PNG
(1,1-diallyl-3-(5-hydroxy-4,6-dimethyl-2-oxoindolin...)
Show SMILES Cc1cc2NC(=O)C(=NC(=S)N(CC=C)CC=C)c2c(C)c1O |w:8.8|
Show InChI InChI=1S/C17H19N3O2S/c1-5-7-20(8-6-2)17(23)19-14-13-11(4)15(21)10(3)9-12(13)18-16(14)22/h5-6,9,21H,1-2,7-8H2,3-4H3,(H,18,19,22,23)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326486
PNG
(CHEMBL1243031 | N'-(3,4-dihydroxybenzylidene)-2-(3...)
Show SMILES Oc1ccc(C=NNC(=O)C(=O)c2cccc(c2)[N+]([O-])=O)cc1O |w:6.6|
Show InChI InChI=1S/C15H11N3O6/c19-12-5-4-9(6-13(12)20)8-16-17-15(22)14(21)10-2-1-3-11(7-10)18(23)24/h1-8,19-20H,(H,17,22)
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n/an/a 1.02E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50240897
PNG
(2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4H...)
Show SMILES COc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(OC)c2=O
Show InChI InChI=1S/C17H14O7/c1-22-9-6-12(20)14-13(7-9)24-16(17(23-2)15(14)21)8-3-4-10(18)11(19)5-8/h3-7,18-20H,1-2H3
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n/an/a 1.02E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326484
PNG
(CHEMBL1243097 | N-4-(4-Amino-phenyl)-benzo[4,5]thi...)
Show SMILES Nc1ccc(Nc2ncnc3c4cc(N)ccc4sc23)cc1
Show InChI InChI=1S/C16H13N5S/c17-9-1-4-11(5-2-9)21-16-15-14(19-8-20-16)12-7-10(18)3-6-13(12)22-15/h1-8H,17-18H2,(H,19,20,21)
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n/an/a 1.07E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326489
PNG
(3-(3,4-dihydroxybenzylidene)-5-nitroindolin-2-one ...)
Show SMILES Oc1ccc(\C=C2/C(=O)Nc3ccc(cc23)[N+]([O-])=O)cc1O
Show InChI InChI=1S/C15H10N2O5/c18-13-4-1-8(6-14(13)19)5-11-10-7-9(17(21)22)2-3-12(10)16-15(11)20/h1-7,18-19H,(H,16,20)/b11-5-
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n/an/a 1.13E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM7458
PNG
(5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one...)
Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1
Show InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H
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n/an/a 1.13E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326487
PNG
((N'1E,N'2E)-N'1,N'2-bis(3,4-dihydroxybenzylidene)o...)
Show SMILES Oc1ccc(C=NNC(=O)C(=O)NN=Cc2ccc(O)c(O)c2)cc1O |w:13.12,6.6|
Show InChI InChI=1S/C16H14N4O6/c21-11-3-1-9(5-13(11)23)7-17-19-15(25)16(26)20-18-8-10-2-4-12(22)14(24)6-10/h1-8,21-24H,(H,19,25)(H,20,26)
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n/an/a 1.16E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM7462
PNG
(3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-...)
Show SMILES Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
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n/an/a 1.20E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50043327
PNG
(2-Hydroxy-5-(2-hydroxy-benzylamino)-benzoic acid m...)
Show SMILES COC(=O)c1cc(NCc2ccccc2O)ccc1O
Show InChI InChI=1S/C15H15NO4/c1-20-15(19)12-8-11(6-7-14(12)18)16-9-10-4-2-3-5-13(10)17/h2-8,16-18H,9H2,1H3
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n/an/a 1.27E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326481
PNG
(CHEMBL1243188 | N1-(3-aminophenyl)-N2-(4-hydroxy-3...)
Show SMILES COc1cc(CCNC(=O)C(=O)Nc2cccc(N)c2)ccc1O
Show InChI InChI=1S/C17H19N3O4/c1-24-15-9-11(5-6-14(15)21)7-8-19-16(22)17(23)20-13-4-2-3-12(18)10-13/h2-6,9-10,21H,7-8,18H2,1H3,(H,19,22)(H,20,23)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50038199
PNG
(5-(2,5-Dihydroxy-benzylamino)-2-hydroxy-benzoic ac...)
Show SMILES OC(=O)c1cc(NCc2cc(O)ccc2O)ccc1O
Show InChI InChI=1S/C14H13NO5/c16-10-2-4-12(17)8(5-10)7-15-9-1-3-13(18)11(6-9)14(19)20/h1-6,15-18H,7H2,(H,19,20)
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n/an/a 1.34E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326488
PNG
(CHEMBL1243095 | N-(3-(4-hydroxy-3-methoxybenzylide...)
Show SMILES COc1cc(\C=C2/C(=O)Nc3ccc(NC(C)=O)cc23)ccc1O
Show InChI InChI=1S/C18H16N2O4/c1-10(21)19-12-4-5-15-13(9-12)14(18(23)20-15)7-11-3-6-16(22)17(8-11)24-2/h3-9,22H,1-2H3,(H,19,21)(H,20,23)/b14-7-
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n/an/a 1.40E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM4085
PNG
(2,3,8,9-tetrahydroxy-5-[(4-nitrophenyl)methyl]-5,6...)
Show SMILES Oc1cc2n(Cc3ccc(cc3)[N+]([O-])=O)c(=O)c3cc(O)c(O)cc3c2cc1O
Show InChI InChI=1S/C20H14N2O7/c23-16-5-12-13-6-17(24)19(26)8-15(13)21(20(27)14(12)7-18(16)25)9-10-1-3-11(4-2-10)22(28)29/h1-8,23-26H,9H2
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n/an/a 1.58E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326492
PNG
(2,3,8,9-tetrahydroxy-5-(2-(phenylsulfonyl)benzyl)p...)
Show SMILES Oc1cc2n(Cc3ccccc3S(=O)(=O)c3ccccc3)c(=O)c3cc(O)c(O)cc3c2cc1O
Show InChI InChI=1S/C26H19NO7S/c28-21-10-17-18-11-22(29)24(31)13-20(18)27(26(32)19(17)12-23(21)30)14-15-6-4-5-9-25(15)35(33,34)16-7-2-1-3-8-16/h1-13,28-31H,14H2
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n/an/a 1.58E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50326480
PNG
(CHEMBL1243220 | N1-(3,4-dihydroxyphenethyl)-N2-(3-...)
Show SMILES Oc1ccc(CCNC(=O)C(=O)Nc2cccc(c2)[N+]([O-])=O)cc1O
Show InChI InChI=1S/C16H15N3O6/c20-13-5-4-10(8-14(13)21)6-7-17-15(22)16(23)18-11-2-1-3-12(9-11)19(24)25/h1-5,8-9,20-21H,6-7H2,(H,17,22)(H,18,23)
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n/an/a 1.64E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd.

Curated by ChEMBL


Assay Description
Inhibition of NOX4 expressed in HEK293 FS cells assessed as H2O2 production by H2O2/Tyr/LPO assay

J Med Chem 53: 6758-62 (2010)


Article DOI: 10.1021/jm1004368
BindingDB Entry DOI: 10.7270/Q2F18ZZ5
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM318936
PNG
(US10173988, Compound A)
Show SMILES COc1cccc(c1)N1CCN(Cc2nc(N)nc(Nc3ccc(C)c(C)c3)n2)CC1
Show InChI InChI=1S/C23H29N7O/c1-16-7-8-18(13-17(16)2)25-23-27-21(26-22(24)28-23)15-29-9-11-30(12-10-29)19-5-4-6-20(14-19)31-3/h4-8,13-14H,9-12,15H2,1-3H3,(H3,24,25,26,27,28)
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n/an/a 1.68E+3n/an/an/an/an/an/a



GLUCOX BIOTECH AB

US Patent


Assay Description
Cells: HEK (CJ Nox4) stably expressing Nox4 was purchased from Redoxis AB (Lund). The adherent cells were cultivated in RPMI 1640 with L-Glutamine we...

US Patent US10173988 (2019)


BindingDB Entry DOI: 10.7270/Q2WH2S3G
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM318938
PNG
(US10173988, Compound C)
Show SMILES Cc1cccc(c1)N1CCN(Cc2nc(N)nc(Nc3ccc(C)c(C)c3)n2)CC1
Show InChI InChI=1S/C23H29N7/c1-16-5-4-6-20(13-16)30-11-9-29(10-12-30)15-21-26-22(24)28-23(27-21)25-19-8-7-17(2)18(3)14-19/h4-8,13-14H,9-12,15H2,1-3H3,(H3,24,25,26,27,28)
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n/an/a 1.68E+3n/an/an/an/an/an/a



GLUCOX BIOTECH AB

US Patent


Assay Description
Cells: HEK (CJ Nox4) stably expressing Nox4 was purchased from Redoxis AB (Lund). The adherent cells were cultivated in RPMI 1640 with L-Glutamine we...

US Patent US10173988 (2019)


BindingDB Entry DOI: 10.7270/Q2WH2S3G
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM318939
PNG
(US10173988, Compound D)
Show SMILES Cc1ccc(Nc2nc(N)nc(CN3CCN(CC3)c3ccc(Cl)cc3)n2)cc1C
Show InChI InChI=1S/C22H26ClN7/c1-15-3-6-18(13-16(15)2)25-22-27-20(26-21(24)28-22)14-29-9-11-30(12-10-29)19-7-4-17(23)5-8-19/h3-8,13H,9-12,14H2,1-2H3,(H3,24,25,26,27,28)
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n/an/a 1.68E+3n/an/an/an/an/an/a



GLUCOX BIOTECH AB

US Patent


Assay Description
Cells: HEK (CJ Nox4) stably expressing Nox4 was purchased from Redoxis AB (Lund). The adherent cells were cultivated in RPMI 1640 with L-Glutamine we...

US Patent US10173988 (2019)


BindingDB Entry DOI: 10.7270/Q2WH2S3G
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50455023
PNG
(CHEMBL4204145)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCCN(C1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H14F4N2O3S/c18-13-4-8-15(9-5-13)27(25,26)23-11-1-10-22(16(23)24)14-6-2-12(3-7-14)17(19,20)21/h2-9H,1,10-11H2
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n/an/a 3.70E+3n/an/an/an/an/an/a



Emory University

Curated by ChEMBL


Assay Description
Inhibition of Nox4 in HASMCs assessed as reduction in TGFbeta-induced increase in smooth muscle alpha actin level pretreated for 30 mins followed by ...

Bioorg Med Chem 26: 989-998 (2018)


Article DOI: 10.1016/j.bmc.2017.12.023
BindingDB Entry DOI: 10.7270/Q2VD722W
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50455024
PNG
(CHEMBL4205860)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCCN(C1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C18H17F3N2O4S/c1-27-15-7-9-16(10-8-15)28(25,26)23-12-2-11-22(17(23)24)14-5-3-13(4-6-14)18(19,20)21/h3-10H,2,11-12H2,1H3
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n/an/a 2.70E+4n/an/an/an/an/an/a



Emory University

Curated by ChEMBL


Assay Description
Inhibition of Nox4 in HASMCs assessed as reduction in TGFbeta-induced increase in smooth muscle alpha actin level pretreated for 30 mins followed by ...

Bioorg Med Chem 26: 989-998 (2018)


Article DOI: 10.1016/j.bmc.2017.12.023
BindingDB Entry DOI: 10.7270/Q2VD722W
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50497265
PNG
(CHEMBL3347503)
Show SMILES [H][C@@]12CC(C)(C)[C@@]([H])([C@H](CC(C)=C)N1Cc1cccc(F)c1)c1ccccc21 |r,TLB:23:22:3.2:13.8,9:8:3.2:27.22,THB:14:13:3.2:27.22|
Show InChI InChI=1S/C24H28FN/c1-16(2)12-21-23-20-11-6-5-10-19(20)22(14-24(23,3)4)26(21)15-17-8-7-9-18(25)13-17/h5-11,13,21-23H,1,12,14-15H2,2-4H3/t21-,22-,23+/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of full length human NOX4 transfected in COS 22 cells assessed as inhibition of Phorbol 12-myristate 13-acetate-stimulated ROS generation ...

Medchemcomm 4: 1085-1092 (2013)


Article DOI: 10.1039/c3md00061c
BindingDB Entry DOI: 10.7270/Q2J38WJK
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50497272
PNG
(CHEMBL3347543)
Show SMILES [H][C@@]12CC(C)(C)[C@@]([H])([C@H](CC(C)=C)N1Cc1cc(C)on1)c1c(Br)cccc21 |r,TLB:22:21:3.2:13.8,9:8:3.2:27.21,THB:14:13:3.2:27.21|
Show InChI InChI=1S/C22H27BrN2O/c1-13(2)9-18-21-20-16(7-6-8-17(20)23)19(11-22(21,4)5)25(18)12-15-10-14(3)26-24-15/h6-8,10,18-19,21H,1,9,11-12H2,2-5H3/t18-,19-,21-/m0/s1
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University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of full length human NOX4 transfected in COS 22 cells assessed as inhibition of Phorbol 12-myristate 13-acetate-stimulated ROS generation ...

Medchemcomm 4: 1085-1092 (2013)


Article DOI: 10.1039/c3md00061c
BindingDB Entry DOI: 10.7270/Q2J38WJK
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50497263
PNG
(CHEMBL3347554)
Show SMILES [H][C@@]12CC(C)(C)[C@@]([H])([C@H](CC(C)=C)N1)c1c(cccc21)-c1ccc(Cl)c(Cl)c1 |r,TLB:15:14:3.2:13.8,9:8:3.2:19.14|
Show InChI InChI=1S/C23H25Cl2N/c1-13(2)10-19-22-21-15(14-8-9-17(24)18(25)11-14)6-5-7-16(21)20(26-19)12-23(22,3)4/h5-9,11,19-20,22,26H,1,10,12H2,2-4H3/t19-,20-,22-/m0/s1
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University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of full length human NOX4 transfected in COS 22 cells assessed as inhibition of Phorbol 12-myristate 13-acetate-stimulated ROS generation ...

Medchemcomm 4: 1085-1092 (2013)


Article DOI: 10.1039/c3md00061c
BindingDB Entry DOI: 10.7270/Q2J38WJK
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50497260
PNG
(CHEMBL3347567)
Show SMILES [H][C@@]12CC(C)(C)[C@@]([H])([C@H](CC(C)=C)N1CCCCC)c1c(cccc21)-c1ccc(Cl)c(Cl)c1 |r,TLB:20:19:3.2:13.8,9:8:3.2:24.19,THB:14:13:3.2:24.19|
Show InChI InChI=1S/C28H35Cl2N/c1-6-7-8-14-31-24(15-18(2)3)27-26-20(19-12-13-22(29)23(30)16-19)10-9-11-21(26)25(31)17-28(27,4)5/h9-13,16,24-25,27H,2,6-8,14-15,17H2,1,3-5H3/t24-,25-,27-/m0/s1
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University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of full length human NOX4 transfected in COS 22 cells assessed as inhibition of Phorbol 12-myristate 13-acetate-stimulated ROS generation ...

Medchemcomm 4: 1085-1092 (2013)


Article DOI: 10.1039/c3md00061c
BindingDB Entry DOI: 10.7270/Q2J38WJK
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50497271
PNG
(CHEMBL3347550)
Show SMILES [H][C@@]12CC(C)(C)[C@@]([H])([C@H](CC(C)=C)N1CCCCC)c1c(Br)cccc21 |r,TLB:9:8:19.25:3.2,20:19:13.8:3.2,THB:14:13:19.25:3.2|
Show InChI InChI=1S/C22H32BrN/c1-6-7-8-12-24-18(13-15(2)3)21-20-16(10-9-11-17(20)23)19(24)14-22(21,4)5/h9-11,18-19,21H,2,6-8,12-14H2,1,3-5H3/t18-,19-,21-/m0/s1
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University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of full length human NOX4 transfected in COS 22 cells assessed as inhibition of Phorbol 12-myristate 13-acetate-stimulated ROS generation ...

Medchemcomm 4: 1085-1092 (2013)


Article DOI: 10.1039/c3md00061c
BindingDB Entry DOI: 10.7270/Q2J38WJK
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50497273
PNG
(CHEMBL3347583)
Show SMILES [H][C@@]12CC(C)(C)[C@@]([H])([C@H](CC(C)=C)N1S(C)(=O)=O)c1c(Br)cccc21 |r,TLB:9:8:3.2:24.18,19:18:3.2:13.8,THB:14:13:3.2:24.18|
Show InChI InChI=1S/C18H24BrNO2S/c1-11(2)9-14-17-16-12(7-6-8-13(16)19)15(10-18(17,3)4)20(14)23(5,21)22/h6-8,14-15,17H,1,9-10H2,2-5H3/t14-,15-,17-/m0/s1
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University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of full length human NOX4 transfected in COS 22 cells assessed as inhibition of Phorbol 12-myristate 13-acetate-stimulated ROS generation ...

Medchemcomm 4: 1085-1092 (2013)


Article DOI: 10.1039/c3md00061c
BindingDB Entry DOI: 10.7270/Q2J38WJK
More data for this
Ligand-Target Pair
NADPH oxidase 4


(Homo sapiens (Human))		BDBM50497257
PNG
(CHEMBL3347502)
Show SMILES [H][C@@]12CC(C)(C)[C@@]([H])([C@H](CC(C)C)N1)c1c(Br)cccc21 |r,TLB:15:14:3.2:13.8,9:8:3.2:20.14|
Show InChI InChI=1S/C17H24BrN/c1-10(2)8-13-16-15-11(6-5-7-12(15)18)14(19-13)9-17(16,3)4/h5-7,10,13-14,16,19H,8-9H2,1-4H3/t13-,14-,16-/m0/s1
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University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of full length human NOX4 transfected in COS 22 cells assessed as inhibition of Phorbol 12-myristate 13-acetate-stimulated ROS generation ...

Medchemcomm 4: 1085-1092 (2013)


Article DOI: 10.1039/c3md00061c
BindingDB Entry DOI: 10.7270/Q2J38WJK
More data for this
Ligand-Target Pair
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