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Found 49 hits Enz. Inhib. hit(s) with Target = 'Na/K-ATPase'   
Target
(Institution)
LigandTarget
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
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50008977
PNG
((8-Benzyloxy-2-methyl-imidazo[1,2-a]pyridin-3-yl)-...)
Show SMILES Cc1nc2c(OCc3ccccc3)cccn2c1CC#N
Show InChI InChI=1S/C17H15N3O/c1-13-15(9-10-18)20-11-5-8-16(17(20)19-13)21-12-14-6-3-2-4-7-14/h2-8,11H,9,12H2,1H3
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n/an/a 101n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013237
PNG
(3-Methyl-4-(4-methyl-2,3-dihydro-pyrrolo[3,2-c]qui...)
Show SMILES Cc1cc(O)ccc1N1CCc2c1c1ccccc1nc2C
Show InChI InChI=1S/C19H18N2O/c1-12-11-14(22)7-8-18(12)21-10-9-15-13(2)20-17-6-4-3-5-16(17)19(15)21/h3-8,11,22H,9-10H2,1-2H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013243
PNG
(4-Methyl-1-o-tolyl-2,3-dihydro-1H-pyrrolo[3,2-c]qu...)
Show SMILES Cc1ccccc1N1CCc2c1c1ccccc1nc2C
Show InChI InChI=1S/C19H18N2/c1-13-7-3-6-10-18(13)21-12-11-15-14(2)20-17-9-5-4-8-16(17)19(15)21/h3-10H,11-12H2,1-2H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013240
PNG
(4,6-Dimethyl-1-o-tolyl-2,3-dihydro-1H-pyrrolo[3,2-...)
Show SMILES Cc1ccccc1N1CCc2c1c1cccc(C)c1nc2C
Show InChI InChI=1S/C20H20N2/c1-13-7-4-5-10-18(13)22-12-11-16-15(3)21-19-14(2)8-6-9-17(19)20(16)22/h4-10H,11-12H2,1-3H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000227
PNG
(2-[4-(4-Fluoro-benzyloxy)-pyridin-2-ylmethanesulfi...)
Show SMILES Fc1ccc(COc2ccnc(CS(=O)c3nc4cscc4[nH]3)c2)cc1
Show InChI InChI=1S/C18H14FN3O2S2/c19-13-3-1-12(2-4-13)8-24-15-5-6-20-14(7-15)11-26(23)18-21-16-9-25-10-17(16)22-18/h1-7,9-10H,8,11H2,(H,21,22)
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n/an/a 500n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013236
PNG
(1-(4-Methoxy-2-methyl-phenyl)-4-methyl-2,3-dihydro...)
Show SMILES COc1ccc(N2CCc3c2c2ccccc2nc3C)c(C)c1
Show InChI InChI=1S/C20H20N2O/c1-13-12-15(23-3)8-9-19(13)22-11-10-16-14(2)21-18-7-5-4-6-17(18)20(16)22/h4-9,12H,10-11H2,1-3H3
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n/an/a 530n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000672
PNG
(6-Methoxy-4-methyl-1-o-tolyl-1H-pyrrolo[3,2-c]quin...)
Show SMILES COc1cccc2c3n(ccc3c(C)nc12)-c1ccccc1C
Show InChI InChI=1S/C20H18N2O/c1-13-7-4-5-9-17(13)22-12-11-15-14(2)21-19-16(20(15)22)8-6-10-18(19)23-3/h4-12H,1-3H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013228
PNG
(6-Methoxy-4-methyl-1-o-tolyl-2,3-dihydro-1H-pyrrol...)
Show SMILES COc1cccc2c3N(CCc3c(C)nc12)c1ccccc1C
Show InChI InChI=1S/C20H20N2O/c1-13-7-4-5-9-17(13)22-12-11-15-14(2)21-19-16(20(15)22)8-6-10-18(19)23-3/h4-10H,11-12H2,1-3H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013231
PNG
(6-Fluoro-4-methyl-1-o-tolyl-2,3-dihydro-1H-pyrrolo...)
Show SMILES Cc1ccccc1N1CCc2c1c1cccc(F)c1nc2C
Show InChI InChI=1S/C19H17FN2/c1-12-6-3-4-9-17(12)22-11-10-14-13(2)21-18-15(19(14)22)7-5-8-16(18)20/h3-9H,10-11H2,1-2H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50001247
PNG
(8-Methoxy-4-o-tolylamino-quinoline-3-carboxylic ac...)
Show SMILES CCOC(=O)c1cnc2c(OC)cccc2c1Nc1ccccc1C
Show InChI InChI=1S/C20H20N2O3/c1-4-25-20(23)15-12-21-19-14(9-7-11-17(19)24-3)18(15)22-16-10-6-5-8-13(16)2/h5-12H,4H2,1-3H3,(H,21,22)
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000685
PNG
(6-Methyl-1-o-tolyl-2,3-dihydro-1H-pyrrolo[3,2-c]qu...)
Show SMILES Cc1ccccc1N1CCc2cnc3c(C)cccc3c12
Show InChI InChI=1S/C19H18N2/c1-13-6-3-4-9-17(13)21-11-10-15-12-20-18-14(2)7-5-8-16(18)19(15)21/h3-9,12H,10-11H2,1-2H3
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n/an/a 980n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013230
PNG
(6-Methoxy-1-(4-methoxy-2-methyl-phenyl)-4-methyl-2...)
Show SMILES COc1ccc(N2CCc3c2c2cccc(OC)c2nc3C)c(C)c1
Show InChI InChI=1S/C21H22N2O2/c1-13-12-15(24-3)8-9-18(13)23-11-10-16-14(2)22-20-17(21(16)23)6-5-7-19(20)25-4/h5-9,12H,10-11H2,1-4H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013233
PNG
(4-Methyl-1-o-tolyl-2,3-dihydro-1H-pyrrolo[3,2-c]qu...)
Show SMILES Cc1ccccc1N1CCc2c1c1cccc(O)c1nc2C
Show InChI InChI=1S/C19H18N2O/c1-12-6-3-4-8-16(12)21-11-10-14-13(2)20-18-15(19(14)21)7-5-9-17(18)22/h3-9,22H,10-11H2,1-2H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013229
PNG
(6-Methoxy-4,5-dimethyl-1-o-tolyl-2,3-dihydro-1H-py...)
Show SMILES COc1cccc2[c+]3N(CCc3c(C)n(C)c12)c1ccccc1C
Show InChI InChI=1S/C21H23N2O/c1-14-8-5-6-10-18(14)23-13-12-16-15(2)22(3)21-17(20(16)23)9-7-11-19(21)24-4/h5-11H,12-13H2,1-4H3/q+1
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n/an/a 1.30E+3n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013239
PNG
(1-(2,6-Dimethyl-phenyl)-4-methyl-2,3-dihydro-1H-py...)
Show SMILES Cc1cccc(C)c1N1CCc2c1c1ccccc1nc2C
Show InChI InChI=1S/C20H20N2/c1-13-7-6-8-14(2)19(13)22-12-11-16-15(3)21-18-10-5-4-9-17(18)20(16)22/h4-10H,11-12H2,1-3H3
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n/an/a 1.50E+3n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013234
PNG
(6-Methoxy-1-(2-methoxy-phenyl)-4-methyl-2,3-dihydr...)
Show SMILES COc1ccccc1N1CCc2c1c1cccc(OC)c1nc2C
Show InChI InChI=1S/C20H20N2O2/c1-13-14-11-12-22(16-8-4-5-9-17(16)23-2)20(14)15-7-6-10-18(24-3)19(15)21-13/h4-10H,11-12H2,1-3H3
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n/an/a 1.60E+3n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000259
PNG
(2-[4-(2,2,3,3,4,4,5,5-Octafluoro-pentyloxy)-pyridi...)
Show SMILES FC(F)C(F)(F)C(F)(F)C(F)(F)COc1ccnc(CS(=O)c2nc3cscc3[nH]2)c1
Show InChI InChI=1S/C16H11F8N3O2S2/c17-12(18)15(21,22)16(23,24)14(19,20)7-29-9-1-2-25-8(3-9)6-31(28)13-26-10-4-30-5-11(10)27-13/h1-5,12H,6-7H2,(H,26,27)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000211
PNG
(4,6-Dimethyl-2-[4-(2,2,2-trifluoro-ethoxy)-pyridin...)
Show SMILES Cc1sc(C)c2[nH]c(nc12)S(=O)Cc1cc(OCC(F)(F)F)ccn1
Show InChI InChI=1S/C15H14F3N3O2S2/c1-8-12-13(9(2)24-8)21-14(20-12)25(22)6-10-5-11(3-4-19-10)23-7-15(16,17)18/h3-5H,6-7H2,1-2H3,(H,20,21)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286575
PNG
(2-(2-Propyl-5-o-tolyl-thiazol-4-yl)-pyridin-4-ylam...)
Show SMILES CCCc1nc(c(s1)-c1ccccc1C)-c1cc(N)ccn1
Show InChI InChI=1S/C18H19N3S/c1-3-6-16-21-17(15-11-13(19)9-10-20-15)18(22-16)14-8-5-4-7-12(14)2/h4-5,7-11H,3,6H2,1-2H3,(H2,19,20)
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n/an/a 2.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013226
PNG
(6-Methoxy-4-methyl-1-phenyl-2,3-dihydro-1H-pyrrolo...)
Show SMILES COc1cccc2c3N(CCc3c(C)nc12)c1ccccc1
Show InChI InChI=1S/C19H18N2O/c1-13-15-11-12-21(14-7-4-3-5-8-14)19(15)16-9-6-10-17(22-2)18(16)20-13/h3-10H,11-12H2,1-2H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286576
PNG
(6-(2-Propyl-5-o-tolyl-thiazol-4-yl)-pyridin-2-ylam...)
Show SMILES CCCc1nc(c(s1)-c1ccccc1C)-c1cccc(N)n1
Show InChI InChI=1S/C18H19N3S/c1-3-7-16-21-17(14-10-6-11-15(19)20-14)18(22-16)13-9-5-4-8-12(13)2/h4-6,8-11H,3,7H2,1-2H3,(H2,19,20)
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n/an/a 2.90E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013242
PNG
(4-Methyl-1-o-tolyl-2,3-dihydro-1H-pyrrolo[3,2-c]qu...)
Show SMILES Cc1ccccc1N1CCc2c1c1ccccc1[n+]([O-])c2C
Show InChI InChI=1S/C19H18N2O/c1-13-7-3-5-9-17(13)20-12-11-15-14(2)21(22)18-10-6-4-8-16(18)19(15)20/h3-10H,11-12H2,1-2H3
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Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000199
PNG
(2-[3-Methoxy-4-(2,2,3,3-tetrafluoro-propoxy)-pyrid...)
Show SMILES COc1c(OCC(F)(F)C(F)F)ccnc1CS(=O)c1nc2cscc2[nH]1
Show InChI InChI=1S/C15H13F4N3O3S2/c1-24-12-10(6-27(23)14-21-8-4-26-5-9(8)22-14)20-3-2-11(12)25-7-15(18,19)13(16)17/h2-5,13H,6-7H2,1H3,(H,21,22)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013227
PNG
(7-Methoxy-1-o-tolyl-1,2,3,4-tetrahydro-benzo[h][1,...)
Show SMILES COc1cccc2c3N(CCCc3cnc12)c1ccccc1C
Show InChI InChI=1S/C20H20N2O/c1-14-7-3-4-10-17(14)22-12-6-8-15-13-21-19-16(20(15)22)9-5-11-18(19)23-2/h3-5,7,9-11,13H,6,8,12H2,1-2H3
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n/an/a 3.10E+3n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000222
PNG
(2-[3-Methoxy-4-(2,2,2-trifluoro-ethoxy)-pyridin-2-...)
Show SMILES COc1c(OCC(F)(F)F)ccnc1CS(=O)c1nc2cscc2[nH]1
Show InChI InChI=1S/C14H12F3N3O3S2/c1-22-12-10(18-3-2-11(12)23-7-14(15,16)17)6-25(21)13-19-8-4-24-5-9(8)20-13/h2-5H,6-7H2,1H3,(H,19,20)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286571
PNG
(2-(2,5-Di-o-tolyl-thiazol-4-yl)-pyridine | CHEMBL3...)
Show SMILES Cc1ccccc1-c1nc(c(s1)-c1ccccc1C)-c1ccccn1
Show InChI InChI=1S/C22H18N2S/c1-15-9-3-5-11-17(15)21-20(19-13-7-8-14-23-19)24-22(25-21)18-12-6-4-10-16(18)2/h3-14H,1-2H3
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n/an/a 4.90E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50292546
PNG
(3,4,5,6-tetrahydroxyxanthone | CHEMBL477921 | US91...)
Show SMILES Oc1ccc2c(oc3c(O)c(O)ccc3c2=O)c1O
Show InChI InChI=1S/C13H8O6/c14-7-3-1-5-9(16)6-2-4-8(15)11(18)13(6)19-12(5)10(7)17/h1-4,14-15,17-18H
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n/an/a 5.00E+3n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000237
PNG
(2-[4-(2,2,3,3,4,4,4-Heptafluoro-butoxy)-3-methoxy-...)
Show SMILES COc1c(OCC(F)(F)C(F)(F)C(F)(F)F)ccnc1CS(=O)c1nc2cscc2[nH]1
Show InChI InChI=1S/C16H12F7N3O3S2/c1-28-12-10(6-31(27)13-25-8-4-30-5-9(8)26-13)24-3-2-11(12)29-7-14(17,18)15(19,20)16(21,22)23/h2-5H,6-7H2,1H3,(H,25,26)
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n/an/a 7.00E+3n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286572
PNG
(2-(2-Propyl-5-o-tolyl-thiazol-4-yl)-pyridine | CHE...)
Show SMILES CCCc1nc(c(s1)-c1ccccc1C)-c1ccccn1
Show InChI InChI=1S/C18H18N2S/c1-3-8-16-20-17(15-11-6-7-12-19-15)18(21-16)14-10-5-4-9-13(14)2/h4-7,9-12H,3,8H2,1-2H3
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n/an/a 8.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286570
PNG
(2-(2-Benzyl-5-o-tolyl-thiazol-4-yl)-pyridine | CHE...)
Show SMILES Cc1ccccc1-c1sc(Cc2ccccc2)nc1-c1ccccn1
Show InChI InChI=1S/C22H18N2S/c1-16-9-5-6-12-18(16)22-21(19-13-7-8-14-23-19)24-20(25-22)15-17-10-3-2-4-11-17/h2-14H,15H2,1H3
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n/an/a 9.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013235
PNG
(1-o-Tolyl-1H-imidazo[4,5-c]quinoline | CHEMBL35727...)
Show SMILES Cc1ccccc1-n1cnc2cnc3ccccc3c12
Show InChI InChI=1S/C17H13N3/c1-12-6-2-5-9-16(12)20-11-19-15-10-18-14-8-4-3-7-13(14)17(15)20/h2-11H,1H3
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n/an/a 9.80E+3n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM174833
PNG
(3,4,5-Trihydroxy xanthone (1) | US9114126, MB5)
Show SMILES Oc1ccc2c(oc3c(O)cccc3c2=O)c1O
Show InChI InChI=1S/C13H8O5/c14-8-5-4-7-10(16)6-2-1-3-9(15)12(6)18-13(7)11(8)17/h1-5,14-15,17H
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n/an/a 1.00E+4n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013225
PNG
(1-Benzyl-6-methoxy-4-methyl-2,3-dihydro-1H-pyrrolo...)
Show SMILES COc1cccc2c3N(Cc4ccccc4)CCc3c(C)nc12
Show InChI InChI=1S/C20H20N2O/c1-14-16-11-12-22(13-15-7-4-3-5-8-15)20(16)17-9-6-10-18(23-2)19(17)21-14/h3-10H,11-13H2,1-2H3
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n/an/a 1.10E+4n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50000186
PNG
(2-[3-Methoxy-4-(2,2,3,3,4,4,5,5-octafluoro-pentylo...)
Show SMILES COc1c(OCC(F)(F)C(F)(F)C(F)(F)C(F)F)ccnc1CS(=O)c1nc2cscc2[nH]1
Show InChI InChI=1S/C17H13F8N3O3S2/c1-30-12-10(6-33(29)14-27-8-4-32-5-9(8)28-14)26-3-2-11(12)31-7-15(20,21)17(24,25)16(22,23)13(18)19/h2-5,13H,6-7H2,1H3,(H,27,28)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286573
PNG
(CHEMBL149912 | Methyl-[6-(2-propyl-5-o-tolyl-thiaz...)
Show SMILES CCCc1nc(c(s1)-c1ccccc1C)-c1cccc(NC)n1
Show InChI InChI=1S/C19H21N3S/c1-4-8-17-22-18(15-11-7-12-16(20-3)21-15)19(23-17)14-10-6-5-9-13(14)2/h5-7,9-12H,4,8H2,1-3H3,(H,20,21)
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n/an/a 1.25E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013238
PNG
(1-o-Tolyl-1,3-dihydro-imidazo[4,5-c]quinoline-2-th...)
Show SMILES Cc1ccccc1-n1c2c(cnc3ccccc23)[nH]c1=S
Show InChI InChI=1S/C17H13N3S/c1-11-6-2-5-9-15(11)20-16-12-7-3-4-8-13(12)18-10-14(16)19-17(20)21/h2-10H,1H3,(H,19,21)
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n/an/a 2.20E+4n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286574
PNG
(2-(5-Phenyl-2-propyl-thiazol-4-yl)-pyridine | CHEM...)
Show SMILES CCCc1nc(c(s1)-c1ccccc1)-c1ccccn1
Show InChI InChI=1S/C17H16N2S/c1-2-8-15-19-16(14-11-6-7-12-18-14)17(20-15)13-9-4-3-5-10-13/h3-7,9-12H,2,8H2,1H3
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n/an/a 4.23E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit H+/K+ stimulated ATPase activity in lympholised gastric vesicles


Citation and Details
More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50292547
PNG
(1,3,5,6-tetrahydroxyxanthone | 1,3,5,6-tetrahydrox...)
Show SMILES Oc1cc(O)c2c(c1)oc1c(O)c(O)ccc1c2=O
Show InChI InChI=1S/C13H8O6/c14-5-3-8(16)10-9(4-5)19-13-6(11(10)17)1-2-7(15)12(13)18/h1-4,14-16,18H
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n/an/a 6.00E+4n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50155436
PNG
(1,3,5-Trihydroxy-xanthen-9-one | CHEMBL365234 | US...)
Show SMILES Oc1cc(O)c2c(c1)oc1c(O)cccc1c2=O
Show InChI InChI=1S/C13H8O5/c14-6-4-9(16)11-10(5-6)18-13-7(12(11)17)2-1-3-8(13)15/h1-5,14-16H
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n/an/a 6.50E+4n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013241
PNG
(1-o-Tolyl-1H-[1,2,3]triazolo[4,5-c]quinoline | CHE...)
Show SMILES Cc1ccccc1-n1nnc2cnc3ccccc3c12
Show InChI InChI=1S/C16H12N4/c1-11-6-2-5-9-15(11)20-16-12-7-3-4-8-13(12)17-10-14(16)18-19-20/h2-10H,1H3
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n/an/a 6.90E+4n/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of H+/K+ ATPase activity was determined in gastric vesicles of pig using ATPase assay with pH 7


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50269645
PNG
(3,4-dihydroxyxanthone | CHEMBL446323 | US9114126, ...)
Show SMILES Oc1ccc2c(oc3ccccc3c2=O)c1O
Show InChI InChI=1S/C13H8O4/c14-9-6-5-8-11(15)7-3-1-2-4-10(7)17-13(8)12(9)16/h1-6,14,16H
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n/an/a>1.00E+5n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM174837
PNG
(US9114126, C-017)
Show SMILES COc1ccc2oc3cc(OC)c(OC)c(OC)c3c(=O)c2c1
Show InChI InChI=1S/C17H16O6/c1-19-9-5-6-11-10(7-9)15(18)14-12(23-11)8-13(20-2)16(21-3)17(14)22-4/h5-8H,1-4H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM174836
PNG
(US9114126, 2027BA2)
Show SMILES COc1cc(O)c2c(c1)oc1ccc(OC)c(O)c1c2=O
Show InChI InChI=1S/C15H12O6/c1-19-7-5-8(16)12-11(6-7)21-9-3-4-10(20-2)14(17)13(9)15(12)18/h3-6,16-17H,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM174835
PNG
(US9114126, 2027BA1)
Show SMILES COc1cc(O)c2c(c1)oc1ccc(O)c(OC)c1c2=O
Show InChI InChI=1S/C15H12O6/c1-19-7-5-9(17)12-11(6-7)21-10-4-3-8(16)15(20-2)13(10)14(12)18/h3-6,16-17H,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM174832
PNG
(US9114126, MB1)
Show SMILES Oc1cc(O)c2c(c1)oc1ccccc1c2=O
Show InChI InChI=1S/C13H8O4/c14-7-5-9(15)12-11(6-7)17-10-4-2-1-3-8(10)13(12)16/h1-6,14-15H
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n/an/a>1.00E+5n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM174834
PNG
(US9114126, MB8)
Show SMILES COc1ccc2c(c1)oc1c(OC)c(OC)ccc1c2=O
Show InChI InChI=1S/C16H14O5/c1-18-9-4-5-10-13(8-9)21-15-11(14(10)17)6-7-12(19-2)16(15)20-3/h4-8H,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



THE UNIVERSITY OF TOLEDO

US Patent


Assay Description
The purified Na/K-ATPase was prepared from pig kidney. The specific activities of Na/K-ATPase of various kidney preparations were in the range of 900...


US Patent US9114126 (2015)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50013228
PNG
(6-Methoxy-4-methyl-1-o-tolyl-2,3-dihydro-1H-pyrrol...)
Show SMILES COc1cccc2c3N(CCc3c(C)nc12)c1ccccc1C
Show InChI InChI=1S/C20H20N2O/c1-13-7-4-5-9-17(13)22-12-11-15-14(2)21-19-16(20(15)22)8-6-10-18(19)23-3/h4-10H,11-12H2,1-3H3
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PubMed
290n/an/an/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
Binding affinity of compound towards H+/K+ ATPase for activation was determined


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50001247
PNG
(8-Methoxy-4-o-tolylamino-quinoline-3-carboxylic ac...)
Show SMILES CCOC(=O)c1cnc2c(OC)cccc2c1Nc1ccccc1C
Show InChI InChI=1S/C20H20N2O3/c1-4-25-20(23)15-12-21-19-14(9-7-11-17(19)24-3)18(15)22-16-10-6-5-8-13(16)2/h5-12H,4H2,1-3H3,(H,21,22)
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290n/an/an/an/an/an/an/an/a



Smith Kline & French Research Ltd.

Curated by ChEMBL


Assay Description
Binding affinity of compound towards H+/K+ ATPase for activation was determined


J Med Chem 33: 527-33 (1990)

More data for this
Ligand-Target Pair
Na/K-ATPase


(Sus scrofa (Pig))
BDBM50286575
PNG
(2-(2-Propyl-5-o-tolyl-thiazol-4-yl)-pyridin-4-ylam...)
Show SMILES CCCc1nc(c(s1)-c1ccccc1C)-c1cc(N)ccn1
Show InChI InChI=1S/C18H19N3S/c1-3-6-16-21-17(15-11-13(19)9-10-20-15)18(22-16)14-8-5-4-7-12(14)2/h4-5,7-11H,3,6H2,1-2H3,(H2,19,20)
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Article
838n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit K+-stimulated ATPase activity


Citation and Details
More data for this
Ligand-Target Pair