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Compile Data Set for Download or QSAR

Found 25 hits with Last Name = 'alam' and Initial = 'u'   
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
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445973
PNG
(CHEMBL3103095)
Show SMILES c1ccc-2c(c1)\C(=N\N=C1/c3ccccc3-c3nc4ccccc4nc13)c1nc3ccccc3nc-21
Show InChI InChI=1S/C30H16N6/c1-3-11-19-17(9-1)25-29(33-23-15-7-5-13-21(23)31-25)27(19)35-36-28-20-12-4-2-10-18(20)26-30(28)34-24-16-8-6-14-22(24)32-26/h1-16H/b35-27-,36-28+
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n/an/a 1.82E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445984
PNG
(CHEMBL3103158)
Show SMILES Brc1ccc(cc1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13BrN4O/c23-14-11-9-13(10-12-14)22(28)27-26-20-16-6-2-1-5-15(16)19-21(20)25-18-8-4-3-7-17(18)24-19/h1-12,25H
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n/an/a 2.27E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445986
PNG
(CHEMBL3103156)
Show SMILES Brc1ccccc1C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13BrN4O/c23-16-10-4-3-9-15(16)22(28)27-26-20-14-8-2-1-7-13(14)19-21(20)25-18-12-6-5-11-17(18)24-19/h1-12,25H
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n/an/a 2.31E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445976
PNG
(CHEMBL3103091)
Show SMILES [O-][N+](=O)c1ccccc1C(=O)\[NH+]=N\c1c2ccccc2c2[n-]c3ccccc3nc12
Show InChI InChI=1S/C22H13N5O3/c28-22(15-9-3-6-12-18(15)27(29)30)26-25-20-14-8-2-1-7-13(14)19-21(20)24-17-11-5-4-10-16(17)23-19/h1-12H,(H,23,24,26,28)
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n/an/a 2.35E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445983
PNG
(CHEMBL3103159)
Show SMILES Clc1ccccc1C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13ClN4O/c23-16-10-4-3-9-15(16)22(28)27-26-20-14-8-2-1-7-13(14)19-21(20)25-18-12-6-5-11-17(18)24-19/h1-12,25H
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n/an/a 2.59E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445975
PNG
(CHEMBL3103092)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)\[NH+]=N\c1c2ccccc2c2[n-]c3ccccc3nc12
Show InChI InChI=1S/C22H13N5O3/c28-22(13-9-11-14(12-10-13)27(29)30)26-25-20-16-6-2-1-5-15(16)19-21(20)24-18-8-4-3-7-17(18)23-19/h1-12H,(H,23,24,26,28)
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n/an/a 2.95E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445979
PNG
(CHEMBL3103088)
Show SMILES Ic1ccc(cc1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13IN4O/c23-14-11-9-13(10-12-14)22(28)27-26-20-16-6-2-1-5-15(16)19-21(20)25-18-8-4-3-7-17(18)24-19/h1-12,25H
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n/an/a 3.77E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM50333465
PNG
((2R,3R,4R,5R,6R)-5-((2R,3R,4R,5S,6R)-5-((2R,3R,4S,...)
Show SMILES C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/m1/s1
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n/an/a 3.83E+4n/an/an/an/an/an/a



COMSATS Institute of Information Technology, Lahore 54000, Pakistan



Assay Description
Reaction mixture (100 µL) contained 70 µL 50 mM Na2HPO4 buffer, pH 6.8, 10 µL test compound (0.5 mM), followed by the addition of 10 &...


Bioorg Chem 54: 96-104 (2014)


Article DOI: 10.1016/j.bioorg.2014.05.003
BindingDB Entry DOI: 10.7270/Q2NG4P8Q
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50333465
PNG
((2R,3R,4R,5R,6R)-5-((2R,3R,4R,5S,6R)-5-((2R,3R,4S,...)
Show SMILES C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/m1/s1
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n/an/a 3.83E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445971
PNG
(CHEMBL3103155)
Show SMILES Fc1ccc(cc1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13FN4O/c23-14-11-9-13(10-12-14)22(28)27-26-20-16-6-2-1-5-15(16)19-21(20)25-18-8-4-3-7-17(18)24-19/h1-12,25H
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n/an/a 5.34E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445977
PNG
(CHEMBL3103090)
Show SMILES Nc1ccccc1C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H15N5O/c23-16-10-4-3-9-15(16)22(28)27-26-20-14-8-2-1-7-13(14)19-21(20)25-18-12-6-5-11-17(18)24-19/h1-12,25H,23H2
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n/an/a 6.23E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM75463
PNG
(11-indeno[1,2-b]quinoxalinone | MLS000067615 | SMR...)
Show SMILES O=C1c2ccccc2-c2nc3ccccc3nc12
Show InChI InChI=1S/C15H8N2O/c18-15-10-6-2-1-5-9(10)13-14(15)17-12-8-4-3-7-11(12)16-13/h1-8H
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n/an/a 6.25E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445980
PNG
(CHEMBL3103162)
Show SMILES Ic1cccc(c1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13IN4O/c23-14-7-5-6-13(12-14)22(28)27-26-20-16-9-2-1-8-15(16)19-21(20)25-18-11-4-3-10-17(18)24-19/h1-12,25H
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n/an/a 7.75E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445972
PNG
(CHEMBL3103154)
Show SMILES Fc1cccc(c1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13FN4O/c23-14-7-5-6-13(12-14)22(28)27-26-20-16-9-2-1-8-15(16)19-21(20)25-18-11-4-3-10-17(18)24-19/h1-12,25H
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n/an/a 9.09E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445981
PNG
(CHEMBL3103161)
Show SMILES Clc1ccc(cc1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13ClN4O/c23-14-11-9-13(10-12-14)22(28)27-26-20-16-6-2-1-5-15(16)19-21(20)25-18-8-4-3-7-17(18)24-19/h1-12,25H
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n/an/a 9.99E+4n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445974
PNG
(CHEMBL3103094)
Show SMILES Oc1ccc(cc1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H14N4O2/c27-14-11-9-13(10-12-14)22(28)26-25-20-16-6-2-1-5-15(16)19-21(20)24-18-8-4-3-7-17(18)23-19/h1-12,24,27H
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n/an/a 1.02E+5n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445982
PNG
(CHEMBL3103160)
Show SMILES Clc1cccc(c1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13ClN4O/c23-14-7-5-6-13(12-14)22(28)27-26-20-16-9-2-1-8-15(16)19-21(20)25-18-11-4-3-10-17(18)24-19/h1-12,25H
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n/an/a 1.05E+5n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM112646
PNG
(Ethyl 6-methyl-4-(4-methylphenyl)-2-oxo-1,2,3,4- t...)
Show SMILES CCOC(=O)C1C(NC(=O)N=C1C)c1ccc(C)cc1
Show InChI InChI=1S/C15H18N2O3/c1-4-20-14(18)12-10(3)16-15(19)17-13(12)11-7-5-9(2)6-8-11/h5-8,12-13H,4H2,1-3H3,(H,17,19)
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n/an/a 1.12E+5n/an/an/an/an/an/a



COMSATS Institute of Information Technology, Lahore 54000, Pakistan



Assay Description
Reaction mixture (100 µL) contained 70 µL 50 mM Na2HPO4 buffer, pH 6.8, 10 µL test compound (0.5 mM), followed by the addition of 10 &...


Bioorg Chem 54: 96-104 (2014)


Article DOI: 10.1016/j.bioorg.2014.05.003
BindingDB Entry DOI: 10.7270/Q2NG4P8Q
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445985
PNG
(CHEMBL3103157)
Show SMILES Brc1cccc(c1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C22H13BrN4O/c23-14-7-5-6-13(12-14)22(28)27-26-20-16-9-2-1-8-15(16)19-21(20)25-18-11-4-3-10-17(18)24-19/h1-12,25H
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n/an/a 1.13E+5n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM112652
PNG
(()2,6-Methano-4-oxo-3,4,5,6-tetrahydro-2H- [1,3,5...)
Show SMILES CCOC(=O)[C@H]1[C@@H]2NC(=O)NC1(C)Oc1ccccc21
Show InChI InChI=1S/C14H16N2O4/c1-3-19-12(17)10-11-8-6-4-5-7-9(8)20-14(10,2)16-13(18)15-11/h4-7,10-11H,3H2,1-2H3,(H2,15,16,18)/t10-,11-,14?/m1/s1
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n/an/a 1.22E+5n/an/an/an/an/an/a



COMSATS Institute of Information Technology, Lahore 54000, Pakistan



Assay Description
Reaction mixture (100 µL) contained 70 µL 50 mM Na2HPO4 buffer, pH 6.8, 10 µL test compound (0.5 mM), followed by the addition of 10 &...


Bioorg Chem 54: 96-104 (2014)


Article DOI: 10.1016/j.bioorg.2014.05.003
BindingDB Entry DOI: 10.7270/Q2NG4P8Q
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM112651
PNG
(Ethyl 6-methyl-4-(4-methylphenyl)-2-thioxo-1,2,3,4...)
Show SMILES CCOC(=O)C1C(NC(=S)N=C1C)c1ccc(C)cc1
Show InChI InChI=1S/C15H18N2O2S/c1-4-19-14(18)12-10(3)16-15(20)17-13(12)11-7-5-9(2)6-8-11/h5-8,12-13H,4H2,1-3H3,(H,17,20)
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n/an/a 1.25E+5n/an/an/an/an/an/a



COMSATS Institute of Information Technology, Lahore 54000, Pakistan



Assay Description
Reaction mixture (100 µL) contained 70 µL 50 mM Na2HPO4 buffer, pH 6.8, 10 µL test compound (0.5 mM), followed by the addition of 10 &...


Bioorg Chem 54: 96-104 (2014)


Article DOI: 10.1016/j.bioorg.2014.05.003
BindingDB Entry DOI: 10.7270/Q2NG4P8Q
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM112642
PNG
(Ethyl 6-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropy...)
Show SMILES CCOC(=O)C1C(NC(=O)N=C1C)c1ccccc1
Show InChI InChI=1S/C14H16N2O3/c1-3-19-13(17)11-9(2)15-14(18)16-12(11)10-7-5-4-6-8-10/h4-8,11-12H,3H2,1-2H3,(H,16,18)
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n/an/a 1.43E+5n/an/an/an/an/an/a



COMSATS Institute of Information Technology, Lahore 54000, Pakistan



Assay Description
Reaction mixture (100 µL) contained 70 µL 50 mM Na2HPO4 buffer, pH 6.8, 10 µL test compound (0.5 mM), followed by the addition of 10 &...


Bioorg Chem 54: 96-104 (2014)


Article DOI: 10.1016/j.bioorg.2014.05.003
BindingDB Entry DOI: 10.7270/Q2NG4P8Q
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM112643
PNG
(Ethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4- t...)
Show SMILES CCOC(=O)C1C(NC(=O)N=C1C)c1ccc(Cl)cc1
Show InChI InChI=1S/C14H15ClN2O3/c1-3-20-13(18)11-8(2)16-14(19)17-12(11)9-4-6-10(15)7-5-9/h4-7,11-12H,3H2,1-2H3,(H,17,19)
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n/an/a 2.13E+5n/an/an/an/an/an/a



COMSATS Institute of Information Technology, Lahore 54000, Pakistan



Assay Description
Reaction mixture (100 µL) contained 70 µL 50 mM Na2HPO4 buffer, pH 6.8, 10 µL test compound (0.5 mM), followed by the addition of 10 &...


Bioorg Chem 54: 96-104 (2014)


Article DOI: 10.1016/j.bioorg.2014.05.003
BindingDB Entry DOI: 10.7270/Q2NG4P8Q
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM112645
PNG
(Ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-oxo...)
Show SMILES CCOC(=O)C1C(NC(=O)N=C1C)c1ccc(O)c(OC)c1
Show InChI InChI=1S/C15H18N2O5/c1-4-22-14(19)12-8(2)16-15(20)17-13(12)9-5-6-10(18)11(7-9)21-3/h5-7,12-13,18H,4H2,1-3H3,(H,17,20)
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n/an/a 3.05E+5n/an/an/an/an/an/a



COMSATS Institute of Information Technology, Lahore 54000, Pakistan



Assay Description
Reaction mixture (100 µL) contained 70 µL 50 mM Na2HPO4 buffer, pH 6.8, 10 µL test compound (0.5 mM), followed by the addition of 10 &...


Bioorg Chem 54: 96-104 (2014)


Article DOI: 10.1016/j.bioorg.2014.05.003
BindingDB Entry DOI: 10.7270/Q2NG4P8Q
More data for this
Ligand-Target Pair
α-glucosidase


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50445978
PNG
(CHEMBL3103089)
Show SMILES Cc1ccc(cc1)C(=O)N=Nc1c2ccccc2c2nc3ccccc3[nH]c12
Show InChI InChI=1S/C23H16N4O/c1-14-10-12-15(13-11-14)23(28)27-26-21-17-7-3-2-6-16(17)20-22(21)25-19-9-5-4-8-18(19)24-20/h2-13,25H,1H3
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of the Punjab

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 mins measured a...


Bioorg Med Chem 22: 1195-200 (2014)


Article DOI: 10.1016/j.bmc.2013.12.024
BindingDB Entry DOI: 10.7270/Q2F1916H
More data for this
Ligand-Target Pair