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Compile Data Set for Download or QSAR

Found 51 hits of ph data with Target = 'Alpha-glucosidase MAL12'   
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
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/a6.837



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/a6.837



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)
BDBM23406
PNG
((3R,4R,5S,6R)-5-{[(2R,3R,4R,5S,6R)-5-{[(2R,3R,4S,5...)
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)OC(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 4.33E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181074
PNG
((E)-N'-(2-Methoxybenzylidene)-4-(2-oxo-2H-chro...)
Show SMILES COc1ccccc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
Show InChI InChI=1S/C21H15N3O4S/c1-27-17-8-4-3-7-14(17)11-22-24-19(25)20-23-16(12-29-20)15-10-13-6-2-5-9-18(13)28-21(15)26/h2-12H,1H3,(H,24,25)/b22-11+
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n/an/a 6.43E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181073
PNG
((E)-N'-(3-bromobenzylidene)-4-(2-oxo-2H-chrome...)
Show SMILES Brc1cccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c1
Show InChI InChI=1S/C20H12BrN3O3S/c21-14-6-3-4-12(8-14)10-22-24-18(25)19-23-16(11-28-19)15-9-13-5-1-2-7-17(13)27-20(15)26/h1-11H,(H,24,25)/b22-10+
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n/an/a 1.40E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
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/a6.837



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)
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/a6.837



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/a6.837



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)
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/a6.837



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)
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/a6.837



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)
BDBM181058
PNG
((E)-N'-(4-Methoxybenzylidene)-4-(2-oxo-2H-chro...)
Show SMILES COc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
Show InChI InChI=1S/C21H15N3O4S/c1-27-15-8-6-13(7-9-15)11-22-24-19(25)20-23-17(12-29-20)16-10-14-4-2-3-5-18(14)28-21(16)26/h2-12H,1H3,(H,24,25)/b22-11+
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n/an/a 8.17E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181059
PNG
((E)-N'-(2-Hydroxybenzylidene)-4-(2-oxo-2H-chro...)
Show SMILES Oc1ccccc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
Show InChI InChI=1S/C20H13N3O4S/c24-16-7-3-1-6-13(16)10-21-23-18(25)19-22-15(11-28-19)14-9-12-5-2-4-8-17(12)27-20(14)26/h1-11,24H,(H,23,25)/b21-10+
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n/an/a 3.72E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181060
PNG
((E)-N'-(4-Hydroxybenzylidene)-4-(2-oxo-2H-chro...)
Show SMILES Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
Show InChI InChI=1S/C20H13N3O4S/c24-14-7-5-12(6-8-14)10-21-23-18(25)19-22-16(11-28-19)15-9-13-3-1-2-4-17(13)27-20(15)26/h1-11,24H,(H,23,25)/b21-10+
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n/an/a 2.52E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181061
PNG
((E)-N'-(3,5-Di-tert-butyl-2-hydroxybenzylidene...)
Show SMILES CC(C)(C)c1cc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c(O)c(c1)C(C)(C)C
Show InChI InChI=1S/C28H29N3O4S/c1-27(2,3)18-11-17(23(32)20(13-18)28(4,5)6)14-29-31-24(33)25-30-21(15-36-25)19-12-16-9-7-8-10-22(16)35-26(19)34/h7-15,32H,1-6H3,(H,31,33)/b29-14+
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n/an/a 1.02E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181062
PNG
((E)-N'-(3,5-Dichloro-2-hydroxybenzylidene)-4-(...)
Show SMILES Oc1c(Cl)cc(Cl)cc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
Show InChI InChI=1S/C20H11Cl2N3O4S/c21-12-5-11(17(26)14(22)7-12)8-23-25-18(27)19-24-15(9-30-19)13-6-10-3-1-2-4-16(10)29-20(13)28/h1-9,26H,(H,25,27)/b23-8+
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n/an/a 6.24E+3n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181063
PNG
((E)-N'-(3-Fluoro-4-hydroxybenzylidene)-4-(2-ox...)
Show SMILES Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1F
Show InChI InChI=1S/C20H12FN3O4S/c21-14-7-11(5-6-16(14)25)9-22-24-18(26)19-23-15(10-29-19)13-8-12-3-1-2-4-17(12)28-20(13)27/h1-10,25H,(H,24,26)/b22-9+
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n/an/a 1.66E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181064
PNG
((E)-N'-(5-Chloro-2-hydroxybenzylidene)-4-(2-ox...)
Show SMILES Oc1ccc(Cl)cc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
Show InChI InChI=1S/C20H12ClN3O4S/c21-13-5-6-16(25)12(7-13)9-22-24-18(26)19-23-15(10-29-19)14-8-11-3-1-2-4-17(11)28-20(14)27/h1-10,25H,(H,24,26)/b22-9+
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n/an/a 8.23E+3n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181065
PNG
((E)-N'-(2-Hydroxy-4-methoxybenzylidene)-4-(2-o...)
Show SMILES COc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c(O)c1
Show InChI InChI=1S/C21H15N3O5S/c1-28-14-7-6-13(17(25)9-14)10-22-24-19(26)20-23-16(11-30-20)15-8-12-4-2-3-5-18(12)29-21(15)27/h2-11,25H,1H3,(H,24,26)/b22-10+
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n/an/a 2.99E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181066
PNG
((E)-N'-(2,4-Dihydroxybenzylidene)-4-(2-oxo-2H-...)
Show SMILES Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c(O)c1
Show InChI InChI=1S/C20H13N3O5S/c24-13-6-5-12(16(25)8-13)9-21-23-18(26)19-22-15(10-29-19)14-7-11-3-1-2-4-17(11)28-20(14)27/h1-10,24-25H,(H,23,26)/b21-9+
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n/an/a 3.86E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181067
PNG
((E)-N'-(3,4-Dihydroxybenzylidene)-4-(2-oxo-2H-...)
Show SMILES Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1O
Show InChI InChI=1S/C20H13N3O5S/c24-15-6-5-11(7-16(15)25)9-21-23-18(26)19-22-14(10-29-19)13-8-12-3-1-2-4-17(12)28-20(13)27/h1-10,24-25H,(H,23,26)/b21-9+
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n/an/a 1.83E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181068
PNG
((E)-N'-(4-Chlorobenzylidene)-4-(2-oxo-2H-chrom...)
Show SMILES Clc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
Show InChI InChI=1S/C20H12ClN3O3S/c21-14-7-5-12(6-8-14)10-22-24-18(25)19-23-16(11-28-19)15-9-13-3-1-2-4-17(13)27-20(15)26/h1-11H,(H,24,25)/b22-10+
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n/an/a 1.06E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181069
PNG
((E)-N'-(3-Chlorobenzylidene)-4-(2-oxo-2H-chrom...)
Show SMILES Clc1cccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c1
Show InChI InChI=1S/C20H12ClN3O3S/c21-14-6-3-4-12(8-14)10-22-24-18(25)19-23-16(11-28-19)15-9-13-5-1-2-7-17(13)27-20(15)26/h1-11H,(H,24,25)/b22-10+
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n/an/a 1.20E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181070
PNG
((E)-4-(2-Oxo-2H-chromen-3-yl)-N'-(4-(trifluoro...)
Show SMILES FC(F)(F)c1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
Show InChI InChI=1S/C21H12F3N3O3S/c22-21(23,24)14-7-5-12(6-8-14)10-25-27-18(28)19-26-16(11-31-19)15-9-13-3-1-2-4-17(13)30-20(15)29/h1-11H,(H,27,28)/b25-10+
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n/an/a 1.60E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM181071
PNG
((E)-N'-(2-Fluorobenzylidene)-4-(2-oxo-2H-chrom...)
Show SMILES Fc1ccccc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
Show InChI InChI=1S/C20H12FN3O3S/c21-15-7-3-1-6-13(15)10-22-24-18(25)19-23-16(11-28-19)14-9-12-5-2-4-8-17(12)27-20(14)26/h1-11H,(H,24,25)/b22-10+
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n/an/a 2.36E+4n/an/an/an/a6.8n/a



Jishou University



Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM60591
PNG
((E)-N'-(3-Fluorobenzylidene)-4-(2-oxo-2H-chromen-3...)
Show SMILES Fc1cccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c1
Show InChI InChI=1S/C20H12FN3O3S/c21-14-6-3-4-12(8-14)10-22-24-18(25)19-23-16(11-28-19)15-9-13-5-1-2-7-17(13)27-20(15)26/h1-11H,(H,24,25)/b22-10+
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Assay Description
The test compounds were dissolved in DMSO to prepare the required distributing concentration. α-Glucosidase inhibitory activity was assayed by u...


Bioorg Chem 65: 167-74 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.001
BindingDB Entry DOI: 10.7270/Q2445K8R
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243075
PNG
(α-Gl inhibitor, C3)
Show SMILES Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)N1c2[nH]c(=O)[nH]c(=O)c2C(C(O)C(O)C(O)C(O)CO)c2c1[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C26H26N6O11S/c27-10-1-5-12(6-2-10)44(42,43)13-7-3-11(4-8-13)32-21-16(23(38)30-25(40)28-21)15(17-22(32)29-26(41)31-24(17)39)19(36)20(37)18(35)14(34)9-33/h1-8,14-15,18-20,33-37H,9,27H2,(H2,28,30,38,40)(H2,29,31,39,41)
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1.40E+4n/an/an/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243074
PNG
(α-Gl inhibitor, C2)
Show SMILES OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(Br)cc2)c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C20H20BrN5O9/c21-6-1-3-7(4-2-6)26-15-10(17(32)24-19(34)22-15)9(11-16(26)23-20(35)25-18(11)33)13(30)14(31)12(29)8(28)5-27/h1-4,8-9,12-14,27-31H,5H2,(H2,22,24,32,34)(H2,23,25,33,35)
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3.00E+4n/an/an/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243073
PNG
(α-Gl inhibitor, C1)
Show SMILES OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(O)cc2)c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C20H21N5O10/c26-5-8(28)12(29)14(31)13(30)9-10-15(21-19(34)23-17(10)32)25(6-1-3-7(27)4-2-6)16-11(9)18(33)24-20(35)22-16/h1-4,8-9,12-14,26-31H,5H2,(H2,21,23,32,34)(H2,22,24,33,35)
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7.00E+4n/an/an/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243074
PNG
(α-Gl inhibitor, C2)
Show SMILES OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(Br)cc2)c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C20H20BrN5O9/c21-6-1-3-7(4-2-6)26-15-10(17(32)24-19(34)22-15)9(11-16(26)23-20(35)25-18(11)33)13(30)14(31)12(29)8(28)5-27/h1-4,8-9,12-14,27-31H,5H2,(H2,22,24,32,34)(H2,23,25,33,35)
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1.30E+5n/an/an/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243073
PNG
(α-Gl inhibitor, C1)
Show SMILES OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(O)cc2)c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C20H21N5O10/c26-5-8(28)12(29)14(31)13(30)9-10-15(21-19(34)23-17(10)32)25(6-1-3-7(27)4-2-6)16-11(9)18(33)24-20(35)22-16/h1-4,8-9,12-14,26-31H,5H2,(H2,21,23,32,34)(H2,22,24,33,35)
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Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243068
PNG
(11-O-(3',4'-dimethoxybenzoyl)-bergenin (6))
Show SMILES COc1ccc(cc1OC)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C23H24O12/c1-30-12-5-4-9(6-13(12)31-2)22(28)33-8-14-16(25)18(27)21-20(34-14)15-10(23(29)35-21)7-11(24)19(32-3)17(15)26/h4-7,14,16,18,20-21,24-27H,8H2,1-3H3/t14-,16-,18+,20?,21?/m1/s1
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n/an/a 2.46E+4n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243067
PNG
(11-O-protocatechuoylbergenin (5))
Show SMILES COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccc(O)c(O)c4)OC3c2c1O
Show InChI InChI=1S/C21H20O12/c1-30-17-11(24)5-8-13(15(17)26)18-19(33-21(8)29)16(27)14(25)12(32-18)6-31-20(28)7-2-3-9(22)10(23)4-7/h2-5,12,14,16,18-19,22-27H,6H2,1H3/t12-,14-,16+,18?,19?/m1/s1
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n/an/a 2.90E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243070
PNG
(11-O-(3',5'-dimethoxybenzoyl)-bergenin (8))
Show SMILES COc1cc(OC)cc(c1)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C23H24O12/c1-30-10-4-9(5-11(6-10)31-2)22(28)33-8-14-16(25)18(27)21-20(34-14)15-12(23(29)35-21)7-13(24)19(32-3)17(15)26/h4-7,14,16,18,20-21,24-27H,8H2,1-3H3/t14-,16-,18+,20?,21?/m1/s1
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Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243071
PNG
(11-O-syringylbergenin (9))
Show SMILES COc1cc(cc(OC)c1O)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C23H24O13/c1-31-11-4-8(5-12(32-2)15(11)25)22(29)34-7-13-16(26)18(28)21-20(35-13)14-9(23(30)36-21)6-10(24)19(33-3)17(14)27/h4-6,13,16,18,20-21,24-28H,7H2,1-3H3/t13-,16-,18+,20?,21?/m1/s1
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Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM197302
PNG
(Benzoic acid | SAMPL4, O1)
Show SMILES OC(=O)c1ccccc1
Show InChI InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
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Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM26194
PNG
(4-Hydroxybenzoate, III | 4-hydroxybenzoic acid | C...)
Show SMILES OC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)
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n/an/a>3.00E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243072
PNG
(Anisic acid)
Show SMILES COc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)
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Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM50100861
PNG
(3,4-Dihydroxybenzoate, VIII | 3,4-dihydroxybenzoic...)
Show SMILES OC(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)
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Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM50336487
PNG
(3,4-Dimethoxy-benzoic acid | 3,4-dimethoxybenzoic ...)
Show SMILES COc1ccc(cc1OC)C(O)=O
Show InChI InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)
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n/an/a>3.00E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM50337364
PNG
(3-methoxy-4-hydroxybenzoic acid | 4-Hydroxy-3-meth...)
Show SMILES COc1cc(ccc1O)C(O)=O
Show InChI InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)
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n/an/a>3.00E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM23406
PNG
((3R,4R,5S,6R)-5-{[(2R,3R,4R,5S,6R)-5-{[(2R,3R,4S,5...)
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)OC(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 9.08E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM18351
PNG
((2R,3R,4R,5S)-2-(Hydroxymethyl)piperidine-3,4,5-tr...)
Show SMILES OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
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n/an/a 2.78E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243073
PNG
(α-Gl inhibitor, C1)
Show SMILES OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(O)cc2)c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C20H21N5O10/c26-5-8(28)12(29)14(31)13(30)9-10-15(21-19(34)23-17(10)32)25(6-1-3-7(27)4-2-6)16-11(9)18(33)24-20(35)22-16/h1-4,8-9,12-14,26-31H,5H2,(H2,21,23,32,34)(H2,22,24,33,35)
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n/an/a 7.49E+4n/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243074
PNG
(α-Gl inhibitor, C2)
Show SMILES OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(Br)cc2)c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C20H20BrN5O9/c21-6-1-3-7(4-2-6)26-15-10(17(32)24-19(34)22-15)9(11-16(26)23-20(35)25-18(11)33)13(30)14(31)12(29)8(28)5-27/h1-4,8-9,12-14,27-31H,5H2,(H2,22,24,32,34)(H2,23,25,33,35)
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n/an/a 2.51E+4n/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243075
PNG
(α-Gl inhibitor, C3)
Show SMILES Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)N1c2[nH]c(=O)[nH]c(=O)c2C(C(O)C(O)C(O)C(O)CO)c2c1[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C26H26N6O11S/c27-10-1-5-12(6-2-10)44(42,43)13-7-3-11(4-8-13)32-21-16(23(38)30-25(40)28-21)15(17-22(32)29-26(41)31-24(17)39)19(36)20(37)18(35)14(34)9-33/h1-8,14-15,18-20,33-37H,9,27H2,(H2,28,30,38,40)(H2,29,31,39,41)
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n/an/a 9.60E+3n/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM23406
PNG
((3R,4R,5S,6R)-5-{[(2R,3R,4R,5S,6R)-5-{[(2R,3R,4S,5...)
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)OC(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 2.75E+5n/an/an/an/a7.0n/a



Shiraz University



Assay Description
In this study, the inhibition assay of yeast enzyme was performed in 100 mM phosphate buffer pH 7.0 at 25C with minor changes, according to the meth...


J Enzyme Inhib Med Chem 28: 1228-35 (2013)


Article DOI: 10.3109/14756366.2012.727812
BindingDB Entry DOI: 10.7270/Q2XP73V0
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243066
PNG
(11-O-p-methoxybenzoylbergenin (4))
Show SMILES COc1ccc(cc1)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C22H22O11/c1-29-10-5-3-9(4-6-10)21(27)31-8-13-15(24)17(26)20-19(32-13)14-11(22(28)33-20)7-12(23)18(30-2)16(14)25/h3-7,13,15,17,19-20,23-26H,8H2,1-2H3/t13-,15-,17+,19?,20?/m1/s1
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n/an/a 1.44E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243065
PNG
(11-O-p-hydroxybenzoylbergenin (3))
Show SMILES COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccc(O)cc4)OC3c2c1O
Show InChI InChI=1S/C21H20O11/c1-29-17-11(23)6-10-13(15(17)25)18-19(32-21(10)28)16(26)14(24)12(31-18)7-30-20(27)8-2-4-9(22)5-3-8/h2-6,12,14,16,18-19,22-26H,7H2,1H3/t12-,14-,16+,18?,19?/m1/s1
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n/an/a 1.43E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243064
PNG
(11-O-benzoylbergenin (2))
Show SMILES COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccccc4)OC3c2c1O
Show InChI InChI=1S/C21H20O10/c1-28-17-11(22)7-10-13(15(17)24)18-19(31-21(10)27)16(25)14(23)12(30-18)8-29-20(26)9-5-3-2-4-6-9/h2-7,12,14,16,18-19,22-25H,8H2,1H3/t12-,14-,16+,18?,19?/m1/s1
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n/an/a 1.18E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243063
PNG
(Bergenin (1))
Show SMILES COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC3c2c1O
Show InChI InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12?,13?/m1/s1
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n/an/a>3.00E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
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