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Compile Data Set for Download or QSAR

Found 16 hits Enz. Inhib. hit(s) with Target = 'Probable alpha-glucosidase Os06g0675700' AND taxid = 39947   
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
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50320826
PNG
(CHEMBL1163255 | beta-1-C-Butyl-1-deoxygalactonojir...)
Show SMILES CCCC[C@@H]1N[C@H](CO)[C@H](O)[C@H](O)[C@H]1C
Show InChI InChI=1S/C11H23NO3/c1-3-4-5-8-7(2)10(14)11(15)9(6-13)12-8/h7-15H,3-6H2,1-2H3/t7-,8-,9+,10+,11-/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase assessed as D-glucose release at pH 5 after 10 to 30 mins


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50360268
PNG
(CHEMBL1933098)
Show SMILES C[C@@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5-,6-,7-/m1/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50320827
PNG
(CHEMBL1163562 | beta-1-C-butenyl-1-deoxygalactonoj...)
Show SMILES C[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)N[C@H]1CCC=C
Show InChI InChI=1S/C11H21NO3/c1-3-4-5-8-7(2)10(14)11(15)9(6-13)12-8/h3,7-15H,1,4-6H2,2H3/t7-,8-,9+,10+,11-/m0/s1
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n/an/a 4.50E+4n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase assessed as D-glucose release at pH 5 after 10 to 30 mins


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50341335
PNG
(CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...)
Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50341331
PNG
(CHEMBL1766489 | rel-(1R,2S,4R,5S)-6-[[1-(10-Hydrox...)
Show SMILES OCCCCCCCCCCn1cc(CN[C@@H]2[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)nn1
Show InChI InChI=1S/C19H36N4O6/c24-10-8-6-4-2-1-3-5-7-9-23-12-13(21-22-23)11-20-14-15(25)17(27)19(29)18(28)16(14)26/h12,14-20,24-29H,1-11H2/t14-,15-,16+,17+,18-,19-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM18358
PNG
((2R,3R,4R,5S)-2-(hydroxymethyl)-1-nonylpiperidine-...)
Show SMILES CCCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO
Show InChI InChI=1S/C15H31NO4/c1-2-3-4-5-6-7-8-9-16-10-13(18)15(20)14(19)12(16)11-17/h12-15,17-20H,2-11H2,1H3/t12-,13+,14-,15-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50341332
PNG
(CHEMBL1766350 | rel-(1R,2S,4R,5S)-6-[(1-(3,5-Bis(b...)
Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(Cc3cc(OCc4ccccc4)cc(OCc4ccccc4)c3)nn2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C30H34N4O7/c35-26-25(27(36)29(38)30(39)28(26)37)31-14-22-16-34(33-32-22)15-21-11-23(40-17-19-7-3-1-4-8-19)13-24(12-21)41-18-20-9-5-2-6-10-20/h1-13,16,25-31,35-39H,14-15,17-18H2/t25-,26-,27+,28+,29-,30-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50341333
PNG
(CHEMBL1766470 | rel-(1R,2S,4R,5S)-6-[[1-(3,3-Diphe...)
Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCC(c3ccccc3)c3ccccc3)nn2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C24H30N4O5/c29-20-19(21(30)23(32)24(33)22(20)31)25-13-17-14-28(27-26-17)12-11-18(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,14,18-25,29-33H,11-13H2/t19-,20-,21+,22+,23-,24-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50341334
PNG
(CHEMBL1766473 | rel-(1R,2S,4R,5S)-6-[(1-Adamantyl-...)
Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CC34CC5CC(CC(C5)C3)C4)nn2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C20H32N4O5/c25-15-14(16(26)18(28)19(29)17(15)27)21-7-13-8-24(23-22-13)9-20-4-10-1-11(5-20)3-12(2-10)6-20/h8,10-12,14-19,21,25-29H,1-7,9H2/t10?,11?,12?,14-,15-,16+,17+,18-,19-,20?
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50318559
PNG
((1R,2S,3r,4R,5S,6s)-6-[(1-Octyl-1H-1,2,3-triazol-4...)
Show SMILES CCCCCCCCn1cc(CN[C@@H]2[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)nn1
Show InChI InChI=1S/C17H32N4O5/c1-2-3-4-5-6-7-8-21-10-11(19-20-21)9-18-12-13(22)15(24)17(26)16(25)14(12)23/h10,12-18,22-26H,2-9H2,1H3/t12-,13-,14+,15+,16-,17-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50318562
PNG
((1R,2S,3r,4R,5S,6s)-6-[(1-Decyl-1H-1,2,3-triazol-4...)
Show SMILES CCCCCCCCCCn1cc(CN[C@@H]2[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)nn1
Show InChI InChI=1S/C19H36N4O5/c1-2-3-4-5-6-7-8-9-10-23-12-13(21-22-23)11-20-14-15(24)17(26)19(28)18(27)16(14)25/h12,14-20,24-28H,2-11H2,1H3/t14-,15-,16+,17+,18-,19-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50341324
PNG
(CHEMBL1766482 | rel-(1R,2S,4R,5S)-6-[[1-Undecyl-1H...)
Show SMILES CCCCCCCCCCCn1cc(CN[C@@H]2[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)nn1
Show InChI InChI=1S/C20H38N4O5/c1-2-3-4-5-6-7-8-9-10-11-24-13-14(22-23-24)12-21-15-16(25)18(27)20(29)19(28)17(15)26/h13,15-21,25-29H,2-12H2,1H3/t15-,16-,17+,18+,19-,20-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50318560
PNG
(CHEMBL1083795 | N-decylaminocyclitol)
Show SMILES CCCCCCCCCCN[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C16H33NO5/c1-2-3-4-5-6-7-8-9-10-17-11-12(18)14(20)16(22)15(21)13(11)19/h11-22H,2-10H2,1H3/t11-,12-,13+,14+,15-,16-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas)

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50241865
PNG
(2,5-dideoxy-2,5-imino-D-altritol | 2R,5R-dihydroxy...)
Show SMILES OC[C@H]1N[C@H](CO)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-1-3-5(10)6(11)4(2-9)7-3/h3-11H,1-2H2/t3-,4-,5-,6+/m1/s1
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n/an/a 1.71E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase assessed as D-glucose release at pH 5 after 10 to 30 mins


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50360269
PNG
(CHEMBL1933097)
Show SMILES C[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1
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n/an/a 2.26E+5n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Citation and Details
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50320825
PNG
(6-O-beta-D-glucopyranosyl-2,3-dideoxy-beta-1-C-eth...)
Show SMILES CC[C@H]1CC[C@@H](O)[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)N1
Show InChI InChI=1S/C14H27NO7/c1-2-7-3-4-9(17)8(15-7)6-21-14-13(20)12(19)11(18)10(5-16)22-14/h7-20H,2-6H2,1H3/t7-,8+,9+,10+,11+,12-,13+,14+/m0/s1
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n/an/a 6.70E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase assessed as D-glucose release at pH 5 after 10 to 30 mins


Citation and Details
More data for this
Ligand-Target Pair