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Compile Data Set for Download or QSAR

Found 7 hits of ki for UniProtKB: P07265   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50296247
PNG
(3-(3,4-Dihydroxyphenyl)-N-[2-(5-hydroxyindol-3-yl)...)
Show SMILES Oc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccc(O)c(O)c3)c2c1
Show InChI InChI=1S/C19H18N2O4/c22-14-3-4-16-15(10-14)13(11-21-16)7-8-20-19(25)6-2-12-1-5-17(23)18(24)9-12/h1-6,9-11,21-24H,7-8H2,(H,20,25)/b6-2+
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6.44E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Uncompetitive inhibition of yeast alpha-glucosidase by Lineweaver-Burk plot analysis


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341135
PNG
(CHEMBL1760547 | N-p-Coumaroyl serotonin)
Show SMILES Oc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
Show InChI InChI=1S/C19H18N2O3/c22-15-4-1-13(2-5-15)3-8-19(24)20-10-9-14-12-21-18-7-6-16(23)11-17(14)18/h1-8,11-12,21-23H,9-10H2,(H,20,24)/b8-3+
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8.16E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Uncompetitive inhibition of yeast alpha-glucosidase by Lineweaver-Burk plot analysis


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341139
PNG
(CHEMBL1760551 | N-Sinapoyl serotonin)
Show SMILES COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc(OC)c1O
Show InChI InChI=1S/C21H22N2O5/c1-27-18-9-13(10-19(28-2)21(18)26)3-6-20(25)22-8-7-14-12-23-17-5-4-15(24)11-16(14)17/h3-6,9-12,23-24,26H,7-8H2,1-2H3,(H,22,25)/b6-3+
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1.12E+5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed-type inhibition of yeast alpha-glucosidase by Lineweaver-Burk plot analysis


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50296246
PNG
(CHEMBL564482 | N-Feruloylserotonin)
Show SMILES COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1O
Show InChI InChI=1S/C20H20N2O4/c1-26-19-10-13(2-6-18(19)24)3-7-20(25)21-9-8-14-12-22-17-5-4-15(23)11-16(14)17/h2-7,10-12,22-24H,8-9H2,1H3,(H,21,25)/b7-3+
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1.30E+5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed-type inhibition of yeast alpha-glucosidase by Lineweaver-Burk plot analysis


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341134
PNG
(CHEMBL1760546 | N-Cinnamoyl serotonin)
Show SMILES Oc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3)c2c1
Show InChI InChI=1S/C19H18N2O2/c22-16-7-8-18-17(12-16)15(13-21-18)10-11-20-19(23)9-6-14-4-2-1-3-5-14/h1-9,12-13,21-22H,10-11H2,(H,20,23)/b9-6+
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1.33E+5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Competitive inhibition of yeast alpha-glucosidase by Dixon plot analysis


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(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=1/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-/s2
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CHEBI
CHEMBL
KEGG
MMDB
PC cid
PC sid
PDB
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Article
PubMed
4.60E+5n/an/an/an/an/an/an/an/a



Universidad Nacional Auto£?noma de Me£?xico

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase assessed as inhibition of p-nitrophenyl-alpha-D-glucopyranoside substrate hydrolysis after 35 mins by spectrosc...


J Nat Prod 74: 314-20 (2011)


Article DOI: 10.1021/np100447a
BindingDB Entry DOI: 10.7270/Q25D8S53
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341204
PNG
((Z)-3-butylidenephthalide | CHEMBL1765390)
Show SMILES CCC\C=C1\OC(=O)c2ccccc12
Show InChI InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+
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Article
PubMed
4.86E+6n/an/an/an/an/an/an/an/a



Universidad Nacional Auto£?noma de Me£?xico

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase assessed as inhibition of p-nitrophenyl-alpha-D-glucopyranoside substrate hydrolysis after 35 mins by spectrosc...


J Nat Prod 74: 314-20 (2011)


Article DOI: 10.1021/np100447a
BindingDB Entry DOI: 10.7270/Q25D8S53
More data for this
Ligand-Target Pair