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PubMed code 26222905

Compile data set for download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
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
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))		BDBM50113279
PNG
(CHEMBL3601513)
Show SMILES [H][C@@]1(CC(=O)[C@@]2(C)C3=C(C(=O)[C@@H](O)[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])C[C@@H]3O)[C@]1(C)CCC(=O)O1 |r,c:7|
Show InChI InChI=1S/C27H38O7/c1-23(2)14-11-13(28)19-20(24(14,3)9-7-16(23)29)21(32)22(33)26(5)15(12-17(30)27(19,26)6)25(4)10-8-18(31)34-25/h13-16,22,28-29,33H,7-12H2,1-6H3/t13-,14-,15+,16-,22+,24-,25-,26-,27-/m0/s1
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PubMed
n/an/a 4.17E+4n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using p-NPG as substrate

J Nat Prod 78: 1868-76 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00132
BindingDB Entry DOI: 10.7270/Q2WH2RTG
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))		BDBM50113280
PNG
(CHEMBL3601516)
Show SMILES [H][C@@]1(CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@]1([H])CC3=O)[C@]1(C)CCC(=O)O1 |r,c:7|
Show InChI InChI=1S/C27H34O6/c1-23(2)16-11-14(28)22-21(24(16,3)9-7-18(23)30)15(29)13-25(4)17(12-19(31)27(22,25)6)26(5)10-8-20(32)33-26/h16-17H,7-13H2,1-6H3/t16-,17-,24-,25+,26-,27-/m0/s1
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n/an/a 8.18E+4n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using p-NPG as substrate

J Nat Prod 78: 1868-76 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00132
BindingDB Entry DOI: 10.7270/Q2WH2RTG
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))		BDBM50113278
PNG
(CHEMBL3601514)
Show SMILES [H][C@@]1(CC(=O)[C@@]2(C)C3=C(C(=O)C(=O)[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@]1([H])C[C@@H]3O)[C@]1(C)CCC(=O)O1 |r,c:7|
Show InChI InChI=1S/C27H36O7/c1-23(2)14-11-13(28)19-20(24(14,3)9-7-16(23)29)21(32)22(33)26(5)15(12-17(30)27(19,26)6)25(4)10-8-18(31)34-25/h13-16,28-29H,7-12H2,1-6H3/t13-,14-,15+,16-,24-,25-,26-,27-/m0/s1
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n/an/a 9.13E+4n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using p-NPG as substrate

J Nat Prod 78: 1868-76 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00132
BindingDB Entry DOI: 10.7270/Q2WH2RTG
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))		BDBM50113276
PNG
(CHEMBL2203594)
Show SMILES [H][C@@]1(CC[C@@]2(C)C3=C([C@@H](O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@]1([H])CC3=O)[C@H](C)CC\C=C(/C)C(O)=O |r,c:6|
Show InChI InChI=1S/C30H44O5/c1-17(9-8-10-18(2)26(34)35)19-11-14-29(6)25-20(31)15-22-27(3,4)23(33)12-13-28(22,5)24(25)21(32)16-30(19,29)7/h10,17,19,21-22,32H,8-9,11-16H2,1-7H3,(H,34,35)/b18-10+/t17-,19-,21+,22+,28+,29+,30-/m1/s1
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n/an/a 1.19E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using p-NPG as substrate

J Nat Prod 78: 1868-76 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00132
BindingDB Entry DOI: 10.7270/Q2WH2RTG
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))		BDBM50113277
PNG
(CHEMBL3601515)
Show SMILES [H][C@@]1(CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@]1([H])CC3=O)[C@H](C)C(O)=O |r,c:7|
Show InChI InChI=1S/C25H32O6/c1-12(21(30)31)13-9-18(29)25(6)20-14(26)10-16-22(2,3)17(28)7-8-23(16,4)19(20)15(27)11-24(13,25)5/h12-13,16H,7-11H2,1-6H3,(H,30,31)/t12-,13+,16-,23-,24+,25-/m0/s1
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n/an/a 1.45E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using p-NPG as substrate

J Nat Prod 78: 1868-76 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00132
BindingDB Entry DOI: 10.7270/Q2WH2RTG
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(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 |r,t:37|
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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KEGG
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n/an/a 6.70E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using p-NPG as substrate

J Nat Prod 78: 1868-76 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00132
BindingDB Entry DOI: 10.7270/Q2WH2RTG
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%