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PubMed code 19362832

Compile data set for download or QSAR
Found 4 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
Lysosomal alpha-glucosidase


(Rattus norvegicus)		BDBM50294475
PNG
((E)-4-(3,4-dimethoxyphenyl)-1-((2S,3R,4R,5S,6R)-3,...)
Show SMILES COc1ccc(C=CC(=O)C[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1OC |r,w:7.7|
Show InChI InChI=1S/C18H24O8/c1-24-12-6-4-10(7-13(12)25-2)3-5-11(20)8-14-16(21)18(23)17(22)15(9-19)26-14/h3-7,14-19,21-23H,8-9H2,1-2H3/t14-,15+,16-,17+,18+/m0/s1
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n/an/a 5.15E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat intestinal alpha-glucosidase

Bioorg Med Chem Lett 19: 2699-703 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.136
BindingDB Entry DOI: 10.7270/Q20V8CTK
More data for this
Ligand-Target Pair
Glucose-6-phosphatase catalytic subunit 1


(Rattus norvegicus)		BDBM50294478
PNG
((E)-4-phenyl-1-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-...)
Show SMILES OC[C@H]1O[C@@H](CC(=O)C=Cc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r,w:8.7|
Show InChI InChI=1S/C16H20O6/c17-9-13-15(20)16(21)14(19)12(22-13)8-11(18)7-6-10-4-2-1-3-5-10/h1-7,12-17,19-21H,8-9H2/t12-,13+,14-,15+,16+/m0/s1
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n/an/a 8.70E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat liver glucose-6-phosphatase

Bioorg Med Chem Lett 19: 2699-703 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.136
BindingDB Entry DOI: 10.7270/Q20V8CTK
More data for this
Ligand-Target Pair
Glucose-6-phosphatase catalytic subunit 1


(Rattus norvegicus)		BDBM50294477
PNG
((E)-1-(beta-D-glucopyranosyl)-4-(4'-chlorophenyl)b...)
Show SMILES OC[C@H]1O[C@@H](CC(=O)C=Cc2ccc(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r,w:8.7|
Show InChI InChI=1S/C16H19ClO6/c17-10-4-1-9(2-5-10)3-6-11(19)7-12-14(20)16(22)15(21)13(8-18)23-12/h1-6,12-16,18,20-22H,7-8H2/t12-,13+,14-,15+,16+/m0/s1
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n/an/a 8.70E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat liver glucose-6-phosphatase

Bioorg Med Chem Lett 19: 2699-703 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.136
BindingDB Entry DOI: 10.7270/Q20V8CTK
More data for this
Ligand-Target Pair
Glycogen phosphorylase, liver form


(Rattus norvegicus)		BDBM50294476
PNG
((E)-4-(naphthalen-2-yl)-1-((2S,3R,4R,5S,6R)-3,4,5-...)
Show SMILES OC[C@H]1O[C@@H](CC(=O)C=Cc2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@@H]1O |r,w:8.7|
Show InChI InChI=1S/C20H22O6/c21-11-17-19(24)20(25)18(23)16(26-17)10-15(22)8-6-12-5-7-13-3-1-2-4-14(13)9-12/h1-9,16-21,23-25H,10-11H2/t16-,17+,18-,19+,20+/m0/s1
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n/an/a 9.80E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat liver glycogen phosphatase

Bioorg Med Chem Lett 19: 2699-703 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.136
BindingDB Entry DOI: 10.7270/Q20V8CTK
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%