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Compile Data Set for Download or QSAR

Found 23 hits of ki for UniProtKB: P06737   
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
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50148913
PNG
(CHEMBL3770455)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc(c[nH]1)-c1ccc2ccccc2c1
Show InChI InChI=1/C19H20N2O5/c22-9-14-15(23)16(24)17(25)18(26-14)19-20-8-13(21-19)12-6-5-10-3-1-2-4-11(10)7-12/h1-8,14-18,22-25H,9H2,(H,20,21)/t14-,15-,16+,17-,18-/s2
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26n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of His6-tagged human liver glycogen phosphorylase-a expressed in Escherichia coli BL21 Gold (DE3) assessed as release of inorg...


Eur J Med Chem 123: 737-745 (2016)


Article DOI: 10.1016/j.ejmech.2016.06.049
BindingDB Entry DOI: 10.7270/Q2TT4SXG
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50241632
PNG
(CHEMBL4101331)
Show SMILES N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1nc(c[nH]1)-c1ccc2ccccc2c1
Show InChI InChI=1/C19H21N3O4/c20-15-17(25)16(24)14(9-23)26-18(15)19-21-8-13(22-19)12-6-5-10-3-1-2-4-11(10)7-12/h1-8,14-18,23-25H,9,20H2,(H,21,22)/t14-,15-,16-,17-,18-/s2
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143n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Competitive inhibition of 6xHis-tagged human liver glycogen phosphorylase-a expressed in Escherichia coli BL21 Gold (DE3) assessed as release of inor...


J Med Chem 60: 9251-9262 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01056
BindingDB Entry DOI: 10.7270/Q2ZC851N
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50148915
PNG
(CHEMBL3770514)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1/C15H18N2O5/c18-7-10-11(19)12(20)13(21)14(22-10)15-16-6-9(17-15)8-4-2-1-3-5-8/h1-6,10-14,18-21H,7H2,(H,16,17)/t10-,11-,12+,13-,14-/s2
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156n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of His6-tagged human liver glycogen phosphorylase-a expressed in Escherichia coli BL21 Gold (DE3) assessed as release of inorg...


Eur J Med Chem 123: 737-745 (2016)


Article DOI: 10.1016/j.ejmech.2016.06.049
BindingDB Entry DOI: 10.7270/Q2TT4SXG
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50437354
PNG
(CHEMBL2408225)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nnc([nH]1)-c1ccc2ccccc2c1
Show InChI InChI=1/C18H19N3O5/c22-8-12-13(23)14(24)15(25)16(26-12)18-19-17(20-21-18)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-16,22-25H,8H2,(H,19,20,21)/t12-,13-,14+,15-,16-/s2
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172n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Competitive inhibition of human liver glycogen phosphorylase-a assessed as release of inorganic phosphate using varying levels of glucose-1-phosphate...


J Med Chem 60: 9251-9262 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01056
BindingDB Entry DOI: 10.7270/Q2ZC851N
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50016703
PNG
(2-Hydroxymethyl-pyrrolidine-3,4-diol | BDBM5003148...)
Show SMILES OC[C@H]1NC[C@@H](O)[C@@H]1O
Show InChI InChI=1/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/s2
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400n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory activity against pig Liver glycogen phosphorylase a


J Med Chem 47: 3537-45 (2004)


Article DOI: 10.1021/jm031121n
BindingDB Entry DOI: 10.7270/Q2HM5977
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50437355
PNG
(CHEMBL2408224)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nnc([nH]1)-c1ccccc1
Show InChI InChI=1/C14H17N3O5/c18-6-8-9(19)10(20)11(21)12(22-8)14-15-13(16-17-14)7-4-2-1-3-5-7/h1-5,8-12,18-21H,6H2,(H,15,16,17)/t8-,9-,10+,11-,12-/s2
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1.35E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
The compound was tested for the inhibition of fibrinogen receptor


J Med Chem 60: 9251-9262 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01056
BindingDB Entry DOI: 10.7270/Q2ZC851N
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50312361
PNG
(CHEMBL4169281)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc(n[nH]1)-c1ccc-2c(Cc3ccccc-23)c1
Show InChI InChI=1S/C21H21N3O5/c25-9-15-16(26)17(27)18(28)19(29-15)21-22-20(23-24-21)11-5-6-14-12(8-11)7-10-3-1-2-4-13(10)14/h1-6,8,15-19,25-28H,7,9H2,(H,22,23,24)/t15-,16-,17+,18-,19-/m1/s1
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2.02E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of human liver glycogen phosphorylase-a assessed as release of inorganic phosphate using glucose-1-phosphate as substrate in presence of g...


Eur J Med Chem 147: 266-278 (2018)

More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50312362
PNG
(CHEMBL4176460)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc(n[nH]1)-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N3O5/c24-10-14-15(25)16(26)17(27)18(28-14)20-21-19(22-23-20)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-18,24-27H,10H2,(H,21,22,23)/t14-,15-,16+,17-,18-/m1/s1
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2.23E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of human liver glycogen phosphorylase-a assessed as release of inorganic phosphate using glucose-1-phosphate as substrate in presence of g...


Eur J Med Chem 147: 266-278 (2018)

More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50313014
PNG
(CHEMBL4172670)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc(n[nH]1)-c1ccc(cc1)-c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C21H21N3O7/c25-9-14-15(26)16(27)17(28)18(31-14)20-22-19(23-24-20)12-5-1-10(2-6-12)11-3-7-13(8-4-11)21(29)30/h1-8,14-18,25-28H,9H2,(H,29,30)(H,22,23,24)/t14-,15-,16+,17-,18-/m1/s1
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2.67E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of human liver glycogen phosphorylase-a assessed as release of inorganic phosphate using glucose-1-phosphate as substrate in presence of g...


Eur J Med Chem 147: 266-278 (2018)

More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50241633
PNG
(CHEMBL4095486)
Show SMILES N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1/C15H19N3O4/c16-11-13(21)12(20)10(7-19)22-14(11)15-17-6-9(18-15)8-4-2-1-3-5-8/h1-6,10-14,19-21H,7,16H2,(H,17,18)/t10-,11-,12-,13-,14-/s2
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2.73E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Competitive inhibition of 6xHis-tagged human liver glycogen phosphorylase-a expressed in Escherichia coli BL21 Gold (DE3) assessed as release of inor...


J Med Chem 60: 9251-9262 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01056
BindingDB Entry DOI: 10.7270/Q2ZC851N
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50312225
PNG
(CHEMBL4161353)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc(n[nH]1)-c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C19H19N3O7/c23-7-12-13(24)14(25)15(26)16(29-12)18-20-17(21-22-18)10-3-1-9-6-11(19(27)28)4-2-8(9)5-10/h1-6,12-16,23-26H,7H2,(H,27,28)(H,20,21,22)/t12-,13-,14+,15-,16-/m1/s1
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3.88E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of human liver glycogen phosphorylase-a assessed as release of inorganic phosphate using glucose-1-phosphate as substrate in presence of g...


Eur J Med Chem 147: 266-278 (2018)

More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50211296
PNG
((7R,8S,9S,10R)-8,9,10-trihydroxy-7-hydroxymethyl-6...)
Show SMILES OC[C@H]1OC2(NC(=O)NC2=O)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C8H12N2O7/c11-1-2-3(12)4(13)5(14)8(17-2)6(15)9-7(16)10-8/h2-5,11-14H,1H2,(H2,9,10,15,16)/t2-,3-,4+,5-,8?/m1/s1
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4.20E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of liver glycogen phosphorylase B


Bioorg Med Chem 15: 4048-56 (2007)


Article DOI: 10.1016/j.bmc.2007.03.084
BindingDB Entry DOI: 10.7270/Q2XW4JGC
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50211294
PNG
((7R,8S,9S,10R)-8,9,10-trihydroxy-7-hydroxymethyl-2...)
Show SMILES OC[C@H]1OC2(NC(=S)NC2=O)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C8H12N2O6S/c11-1-2-3(12)4(13)5(14)8(16-2)6(15)9-7(17)10-8/h2-5,11-14H,1H2,(H2,9,10,15,17)/t2-,3-,4+,5-,8?/m1/s1
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5.10E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of liver glycogen phosphorylase B


Bioorg Med Chem 15: 4048-56 (2007)


Article DOI: 10.1016/j.bmc.2007.03.084
BindingDB Entry DOI: 10.7270/Q2XW4JGC
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50241634
PNG
(CHEMBL4068103)
Show SMILES N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1nc(n[nH]1)-c1ccc2ccccc2c1
Show InChI InChI=1/C18H20N4O4/c19-13-15(25)14(24)12(8-23)26-16(13)18-20-17(21-22-18)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-16,23-25H,8,19H2,(H,20,21,22)/t12-,13-,14-,15-,16-/s2
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7.60E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Competitive inhibition of 6xHis-tagged human liver glycogen phosphorylase-a expressed in Escherichia coli BL21 Gold (DE3) assessed as release of inor...


J Med Chem 60: 9251-9262 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01056
BindingDB Entry DOI: 10.7270/Q2ZC851N
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50312632
PNG
(CHEMBL4164542)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc(n[nH]1)-c1cccc2ccccc12
Show InChI InChI=1S/C18H19N3O5/c22-8-12-13(23)14(24)15(25)16(26-12)18-19-17(20-21-18)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-16,22-25H,8H2,(H,19,20,21)/t12-,13-,14+,15-,16-/m1/s1
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8.91E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of human liver glycogen phosphorylase-a assessed as release of inorganic phosphate using glucose-1-phosphate as substrate in presence of g...


Eur J Med Chem 147: 266-278 (2018)

More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50263769
PNG
((5S,7R,8S,9S,10R)-8,9,10-Trihydroxy-7-hydroxymethy...)
Show SMILES OC[C@H]1O[C@@]2(NC(=S)NC2=O)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1/C8H12N2O6S/c11-1-2-3(12)4(13)5(14)8(16-2)6(15)9-7(17)10-8/h2-5,11-14H,1H2,(H2,9,10,15,17)/t2-,3-,4+,5-,8+/s2
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1.09E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibitory activity against muscle Glycogen Phosphorylase a


J Med Chem 44: 2843-8 (2001)


Article DOI: 10.1021/jm010892t
BindingDB Entry DOI: 10.7270/Q2NV9JZQ
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50211289
PNG
(5-[4-(6,7-dibromo-2,3-dihydrobenzo[1,4]dioxin-2-yl...)
Show SMILES OC1=NC(=O)C(S1)=Cc1ccc(OCC2COc3cc(Br)c(Br)cc3O2)cc1
Show InChI InChI=1/C19H13Br2NO5S/c20-13-6-15-16(7-14(13)21)27-12(9-26-15)8-25-11-3-1-10(2-4-11)5-17-18(23)22-19(24)28-17/h1-7,12H,8-9H2,(H,22,23,24)/b17-5-
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1.20E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of liver glycogen phosphorylase B


Bioorg Med Chem 15: 4048-56 (2007)


Article DOI: 10.1016/j.bmc.2007.03.084
BindingDB Entry DOI: 10.7270/Q2XW4JGC
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50263769
PNG
((5S,7R,8S,9S,10R)-8,9,10-Trihydroxy-7-hydroxymethy...)
Show SMILES OC[C@H]1O[C@@]2(NC(=S)NC2=O)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1/C8H12N2O6S/c11-1-2-3(12)4(13)5(14)8(16-2)6(15)9-7(17)10-8/h2-5,11-14H,1H2,(H2,9,10,15,17)/t2-,3-,4+,5-,8+/s2
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2.98E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibitory activity against liver Glycogen Phosphorylase a


J Med Chem 44: 2843-8 (2001)


Article DOI: 10.1021/jm010892t
BindingDB Entry DOI: 10.7270/Q2NV9JZQ
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50211288
PNG
(5-[4-(6,7-dibromo-2,3-dihydrobenzo[1,4]dioxin-2-yl...)
Show SMILES COc1cc(C=C2SC(O)=NC2=O)ccc1OCC1COc2cc(Br)c(Br)cc2O1
Show InChI InChI=1/C20H15Br2NO6S/c1-26-15-4-10(5-18-19(24)23-20(25)30-18)2-3-14(15)27-8-11-9-28-16-6-12(21)13(22)7-17(16)29-11/h2-7,11H,8-9H2,1H3,(H,23,24,25)/b18-5-
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3.00E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of liver glycogen phosphorylase B


Bioorg Med Chem 15: 4048-56 (2007)


Article DOI: 10.1016/j.bmc.2007.03.084
BindingDB Entry DOI: 10.7270/Q2XW4JGC
More data for this
Ligand-Target Pair
Liver glycogen phosphorylase


(Homo sapiens (Human))
BDBM50241635
PNG
(CHEMBL4087784)
Show SMILES N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1nc(n[nH]1)-c1ccccc1
Show InChI InChI=1/C14H18N4O4/c15-9-11(21)10(20)8(6-19)22-12(9)14-16-13(17-18-14)7-4-2-1-3-5-7/h1-5,8-12,19-21H,6,15H2,(H,16,17,18)/t8-,9-,10-,11-,12-/s2
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3.08E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Competitive inhibition of 6xHis-tagged human liver glycogen phosphorylase-a expressed in Escherichia coli BL21 Gold (DE3) assessed as release of inor...


J Med Chem 60: 9251-9262 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01056
BindingDB Entry DOI: 10.7270/Q2ZC851N
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50211286
PNG
(5-[4-(6-bromo-2,3-dihydrobenzo[1,4]dioxin-2-ylmeth...)
Show SMILES OC1=NC(=O)C(S1)=Cc1ccc(OCC2COc3cc(Br)ccc3O2)cc1
Show InChI InChI=1/C19H14BrNO5S/c20-12-3-6-15-16(8-12)25-10-14(26-15)9-24-13-4-1-11(2-5-13)7-17-18(22)21-19(23)27-17/h1-8,14H,9-10H2,(H,21,22,23)/b17-7-
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8.00E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of liver glycogen phosphorylase B


Bioorg Med Chem 15: 4048-56 (2007)


Article DOI: 10.1016/j.bmc.2007.03.084
BindingDB Entry DOI: 10.7270/Q2XW4JGC
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50351158
PNG
(CHEMBL423707)
Show SMILES OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/s2
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4.28E+6n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of His6-tagged human liver glycogen phosphorylase-a expressed in Escherichia coli BL21 Gold (DE3) assessed as release of inorg...


Eur J Med Chem 123: 737-745 (2016)


Article DOI: 10.1016/j.ejmech.2016.06.049
BindingDB Entry DOI: 10.7270/Q2TT4SXG
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50351158
PNG
(CHEMBL423707)
Show SMILES OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/s2
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4.90E+6n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of glycogen phosphorylase a (unknown origin)


Bioorg Med Chem 22: 4810-25 (2014)


Article DOI: 10.1016/j.bmc.2014.06.058
BindingDB Entry DOI: 10.7270/Q2KS6T58
More data for this
Ligand-Target Pair