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PubMed code 10360741

Compile data set for download or QSAR
Found 10 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
Glycogen phosphorylase, muscle form


(Homo sapiens (Human))
BDBM50215446
PNG
(CHEMBL3351144)
Show SMILES OC[C@@H]1O[C@@]2(NC(=O)NC2=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
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-/m0/s1
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4.20E+3n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Muscle phosphorylase b in rabbit


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Homo sapiens (Human))
BDBM50215446
PNG
(CHEMBL3351144)
Show SMILES OC[C@@H]1O[C@@]2(NC(=O)NC2=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
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-/m0/s1
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4.20E+3n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Liver phosphorylase b in rat


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(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 |r|
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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PubMed
5.10E+3n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Muscle phosphorylase b in rabbit


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, liver form


(Rattus norvegicus)
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 |r|
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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PubMed
7.00E+3n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Liver phosphorylase b in rat


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(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 |r|
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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PubMed
1.09E+4n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Muscle phosphorylase a in rabbit


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, liver form


(Rattus norvegicus)
BDBM50215446
PNG
(CHEMBL3351144)
Show SMILES OC[C@@H]1O[C@@]2(NC(=O)NC2=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
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-/m0/s1
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1.28E+4n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Liver phosphorylase b in rat


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
Glycogen phosphorylase, liver form


(Rattus norvegicus)
BDBM50215446
PNG
(CHEMBL3351144)
Show SMILES OC[C@@H]1O[C@@]2(NC(=O)NC2=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
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-/m0/s1
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1.65E+4n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Liver phosphorylase a in rat


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
Glycogen phosphorylase, liver form


(Rattus norvegicus)
BDBM50215446
PNG
(CHEMBL3351144)
Show SMILES OC[C@@H]1O[C@@]2(NC(=O)NC2=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
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-/m0/s1
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1.65E+4n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Liver phosphorylase b in rat


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Homo sapiens (Human))
BDBM50215446
PNG
(CHEMBL3351144)
Show SMILES OC[C@@H]1O[C@@]2(NC(=O)NC2=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
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-/m0/s1
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2.60E+4n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Muscle phosphorylase a in rabbit


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
Glycogen phosphorylase, liver form


(Rattus norvegicus)
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 |r|
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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2.98E+4n/an/an/an/an/an/an/an/a



Lajos Kossuth University

Curated by ChEMBL


Assay Description
Inhibitor constant was measured against Liver phosphorylase a in rat


Bioorg Med Chem Lett 9: 1385-90 (1999)


BindingDB Entry DOI: 10.7270/Q2W66M82
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%