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PubMed code 21821421

Compile data set for download or QSAR
Found 8 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


(Oryctolagus cuniculus (rabbit))
BDBM50351156
PNG
(CHEMBL1233215)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(O)ccc1O |r|
Show InChI InChI=1S/C12H16O7/c13-4-8-9(16)10(17)11(18)12(19-8)6-3-5(14)1-2-7(6)15/h1-3,8-18H,4H2/t8-,9-,10+,11-,12+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

MMDB
PDB
Article
PubMed
9.00E+5n/an/an/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50351159
PNG
(CHEMBL1817918)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=CC(=O)C=CC1=O |r,c:16,t:12|
Show InChI InChI=1S/C12H14O7/c13-4-8-9(16)10(17)11(18)12(19-8)6-3-5(14)1-2-7(6)15/h1-3,8-13,16-18H,4H2/t8-,9-,10+,11-,12+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.30E+6n/an/an/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50351158
PNG
(CHEMBL423707)
Show SMILES OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1
PDB
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
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Purchase

CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.70E+6n/an/an/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50351155
PNG
(CHEMBL1738940)
Show SMILES COc1cc(Cl)c(O)c(c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C13H17ClO7/c1-20-5-2-6(9(16)7(14)3-5)13-12(19)11(18)10(17)8(4-15)21-13/h2-3,8,10-13,15-19H,4H2,1H3/t8-,10-,11+,12-,13+/m1/s1
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KEGG

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MMDB
PDB
Article
PubMed
n/an/a 3.98E+4n/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50351154
PNG
(CHEMBL1738939)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(O)cc(Cl)c1O |r|
Show InChI InChI=1S/C12H15ClO7/c13-6-2-4(15)1-5(8(6)16)12-11(19)10(18)9(17)7(3-14)20-12/h1-2,7,9-12,14-19H,3H2/t7-,9-,10+,11-,12+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

MMDB
PDB
Article
PubMed
n/an/a 9.50E+4n/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50351157
PNG
(CHEMBL1738941)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(O)c(Br)cc1O |r|
Show InChI InChI=1S/C12H15BrO7/c13-5-2-6(15)4(1-7(5)16)12-11(19)10(18)9(17)8(3-14)20-12/h1-2,8-12,14-19H,3H2/t8-,9-,10+,11-,12+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

MMDB
PDB
Article
PubMed
n/an/a 1.36E+5n/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50351153
PNG
(CHEMBL1738938)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(O)c(Cl)cc1O |r|
Show InChI InChI=1S/C12H15ClO7/c13-5-2-6(15)4(1-7(5)16)12-11(19)10(18)9(17)8(3-14)20-12/h1-2,8-12,14-19H,3H2/t8-,9-,10+,11-,12+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

MMDB
PDB
Article
PubMed
n/an/a 1.70E+5n/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50351156
PNG
(CHEMBL1233215)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(O)ccc1O |r|
Show InChI InChI=1S/C12H16O7/c13-4-8-9(16)10(17)11(18)12(19-8)6-3-5(14)1-2-7(6)15/h1-3,8-18H,4H2/t8-,9-,10+,11-,12+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

MMDB
PDB
Article
PubMed
n/an/a 9.77E+5n/an/an/an/a6.8n/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release using alphaD glucose-1-phosphate as substrat...


Bioorg Med Chem 19: 5125-36 (2011)


Article DOI: 10.1016/j.bmc.2011.07.024
BindingDB Entry DOI: 10.7270/Q2GX4BX1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
* indicates data uncertainty>20%