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13 molecules are shown

Wt: 379.3
BDBM50316583
Wt: 276.2
BDBM50316582
Wt: 275.2
BDBM50316584
Wt: 294.2
BDBM50316585
Wt: 274.2
BDBM50316587
Wt: 273.2
BDBM50316588
Wt: 288.2
BDBM50382961
Purchase
Wt: 308.6
BDBM50386288
Wt: 298.2
BDBM50386283
Wt: 340.3
BDBM50386284
Wt: 368.3
BDBM50386285
Wt: 340.3
BDBM50386286
Wt: 368.3
BDBM50386287

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50316583,50316582,50316584,50316585,50316587,50316588,50382961,50386288,50386283,50386284,50386285,50386286,50386287   
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
Muscle glycogen phosphorylase


(Homo sapiens)
BDBM50386288
PNG
(CHEMBL2041081)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1cc(Cl)c(=O)[nH]c1=O
Show InChI InChI=1S/C10H13ClN2O7/c11-3-1-13(10(19)12-8(3)18)9-7(17)6(16)5(15)4(2-14)20-9/h1,4-7,9,14-17H,2H2,(H,12,18,19)/t4-,5-,6+,7-,9-/m1/s1
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1.02E+3n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of glycogen phosphorylase b


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50386288
PNG
(CHEMBL2041081)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1cc(Cl)c(=O)[nH]c1=O
Show InChI InChI=1S/C10H13ClN2O7/c11-3-1-13(10(19)12-8(3)18)9-7(17)6(16)5(15)4(2-14)20-9/h1,4-7,9,14-17H,2H2,(H,12,18,19)/t4-,5-,6+,7-,9-/m1/s1
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1.02E+3n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit skeletal muscle glycogen phosphorylase b using Glc-1-P as substrate


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50386283
PNG
(CHEMBL2041078)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1cc(C#C)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H14N2O7/c1-2-5-3-14(12(20)13-10(5)19)11-9(18)8(17)7(16)6(4-15)21-11/h1,3,6-9,11,15-18H,4H2,(H,13,19,20)/t6-,7-,8+,9-,11-/m1/s1
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4.70E+3n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit skeletal muscle glycogen phosphorylase b using Glc-1-P as substrate


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50316587
PNG
(1-D-glucopyranosyl uracil | 1-beta-D-glucopyranosy...)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C10H14N2O7/c13-3-4-6(15)7(16)8(17)9(19-4)12-2-1-5(14)11-10(12)18/h1-2,4,6-9,13,15-17H,3H2,(H,11,14,18)/t4-,6-,7+,8-,9-/m1/s1
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6.10E+3n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase inactive form b


Bioorg Med Chem 18: 3413-25 (2010)


Article DOI: 10.1016/j.bmc.2010.04.004
BindingDB Entry DOI: 10.7270/Q2TQ62GP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50316588
PNG
(1-D-glucopyranosyl cytosine | 4-amino-1-beta-D-glu...)
Show SMILES Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)n1
Show InChI InChI=1S/C10H15N3O6/c11-5-1-2-13(10(18)12-5)9-8(17)7(16)6(15)4(3-14)19-9/h1-2,4,6-9,14-17H,3H2,(H2,11,12,18)/t4-,6-,7+,8-,9-/m1/s1
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7.70E+3n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase inactive form b


Bioorg Med Chem 18: 3413-25 (2010)


Article DOI: 10.1016/j.bmc.2010.04.004
BindingDB Entry DOI: 10.7270/Q2TQ62GP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50386286
PNG
(CHEMBL2041079)
Show SMILES CCCc1cc2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(=O)nc2o1
Show InChI InChI=1S/C15H20N2O7/c1-2-3-8-4-7-5-17(15(22)16-13(7)23-8)14-12(21)11(20)10(19)9(6-18)24-14/h4-5,9-12,14,18-21H,2-3,6H2,1H3/t9-,10-,11+,12-,14-/m1/s1
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3.24E+4n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit skeletal muscle glycogen phosphorylase b using Glc-1-P as substrate


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50386287
PNG
(CHEMBL2041080)
Show SMILES CCCCCc1cc2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(=O)nc2o1
Show InChI InChI=1S/C17H24N2O7/c1-2-3-4-5-10-6-9-7-19(17(24)18-15(9)25-10)16-14(23)13(22)12(21)11(8-20)26-16/h6-7,11-14,16,20-23H,2-5,8H2,1H3/t11-,12-,13+,14-,16-/m1/s1
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3.34E+4n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit skeletal muscle glycogen phosphorylase b using Glc-1-P as substrate


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50316583
PNG
(CHEMBL1095543 | N-(1-((2R,4S,6R)-4-fluoro-3,5-dihy...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@@H](F)C1O)n1ccc(NC(=O)c2ccccc2)nc1=O
Show InChI InChI=1S/C17H18FN3O6/c18-12-13(23)10(8-22)27-16(14(12)24)21-7-6-11(20-17(21)26)19-15(25)9-4-2-1-3-5-9/h1-7,10,12-14,16,22-24H,8H2,(H,19,20,25,26)/t10-,12+,13?,14?,16-/m1/s1
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4.64E+4n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase inactive form b


Bioorg Med Chem 18: 3413-25 (2010)


Article DOI: 10.1016/j.bmc.2010.04.004
BindingDB Entry DOI: 10.7270/Q2TQ62GP
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50386284
PNG
(CHEMBL2041076)
Show SMILES CCCC#Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)[nH]c1=O
Show InChI InChI=1S/C15H20N2O7/c1-2-3-4-5-8-6-17(15(23)16-13(8)22)14-12(21)11(20)10(19)9(7-18)24-14/h6,9-12,14,18-21H,2-3,7H2,1H3,(H,16,22,23)/t9-,10-,11+,12-,14-/m1/s1
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3.03E+5n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit skeletal muscle glycogen phosphorylase b using Glc-1-P as substrate


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50316582
PNG
(1-((2R,4S,6R)-4-fluoro-3,5-dihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@@H](F)C1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C10H13FN2O6/c11-6-7(16)4(3-14)19-9(8(6)17)13-2-1-5(15)12-10(13)18/h1-2,4,6-9,14,16-17H,3H2,(H,12,15,18)/t4-,6+,7?,8?,9-/m1/s1
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3.46E+6n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase inactive form b


Bioorg Med Chem 18: 3413-25 (2010)


Article DOI: 10.1016/j.bmc.2010.04.004
BindingDB Entry DOI: 10.7270/Q2TQ62GP
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50316585
PNG
(5-fluoro-1-((2R,4S,6R)-4-fluoro-3,5-dihydroxy-6-(h...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@@H](F)C1O)n1cc(F)c(=O)[nH]c1=O
Show InChI InChI=1S/C10H12F2N2O6/c11-3-1-14(10(19)13-8(3)18)9-7(17)5(12)6(16)4(2-15)20-9/h1,4-7,9,15-17H,2H2,(H,13,18,19)/t4-,5+,6?,7?,9-/m1/s1
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3.67E+6n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase inactive form b


Bioorg Med Chem 18: 3413-25 (2010)


Article DOI: 10.1016/j.bmc.2010.04.004
BindingDB Entry DOI: 10.7270/Q2TQ62GP
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50316584
PNG
(4-amino-1-((2R,4S,6R)-4-fluoro-3,5-dihydroxy-6-(hy...)
Show SMILES Nc1ccn([C@@H]2O[C@H](CO)C(O)[C@H](F)C2O)c(=O)n1
Show InChI InChI=1S/C10H14FN3O5/c11-6-7(16)4(3-15)19-9(8(6)17)14-2-1-5(12)13-10(14)18/h1-2,4,6-9,15-17H,3H2,(H2,12,13,18)/t4-,6+,7?,8?,9-/m1/s1
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4.01E+6n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase inactive form b


Bioorg Med Chem 18: 3413-25 (2010)


Article DOI: 10.1016/j.bmc.2010.04.004
BindingDB Entry DOI: 10.7270/Q2TQ62GP
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50386285
PNG
(CHEMBL2041077)
Show SMILES CCCCCC#Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)[nH]c1=O
Show InChI InChI=1S/C17H24N2O7/c1-2-3-4-5-6-7-10-8-19(17(25)18-15(10)24)16-14(23)13(22)12(21)11(9-20)26-16/h8,11-14,16,20-23H,2-5,9H2,1H3,(H,18,24,25)/t11-,12-,13+,14-,16-/m1/s1
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n/an/a 6.10E+6n/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Competitive inhibition of rabbit skeletal muscle glycogen phosphorylase b using Glc-1-P as substrate


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Muscle glycogen phosphorylase


(Homo sapiens)
BDBM50386283
PNG
(CHEMBL2041078)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1cc(C#C)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H14N2O7/c1-2-5-3-14(12(20)13-10(5)19)11-9(18)8(17)7(16)6(4-15)21-11/h1,3,6-9,11,15-18H,4H2,(H,13,19,20)/t6-,7-,8+,9-,11-/m1/s1
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n/an/a 2.91E+5n/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of glycogen phosphorylase b in human HepG2 cells after 3 hrs


Eur J Med Chem 54: 740-9 (2012)


Article DOI: 10.1016/j.ejmech.2012.06.029
BindingDB Entry DOI: 10.7270/Q2VX0HKH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50382961
PNG
(CHEMBL1231802)
Show SMILES Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)[nH]c1=O
Show InChI InChI=1S/C11H16N2O7/c1-4-2-13(11(19)12-9(4)18)10-8(17)7(16)6(15)5(3-14)20-10/h2,5-8,10,14-17H,3H2,1H3,(H,12,18,19)/t5-,6-,7+,8-,10-/m1/s1
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n/an/a 6.60E+3n/an/an/an/an/an/a



Universit£ de Lyon

Curated by ChEMBL


Assay Description
Binding affinity to rabbit muscular GPb by NMR binding assay


J Med Chem 55: 1287-95 (2012)


Article DOI: 10.1021/jm201439b
BindingDB Entry DOI: 10.7270/Q21J9BS9
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)