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Compile Data Set for Download or QSAR

Found 15 hits with Last Name = 'szilágyi' and Initial = 'b'   
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))
BDBM50263773
PNG
(1-(2-naphthoyl)-3-((2R,3R,4S,5S,6R)-3,4,5-trihydro...)
Show SMILES OC[C@H]1O[C@@H](NC(=O)NC(=O)c2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C18H20N2O7/c21-8-12-13(22)14(23)15(24)17(27-12)20-18(26)19-16(25)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-15,17,21-24H,8H2,(H2,19,20,25,26)/t12-,13-,14+,15-,17-/m1/s1
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350n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50263771
PNG
(1-benzoyl-3-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(...)
Show SMILES OC[C@H]1O[C@@H](NC(=O)NC(=O)c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C14H18N2O7/c17-6-8-9(18)10(19)11(20)13(23-8)16-14(22)15-12(21)7-4-2-1-3-5-7/h1-5,8-11,13,17-20H,6H2,(H2,15,16,21,22)/t8-,9-,10+,11-,13-/m1/s1
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4.60E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50263723
PNG
(CHEMBL488967 | N-((2R,3R,4S,5S,6R)-3,4,5-trihydrox...)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C17H19NO6/c19-8-12-13(20)14(21)15(22)17(24-12)18-16(23)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-15,17,19-22H,8H2,(H,18,23)/t12-,13-,14+,15-,17-/m1/s1
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1.00E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50263772
PNG
(1-(1-naphthoyl)-3-((2R,3R,4S,5S,6R)-3,4,5-trihydro...)
Show SMILES OC[C@H]1O[C@@H](NC(=O)NC(=O)c2cccc3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C18H20N2O7/c21-8-12-13(22)14(23)15(24)17(27-12)20-18(26)19-16(25)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-15,17,21-24H,8H2,(H2,19,20,25,26)/t12-,13-,14+,15-,17-/m1/s1
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1.50E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439568
PNG
(CHEMBL2418614)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2nnc(o2)-c2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C19H19N3O7/c23-8-12-13(24)14(25)15(26)18(28-12)20-16(27)19-22-21-17(29-19)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-15,18,23-26H,8H2,(H,20,27)/t12-,13-,14+,15-,18-/m1/s1
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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 rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439564
PNG
(CHEMBL2418618)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2noc(n2)-c2cccc3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C19H19N3O7/c23-8-12-13(24)14(25)15(26)19(28-12)21-17(27)16-20-18(29-22-16)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-15,19,23-26H,8H2,(H,21,27)/t12-,13-,14+,15-,19-/m1/s1
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3.30E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439569
PNG
(CHEMBL2418611)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2cn(nn2)-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C15H18N4O6/c20-7-10-11(21)12(22)13(23)15(25-10)16-14(24)9-6-19(18-17-9)8-4-2-1-3-5-8/h1-6,10-13,15,20-23H,7H2,(H,16,24)/t10-,11-,12+,13-,15-/m1/s1
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7.50E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50240801
PNG
(CHEMBL131967 | N-((2R,3R,4S,5S,6R)-3,4,5-trihydrox...)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C13H17NO6/c15-6-8-9(16)10(17)11(18)13(20-8)14-12(19)7-4-2-1-3-5-7/h1-5,8-11,13,15-18H,6H2,(H,14,19)/t8-,9-,10+,11-,13-/m1/s1
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8.10E+4n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439563
PNG
(CHEMBL2418619)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2nc(no2)-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C15H17N3O7/c19-6-8-9(20)10(21)11(22)14(24-8)17-13(23)15-16-12(18-25-15)7-4-2-1-3-5-7/h1-5,8-11,14,19-22H,6H2,(H,17,23)/t8-,9-,10+,11-,14-/m1/s1
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1.04E+5n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439565
PNG
(CHEMBL2418616)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2noc(n2)-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C15H17N3O7/c19-6-8-9(20)10(21)11(22)15(24-8)17-13(23)12-16-14(25-18-12)7-4-2-1-3-5-7/h1-5,8-11,15,19-22H,6H2,(H,17,23)/t8-,9-,10+,11-,15-/m1/s1
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1.36E+5n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439562
PNG
(CHEMBL2418621)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2nc(no2)-c2cccc3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C19H19N3O7/c23-8-12-13(24)14(25)15(26)18(28-12)21-17(27)19-20-16(22-29-19)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-15,18,23-26H,8H2,(H,21,27)/t12-,13-,14+,15-,18-/m1/s1
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1.45E+5n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439566
PNG
(CHEMBL2418615)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2nnc(o2)-c2cccc3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C19H19N3O7/c23-8-12-13(24)14(25)15(26)18(28-12)20-16(27)19-22-21-17(29-19)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-15,18,23-26H,8H2,(H,20,27)/t12-,13-,14+,15-,18-/m1/s1
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1.72E+5n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439570
PNG
(CHEMBL2418622)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2cc(no2)-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C16H18N2O7/c19-7-11-12(20)13(21)14(22)16(24-11)17-15(23)10-6-9(18-25-10)8-4-2-1-3-5-8/h1-6,11-14,16,19-22H,7H2,(H,17,23)/t11-,12-,13+,14-,16-/m1/s1
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1.72E+5n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50263722
PNG
(CHEMBL450104 | N-((2R,3R,4S,5S,6R)-3,4,5-trihydrox...)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2cccc3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C17H19NO6/c19-8-12-13(20)14(21)15(22)17(24-12)18-16(23)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-15,17,19-22H,8H2,(H,18,23)/t12-,13-,14+,15-,17-/m1/s1
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4.44E+5n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50439567
PNG
(CHEMBL2418613)
Show SMILES OC[C@H]1O[C@@H](NC(=O)c2nnc(o2)-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C15H17N3O7/c19-6-8-9(20)10(21)11(22)14(24-8)16-12(23)15-18-17-13(25-15)7-4-2-1-3-5-7/h1-5,8-11,14,19-22H,6H2,(H,16,23)/t8-,9-,10+,11-,14-/m1/s1
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5.45E+5n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Lineweaver-Burk plot method


Bioorg Med Chem 21: 5738-47 (2013)


Article DOI: 10.1016/j.bmc.2013.07.024
BindingDB Entry DOI: 10.7270/Q2BC410F
More data for this
Ligand-Target Pair