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Compile Data Set for Download or QSAR

Found 41 hits Enz. Inhib. hit(s) with all data for entry = 50042426   
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
Albumin


(Bos taurus)
BDBM50425942
PNG
(CHEMBL2313740)
Show SMILES COc1ccc(NC(=S)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C22H23FN4O3S/c1-29-17-5-3-16(4-6-17)25-22(31)24-13-20(28)27-10-8-14(9-11-27)21-18-7-2-15(23)12-19(18)30-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,31)
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n/an/a 3.60E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425923
PNG
(CHEMBL2313709)
Show SMILES COc1ccc(NC(=S)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C25H27FN4O3S/c1-32-19-7-5-18(6-8-19)27-25(34)30-12-2-3-21(30)24(31)29-13-10-16(11-14-29)23-20-9-4-17(26)15-22(20)33-28-23/h4-9,15-16,21H,2-3,10-14H2,1H3,(H,27,34)
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n/an/a 3.90E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425946
PNG
(CHEMBL2313736)
Show SMILES COc1ccccc1NC(=S)NCC(=O)N1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C22H23FN4O3S/c1-29-18-5-3-2-4-17(18)25-22(31)24-13-20(28)27-10-8-14(9-11-27)21-16-7-6-15(23)12-19(16)30-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,31)
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n/an/a 4.10E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425911
PNG
(CHEMBL2313700)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1cccc(Br)c1
Show InChI InChI=1S/C24H24BrFN4O2S/c25-16-3-1-4-18(13-16)27-24(33)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)32-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,33)
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n/an/a 4.70E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425932
PNG
(CHEMBL2313729)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=S)Nc1cccc(Br)c1
Show InChI InChI=1S/C21H20BrFN4O2S/c22-14-2-1-3-16(10-14)25-21(30)24-12-19(28)27-8-6-13(7-9-27)20-17-5-4-15(23)11-18(17)29-26-20/h1-5,10-11,13H,6-9,12H2,(H2,24,25,30)
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n/an/a 4.90E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425927
PNG
(CHEMBL2313705)
Show SMILES COc1ccccc1NC(=S)N1CCCC1C(=O)N1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C25H27FN4O3S/c1-32-21-7-3-2-5-19(21)27-25(34)30-12-4-6-20(30)24(31)29-13-10-16(11-14-29)23-18-9-8-17(26)15-22(18)33-28-23/h2-3,5,7-9,15-16,20H,4,6,10-14H2,1H3,(H,27,34)
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n/an/a 5.20E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425934
PNG
(CHEMBL2313727)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=S)Nc1ccccc1Br
Show InChI InChI=1S/C21H20BrFN4O2S/c22-16-3-1-2-4-17(16)25-21(30)24-12-19(28)27-9-7-13(8-10-27)20-15-6-5-14(23)11-18(15)29-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,30)
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n/an/a 6.30E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425910
PNG
(CHEMBL2313701)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C24H24BrFN4O3/c25-16-3-6-18(7-4-16)27-24(32)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)33-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,32)
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n/an/a 6.80E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425912
PNG
(CHEMBL2313699)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1cccc(Br)c1
Show InChI InChI=1S/C24H24BrFN4O3/c25-16-3-1-4-18(13-16)27-24(32)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)33-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,32)
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n/an/a 6.90E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425921
PNG
(CHEMBL2313711)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1ccccc1F
Show InChI InChI=1S/C24H24F2N4O2S/c25-16-7-8-17-21(14-16)32-28-22(17)15-9-12-29(13-10-15)23(31)20-6-3-11-30(20)24(33)27-19-5-2-1-4-18(19)26/h1-2,4-5,7-8,14-15,20H,3,6,9-13H2,(H,27,33)
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n/an/a 7.80E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425913
PNG
(CHEMBL2313698)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1ccccc1Br
Show InChI InChI=1S/C24H24BrFN4O2S/c25-18-4-1-2-5-19(18)27-24(33)30-11-3-6-20(30)23(31)29-12-9-15(10-13-29)22-17-8-7-16(26)14-21(17)32-28-22/h1-2,4-5,7-8,14-15,20H,3,6,9-13H2,(H,27,33)
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n/an/a 7.80E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425931
PNG
(CHEMBL2313730)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C21H20BrFN4O3/c22-14-1-4-16(5-2-14)25-21(29)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)30-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,29)
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n/an/a 8.50E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425940
PNG
(CHEMBL2313719)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=S)Nc1ccccc1F
Show InChI InChI=1S/C21H20F2N4O2S/c22-14-5-6-15-18(11-14)29-26-20(15)13-7-9-27(10-8-13)19(28)12-24-21(30)25-17-4-2-1-3-16(17)23/h1-6,11,13H,7-10,12H2,(H2,24,25,30)
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n/an/a 9.10E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425933
PNG
(CHEMBL2313728)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1cccc(Br)c1
Show InChI InChI=1S/C21H20BrFN4O3/c22-14-2-1-3-16(10-14)25-21(29)24-12-19(28)27-8-6-13(7-9-27)20-17-5-4-15(23)11-18(17)30-26-20/h1-5,10-11,13H,6-9,12H2,(H2,24,25,29)
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n/an/a 9.30E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425944
PNG
(CHEMBL2313738)
Show SMILES COc1cccc(NC(=S)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1
Show InChI InChI=1S/C22H23FN4O3S/c1-29-17-4-2-3-16(12-17)25-22(31)24-13-20(28)27-9-7-14(8-10-27)21-18-6-5-15(23)11-19(18)30-26-21/h2-6,11-12,14H,7-10,13H2,1H3,(H2,24,25,31)
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n/an/a 1.53E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425943
PNG
(CHEMBL2313739)
Show SMILES COc1ccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C22H23FN4O4/c1-30-17-5-3-16(4-6-17)25-22(29)24-13-20(28)27-10-8-14(9-11-27)21-18-7-2-15(23)12-19(18)31-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,29)
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n/an/a 1.95E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425947
PNG
(CHEMBL2313735)
Show SMILES COc1ccccc1NC(=O)NCC(=O)N1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C22H23FN4O4/c1-30-18-5-3-2-4-17(18)25-22(29)24-13-20(28)27-10-8-14(9-11-27)21-16-7-6-15(23)12-19(16)31-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,29)
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n/an/a 2.02E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425925
PNG
(CHEMBL2313707)
Show SMILES COc1cccc(NC(=S)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1
Show InChI InChI=1S/C25H27FN4O3S/c1-32-19-5-2-4-18(15-19)27-25(34)30-11-3-6-21(30)24(31)29-12-9-16(10-13-29)23-20-8-7-17(26)14-22(20)33-28-23/h2,4-5,7-8,14-16,21H,3,6,9-13H2,1H3,(H,27,34)
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n/an/a 2.05E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425945
PNG
(CHEMBL2313737)
Show SMILES COc1cccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1
Show InChI InChI=1S/C22H23FN4O4/c1-30-17-4-2-3-16(12-17)25-22(29)24-13-20(28)27-9-7-14(8-10-27)21-18-6-5-15(23)11-19(18)31-26-21/h2-6,11-12,14H,7-10,13H2,1H3,(H2,24,25,29)
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n/an/a 2.11E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425924
PNG
(CHEMBL2313708)
Show SMILES COc1ccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C25H27FN4O4/c1-33-19-7-5-18(6-8-19)27-25(32)30-12-2-3-21(30)24(31)29-13-10-16(11-14-29)23-20-9-4-17(26)15-22(20)34-28-23/h4-9,15-16,21H,2-3,10-14H2,1H3,(H,27,32)
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n/an/a 2.21E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425928
PNG
(CHEMBL2313704)
Show SMILES COc1ccccc1NC(=O)N1CCCC1C(=O)N1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C25H27FN4O4/c1-33-21-7-3-2-5-19(21)27-25(32)30-12-4-6-20(30)24(31)29-13-10-16(11-14-29)23-18-9-8-17(26)15-22(18)34-28-23/h2-3,5,7-9,15-16,20H,4,6,10-14H2,1H3,(H,27,32)
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n/an/a 3.06E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425926
PNG
(CHEMBL2313706)
Show SMILES COc1cccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1
Show InChI InChI=1S/C25H27FN4O4/c1-33-19-5-2-4-18(15-19)27-25(32)30-11-3-6-21(30)24(31)29-12-9-16(10-13-29)23-20-8-7-17(26)14-22(20)34-28-23/h2,4-5,7-8,14-16,21H,3,6,9-13H2,1H3,(H,27,32)
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n/an/a 3.34E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50217942
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chr...)
Show SMILES C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(O)c4c(cc(O)cc4=O)oc3-c3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-30,32-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1
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n/an/a 4.19E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425922
PNG
(CHEMBL2313710)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1ccccc1F
Show InChI InChI=1S/C24H24F2N4O3/c25-16-7-8-17-21(14-16)33-28-22(17)15-9-12-29(13-10-15)23(31)20-6-3-11-30(20)24(32)27-19-5-2-1-4-18(19)26/h1-2,4-5,7-8,14-15,20H,3,6,9-13H2,(H,27,32)
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n/an/a 5.48E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425941
PNG
(CHEMBL2313718)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1ccccc1F
Show InChI InChI=1S/C21H20F2N4O3/c22-14-5-6-15-18(11-14)30-26-20(15)13-7-9-27(10-8-13)19(28)12-24-21(29)25-17-4-2-1-3-16(17)23/h1-6,11,13H,7-10,12H2,(H2,24,25,29)
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n/an/a 5.55E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425914
PNG
(CHEMBL2313697)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C24H24ClFN4O2S/c25-16-3-6-18(7-4-16)27-24(33)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)32-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,33)
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n/an/a 5.94E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425915
PNG
(CHEMBL2313717)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C24H24ClFN4O3/c25-16-3-6-18(7-4-16)27-24(32)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)33-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,32)
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n/an/a 6.03E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425937
PNG
(CHEMBL2313722)
Show SMILES Fc1ccc(NC(=S)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C21H20F2N4O2S/c22-14-1-4-16(5-2-14)25-21(30)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)29-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,30)
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n/an/a 7.03E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425918
PNG
(CHEMBL2313714)
Show SMILES Fc1ccc(NC(=S)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C24H24F2N4O2S/c25-16-3-6-18(7-4-16)27-24(33)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)32-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,33)
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n/an/a 7.09E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425938
PNG
(CHEMBL2313721)
Show SMILES Fc1ccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C21H20F2N4O3/c22-14-1-4-16(5-2-14)25-21(29)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)30-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,29)
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n/an/a 7.58E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425919
PNG
(CHEMBL2313713)
Show SMILES Fc1ccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C24H24F2N4O3/c25-16-3-6-18(7-4-16)27-24(32)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)33-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,32)
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n/an/a 7.61E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425935
PNG
(CHEMBL2313725)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C21H20ClFN4O3/c22-14-1-4-16(5-2-14)25-21(29)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)30-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,29)
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n/an/a 8.39E+4n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425939
PNG
(CHEMBL2313720)
Show SMILES Fc1cccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1
Show InChI InChI=1S/C21H20F2N4O3/c22-14-2-1-3-16(10-14)25-21(29)24-12-19(28)27-8-6-13(7-9-27)20-17-5-4-15(23)11-18(17)30-26-20/h1-5,10-11,13H,6-9,12H2,(H2,24,25,29)
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n/an/a 1.00E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425920
PNG
(CHEMBL2313712)
Show SMILES Fc1cccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1
Show InChI InChI=1S/C24H24F2N4O3/c25-16-3-1-4-18(13-16)27-24(32)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)33-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,32)
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n/an/a 1.17E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425916
PNG
(CHEMBL2313716)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1cccc(Cl)c1
Show InChI InChI=1S/C24H24ClFN4O2S/c25-16-3-1-4-18(13-16)27-24(33)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)32-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,33)
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n/an/a 1.26E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425936
PNG
(CHEMBL2313723)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C21H20ClFN4O3/c22-14-2-1-3-16(10-14)25-21(29)24-12-19(28)27-8-6-13(7-9-27)20-17-5-4-15(23)11-18(17)30-26-20/h1-5,10-11,13H,6-9,12H2,(H2,24,25,29)
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n/an/a 1.44E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425917
PNG
(CHEMBL2313715)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C24H24ClFN4O3/c25-16-3-1-4-18(13-16)27-24(32)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)33-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,32)
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n/an/a 1.45E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425929
PNG
(CHEMBL2313703)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1ccccc1
Show InChI InChI=1S/C24H25FN4O2S/c25-17-8-9-19-21(15-17)31-27-22(19)16-10-13-28(14-11-16)23(30)20-7-4-12-29(20)24(32)26-18-5-2-1-3-6-18/h1-3,5-6,8-9,15-16,20H,4,7,10-14H2,(H,26,32)
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n/an/a 2.95E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425930
PNG
(CHEMBL2313732)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1ccccc1
Show InChI InChI=1S/C24H25FN4O3/c25-17-8-9-19-21(15-17)32-27-22(19)16-10-13-28(14-11-16)23(30)20-7-4-12-29(20)24(31)26-18-5-2-1-3-6-18/h1-3,5-6,8-9,15-16,20H,4,7,10-14H2,(H,26,31)
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PubMed
n/an/a 3.40E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425948
PNG
(CHEMBL2313734)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=S)Nc1ccccc1
Show InChI InChI=1S/C21H21FN4O2S/c22-15-6-7-17-18(12-15)28-25-20(17)14-8-10-26(11-9-14)19(27)13-23-21(29)24-16-4-2-1-3-5-16/h1-7,12,14H,8-11,13H2,(H2,23,24,29)
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n/an/a 3.81E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50425949
PNG
(CHEMBL2313733)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1ccccc1
Show InChI InChI=1S/C21H21FN4O3/c22-15-6-7-17-18(12-15)29-25-20(17)14-8-10-26(11-9-14)19(27)13-23-21(28)24-16-4-2-1-3-5-16/h1-7,12,14H,8-11,13H2,(H2,23,24,28)
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n/an/a 3.90E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...


Eur J Med Chem 60: 325-32 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.029
BindingDB Entry DOI: 10.7270/Q2JQ1292
More data for this
Ligand-Target Pair