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PubMed code 21752643

Compile data set for download or QSAR
Found 3 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
Albumin


(Bos taurus)
BDBM50349518
PNG
(BERGENIN)
Show SMILES COc1c(O)cc2C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]3c2c1O |r|
Show InChI InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1
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Article
PubMed
n/an/a 1.64E+5n/an/an/an/an/an/a



India Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Antiglycation activity in bovine serum albumin assessed as inhibition of fructosamines formation in presence of glucose


Bioorg Med Chem Lett 21: 4928-31 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.131
BindingDB Entry DOI: 10.7270/Q2N58MQ4
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50349520
PNG
(CHEMBL1808739)
Show SMILES COc1c(O)cc2C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4cc(O)c(O)c(O)c4)O[C@H]3c2c1O |r|
Show InChI InChI=1S/C21H20O13/c1-31-17-10(24)4-7-12(15(17)27)18-19(34-21(7)30)16(28)14(26)11(33-18)5-32-20(29)6-2-8(22)13(25)9(23)3-6/h2-4,11,14,16,18-19,22-28H,5H2,1H3/t11-,14-,16+,18+,19-/m1/s1
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Article
PubMed
n/an/a 1.84E+5n/an/an/an/an/an/a



India Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Antiglycation activity in bovine serum albumin assessed as inhibition of fructosamines formation in presence of glucose


Bioorg Med Chem Lett 21: 4928-31 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.131
BindingDB Entry DOI: 10.7270/Q2N58MQ4
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM50349519
PNG
(CHEMBL1808738)
Show SMILES COc1c(O)cc2C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4cccc(O)c4O)O[C@H]3c2c1O |r|
Show InChI InChI=1S/C21H20O12/c1-30-17-10(23)5-8-12(15(17)26)18-19(33-21(8)29)16(27)14(25)11(32-18)6-31-20(28)7-3-2-4-9(22)13(7)24/h2-5,11,14,16,18-19,22-27H,6H2,1H3/t11-,14-,16+,18+,19-/m1/s1
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PubMed
n/an/a 3.22E+5n/an/an/an/an/an/a



India Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Antiglycation activity in bovine serum albumin assessed as inhibition of fructosamines formation in presence of glucose


Bioorg Med Chem Lett 21: 4928-31 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.131
BindingDB Entry DOI: 10.7270/Q2N58MQ4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%