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Compile Data Set for Download or QSAR

Found 24 hits Enz. Inhib. hit(s) with all data for entry = 50032888   
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
Galectin-8


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 1.60n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 85n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 2 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 85n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 2 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 1.06E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-3 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 304n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 0.233n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 136n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 36.9n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 780n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 2 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 58n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 2 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 31.3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 2 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 490n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 2 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 1.43E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-3 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 2.20E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-3 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 24.6n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 2 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 304n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 2.20E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-3 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 1.43E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-3 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 1.06E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-3 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336204
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O11S/c25-13-15-17(27)18(28)20(30)24(33-15)35-22-16(14-26)34-23(21(31)19(22)29)32-11-9-7-5-3-1-2-4-6-8-10-12-36/h15-31,36H,1-14H2/t15-,16-,17+,18+,19-,20-,21-,22-,23-,24?/m1/s1
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n/an/an/a 1.60n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336202
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)C[C@@H](OCCCCCCCCCCCCS)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C24H46O10S/c25-14-17-20(28)21(29)22(30)24(33-17)34-23-16(27)13-19(32-18(23)15-26)31-11-9-7-5-3-1-2-4-6-8-10-12-35/h16-30,35H,1-15H2/t16-,17-,18-,19+,20+,21+,22-,23+,24+/m1/s1
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n/an/an/a 36.9n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-8


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 0.233n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-8 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 1.26E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair
Galectin-4


(Homo sapiens (Human))
BDBM50336203
PNG
(12-Mercaptododecyl-beta-D-galactopyranosyl-(1->4)-...)
Show SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1OCCCCCCCCCCCCS |r|
Show InChI InChI=1S/C26H49NO11S/c1-16(30)27-19-21(32)24(38-26-23(34)22(33)20(31)17(14-28)36-26)18(15-29)37-25(19)35-12-10-8-6-4-2-3-5-7-9-11-13-39/h17-26,28-29,31-34,39H,2-15H2,1H3,(H,27,30)/t17-,18-,19-,20+,21-,22+,23-,24-,25+,26+/m1/s1
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n/an/an/a 1.26E+3n/an/an/an/an/a



National Institute of Advanced Industrial Science and Technology (AIST)

Curated by ChEMBL


Assay Description
Binding affinity to human galectin-4 component 1 by surface plasmon resonance method


Bioorg Med Chem Lett 21: 1265-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.049
BindingDB Entry DOI: 10.7270/Q29G5N3B
More data for this
Ligand-Target Pair