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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Galectin-8' and Ligand = 'BDBM50336202'   
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))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
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