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1 similar compounds to monomer 50272378

Compile data set for download or QSAR
Wt: 332.3
BDBM50272336

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50272336   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Galectin-1


(Homo sapiens (Human))
BDBM50272336
PNG
(2-Acetamido-5-(beta-D-galactopyranosyl)-4-methylth...)
Show SMILES CC(=O)Nc1nc(C)c(C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1
Show InChI InChI=1S/C13H20N2O6S/c1-5-9(22-13(14-5)15-6(2)17)3-7-10(18)12(20)11(19)8(4-16)21-7/h7-8,10-12,16,18-20H,3-4H2,1-2H3,(H,14,15,17)/t7-,8+,10-,11-,12+/m0/s1
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)


Article DOI: 10.1016/j.bmc.2008.06.044
BindingDB Entry DOI: 10.7270/Q2HQ40TS
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM50272336
PNG
(2-Acetamido-5-(beta-D-galactopyranosyl)-4-methylth...)
Show SMILES CC(=O)Nc1nc(C)c(C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1
Show InChI InChI=1S/C13H20N2O6S/c1-5-9(22-13(14-5)15-6(2)17)3-7-10(18)12(20)11(19)8(4-16)21-7/h7-8,10-12,16,18-20H,3-4H2,1-2H3,(H,14,15,17)/t7-,8+,10-,11-,12+/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 3 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)


Article DOI: 10.1016/j.bmc.2008.06.044
BindingDB Entry DOI: 10.7270/Q2HQ40TS
More data for this
Ligand-Target Pair