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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with all data for assayid = 3 entry = 50046087   
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-3


(Homo sapiens (Human))
BDBM50094303
PNG
(CHEMBL3590105)
Show SMILES OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](OCCOCCOCCn3cc(CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)nn3)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C27H45N3O5/c28-13-7-17-34-15-4-5-16-35-18-8-14-29-27(33)25(20-23-11-6-12-24(31)19-23)30-26(32)21-22-9-2-1-3-10-22/h6,11-12,19,22,25,31H,1-5,7-10,13-18,20-21,28H2,(H,29,33)(H,30,32)/t25-/m0/s1
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PC cid
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Similars

Article
PubMed
n/an/an/a 1.90E+4n/an/an/an/an/a



FCFRP - USP

Curated by ChEMBL


Assay Description
Inhibition of human recombinant wild type galectin 3 second carbohydrate recognition domain after 60 mins by surface plasmon resonance immunosensor a...


Bioorg Med Chem 23: 3414-25 (2015)


Article DOI: 10.1016/j.bmc.2015.04.044
BindingDB Entry DOI: 10.7270/Q2028T8V
More data for this
Ligand-Target Pair