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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sialidase-2' and Ligand = 'BDBM50487728'   
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
Sialidase-2


(Homo sapiens (Human))
BDBM50487728
PNG
(CHEMBL116550)
Show SMILES [H][C@]1(OC(=C[C@H](O)[C@H]1NC(C)=O)C(O)=O)[C@@H](O)[C@@H](O)CO |r,c:3|
Show InChI InChI=1S/C11H17NO8/c1-4(14)12-8-5(15)2-7(11(18)19)20-10(8)9(17)6(16)3-13/h2,5-6,8-10,13,15-17H,3H2,1H3,(H,12,14)(H,18,19)/t5-,6-,8+,9-,10+/m0/s1
PDB
MMDB

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KEGG
PC cid
PC sid
UniChem
Article
n/an/a 4.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Homo sapiens (human) NEU2 expressed in HEK293 cells using 4MU-NeuAc as substrate after 10 to 30 min by fluorometric analysis


Citation and Details

Article DOI: 10.1007/s00044-009-9269-6
BindingDB Entry DOI: 10.7270/Q2VD72BG
More data for this
Ligand-Target Pair