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SMILES: [Na;v0+].[H][C@]1([#8]-[#6](=[#6]-[#6@H](-[#8])-[#6@H]1-[#7]-[#6](=O)-[#6](-[#6])-[#6])-[#6](-[#8-])=O)[#6@H](-[#8])-[#6@H](-[#8])-[#6]-[#8]

InChI Key: InChIKey=DABFDRRDOJFLBA-WWIZLJSCSA-M

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50497275   
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
Neuraminidase


(Influenza A virus)
BDBM50497275
PNG
(CHEMBL3330709)
Show SMILES [Na;v0+].[H][C@]1([#8]-[#6](=[#6]-[#6@H](-[#8])-[#6@H]1-[#7]-[#6](=O)-[#6](-[#6])-[#6])-[#6](-[#8-])=O)[#6@H](-[#8])-[#6@H](-[#8])-[#6]-[#8] |r,c:3|
Show InChI InChI=1S/C13H21NO8.Na/c1-5(2)12(19)14-9-6(16)3-8(13(20)21)22-11(9)10(18)7(17)4-15;/h3,5-7,9-11,15-18H,4H2,1-2H3,(H,14,19)(H,20,21);/q;+1/p-1/t6-,7+,9+,10+,11+;/m0./s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.82E+3n/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of neuraminidase activity of human parainfluenza virus 1 C35 hemagglutinin-neuraminidase pre-incubated for 20 mins before MUN substrate by...


J Med Chem 57: 7613-23 (2014)


Article DOI: 10.1021/jm500759v
BindingDB Entry DOI: 10.7270/Q2DB84VP
More data for this
Ligand-Target Pair