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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for UniProtKB: A4U6B8   
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 (A/turkey/Italy/4426/2000(H7N1)))
BDBM5025
PNG
(Oseltamivir | US10919856, POSITIVE CONTROL | ethyl...)
Show SMILES [H][C@@]1(OC(CC)CC)C=C(C[C@H](N)[C@H]1NC(C)=O)C(=O)OCC |r,c:8|
Show InChI InChI=1S/C16H28N2O4/c1-5-12(6-2)22-14-9-11(16(20)21-7-3)8-13(17)15(14)18-10(4)19/h9,12-15H,5-8,17H2,1-4H3,(H,18,19)/t13-,14+,15+/m0/s1
PDB

UniProtKB/TrEMBL

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MCE
KEGG
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 23.7n/an/an/an/a6.5n/a



Chulalongkorn University



Assay Description
Practically in a microtitre plate, 90 μl of 33 mM MES pH 6.5 containing 4 mM CaCl2 were dispensed in each well, except for the first well of eac...


J Enzyme Inhib Med Chem 27: 5-11 (2012)


Article DOI: 10.3109/14756366.2011.568415
BindingDB Entry DOI: 10.7270/Q2VT1R04
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (A/turkey/Italy/4426/2000(H7N1)))
BDBM5025
PNG
(Oseltamivir | US10919856, POSITIVE CONTROL | ethyl...)
Show SMILES [H][C@@]1(OC(CC)CC)C=C(C[C@H](N)[C@H]1NC(C)=O)C(=O)OCC |r,c:8|
Show InChI InChI=1S/C16H28N2O4/c1-5-12(6-2)22-14-9-11(16(20)21-7-3)8-13(17)15(14)18-10(4)19/h9,12-15H,5-8,17H2,1-4H3,(H,18,19)/t13-,14+,15+/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

DrugBank
MCE
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 25n/an/an/an/a6.537



Chulalongkorn University



Assay Description
The 50% inhibitory concentration (IC50) determination was carried out by using a 96-well microtitre plate as an array of reaction vessels. In the fir...


J Enzyme Inhib Med Chem 27: 5-11 (2012)


Article DOI: 10.3109/14756366.2011.568415
BindingDB Entry DOI: 10.7270/Q2VT1R04
More data for this
Ligand-Target Pair