null
SMILES [H][C@@]1(OC(CC)CC)C=C(C[C@H](N)[C@H]1NC(C)=O)C(=O)OCC
InChI Key InChIKey=VSZGPKBBMSAYNT-RRFJBIMHSA-N
PDB links: 6 PDB IDs contain inhibitors having a similarity of 90% to this monomer.
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 127 hits for monomerid = 5025
TargetNeuraminidase(Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...)
Charles University
Curated by ChEMBL
Charles University
Curated by ChEMBL
Affinity DataKi: 860nMAssay Description:Inhibition of influenza A virus chicken/Nakorn-Patom/Thailand/CU-K2-2004 Neuraminidase N1 at pH 7.4 by DIANA assayMore data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...)
Charles University
Curated by ChEMBL
Charles University
Curated by ChEMBL
Affinity DataKi: 1.21E+4nMAssay Description:Inhibition of neuraminidase in influenza A virus (A/Puerto Rico/8/1934(H1N1)) pre-incubated for 30 mins before NA-Star substrate addition for 30 mins...More data for this Ligand-Target Pair
Affinity DataIC50: 1nMpH: 6.5 T: 2°CAssay Description:A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...More data for this Ligand-Target Pair
Affinity DataIC50: 5nMpH: 6.5 T: 2°CAssay Description:A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...More data for this Ligand-Target Pair
Affinity DataIC50: 25nMpH: 6.5 T: 2°CAssay 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...More data for this Ligand-Target Pair
TargetNon-structural protein 1(Influenza A virus (A/turkey/Italy/8000/2002(H7N3)))
Chulalongkorn University
Chulalongkorn University
Affinity DataIC50: 0.200nMpH: 6.5 T: 2°CAssay 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...More data for this Ligand-Target Pair
Affinity DataIC50: 23.7nMpH: 6.5Assay 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...More data for this Ligand-Target Pair
TargetNon-structural protein 1(Influenza A virus (A/turkey/Italy/8000/2002(H7N3)))
Chulalongkorn University
Chulalongkorn University
Affinity DataIC50: 0.120nMpH: 6.5Assay 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...More data for this Ligand-Target Pair
Affinity DataIC50: 800nMAssay Description:Inhibition of Influenza A virus (A/RI/5+/1957(H2N2)) recombinant neuraminidase using MUNANA as substrate after 30 minsMore data for this Ligand-Target Pair
Affinity DataIC50: 17nMAssay Description:Inhibition of Influenza A virus A/chicken/china/1220/2012(H5N1) Neuraminidase N1More data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Shandong University
Curated by ChEMBL
Shandong University
Curated by ChEMBL
Affinity DataIC50: 13nMAssay Description:Inhibition of Influenza A virus A/duck/china/1206/2012(H5N1) NeuraminidaseMore data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Shandong University
Curated by ChEMBL
Shandong University
Curated by ChEMBL
Affinity DataIC50: 9nMAssay Description:Inhibition of Influenza A virus A/duck/china/QJ/01(H5N1) NeuraminidaseMore data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Shandong University
Curated by ChEMBL
Shandong University
Curated by ChEMBL
Affinity DataIC50: 3.10nMAssay Description:Inhibition of Influenza A virus A/chicken/shandong/S2/02(H9N2) NeuraminidaseMore data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Shandong University
Curated by ChEMBL
Shandong University
Curated by ChEMBL
Affinity DataIC50: 2.05E+4nMAssay Description:Inhibition of recombinant Influenza A virus H1N1 neuraminidase using 4-methylumbelliferyl-alpha-D-Nacetylneuraminic acid sodium salt hydrate as subst...More data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Shandong University
Curated by ChEMBL
Shandong University
Curated by ChEMBL
Affinity DataIC50: 8.82E+4nMAssay Description:Inhibition of Influenza A virus H5N1 neuraminidase using 4-methylumbelliferyl-alpha-D-Nacetylneuraminic acid sodium salt hydrate as substrate by fluo...More data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Shandong University
Curated by ChEMBL
Shandong University
Curated by ChEMBL
Affinity DataIC50: 1.40nMAssay Description:Inhibition of influenza A virus (A/Perth/16/2009(H3N2)) neuraminidase using MUNANA substrate pre-incubated for 30 mins before substrate addition by f...More data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Shandong University
Curated by ChEMBL
Shandong University
Curated by ChEMBL
Affinity DataIC50: 2.60nMAssay Description:Inhibition of influenza A virus (A/California/07/2009(H1N1)) pdm09 neuraminidase using MUNANA substrate pre-incubated for 30 mins before substrate ad...More data for this Ligand-Target Pair
Affinity DataIC50: 1.83E+7nMAssay Description:Inhibition of rat recombinant PEPT1 expressed in Pichia pastoris GS115 assessed as [3H]GlySar uptake after 30s by dual-channel liquid scintillation c...More data for this Ligand-Target Pair
Affinity DataIC50: 1.07E+7nMAssay Description:Inhibition of mouse recombinant PEPT1 expressed in Pichia pastoris GS115 assessed as [3H]GlySar uptake after 30s by dual-channel liquid scintillation...More data for this Ligand-Target Pair
TargetSolute carrier family 15 member 1(Homo sapiens (Human))
University of Michigan
Curated by ChEMBL
University of Michigan
Curated by ChEMBL
Affinity DataIC50: 2.74E+7nMAssay Description:Inhibition of human recombinant PEPT1 expressed in Pichia pastoris GS115 assessed as [3H]GlySar uptake after 30s by dual-channel liquid scintillation...More data for this Ligand-Target Pair
TargetATP-dependent translocase ABCB1(Homo sapiens (Human))
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
Affinity DataIC50: 1.30E+6nMAssay Description:Inhibition of human MDR1-mediated digoxin permeability expressed in pig LLC-PK1 cellsMore data for this Ligand-Target Pair
Affinity DataIC50: 1.00E+7nMAssay Description:Inhibition of human neuraminidase 3 assessed as inhibition of GM3 hydrolysisMore data for this Ligand-Target Pair
Affinity DataIC50: 1.33E+5nMAssay Description:Inhibition of human MRP2 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...More data for this Ligand-Target Pair
Affinity DataIC50: 1.33E+5nMAssay Description:Inhibition of human MRP4 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...More data for this Ligand-Target Pair
Affinity DataIC50: 1.33E+5nMAssay Description:Inhibition of human BSEP overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-taurocholate in presence of ATP measured after 15 to ...More data for this Ligand-Target Pair
Affinity DataIC50: 1.33E+5nMAssay Description:Inhibition of human MRP3 overexpressed in Sf9 insect cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ...More data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...)
Charles University
Curated by ChEMBL
Charles University
Curated by ChEMBL
Affinity DataIC50: 78nMAssay Description:Selectivity against alphaV-beta3 integrinMore data for this Ligand-Target Pair
Affinity DataIC50: 210nMAssay Description:Inhibition of Influenza A virus A/Anhui/1/2005(H5N1) neuraminidase using MUNANA as substrate preincubated for 5 to 15 mins followed by substrate addi...More data for this Ligand-Target Pair
TargetNeuraminidase(Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...)
Charles University
Curated by ChEMBL
Charles University
Curated by ChEMBL
Affinity DataIC50: 4.07E+3nMAssay Description:Inhibition of Influenza A virus A/California/04/2009(H1N1) neuraminidase H274Y mutant using MUNANA as substrate preincubated for 5 to 15 mins followe...More data for this Ligand-Target Pair
Affinity DataIC50: 6.10E+3nMAssay Description:Inhibition of Influenza A virus A/Anhui/1/2005(H5N1) neuraminidase H274Y mutant using MUNANA as substrate preincubated for 5 to 15 mins followed by s...More data for this Ligand-Target Pair
Affinity DataIC50: 15nMAssay Description:Inhibition of Influenza A virus A/Anhui/1/2013(H7N9) neuraminidase 150 cavity at 10 uM using MUNANA as substrate preincubated for 5 to 15 mins follow...More data for this Ligand-Target Pair
Affinity DataIC50: 2.5nMAssay Description:Inhibition of Influenza A virus A/California/04/2009(H1N1) neuraminidase using MUNANA as substrate preincubated for 5 to 15 mins followed by substrat...More data for this Ligand-Target Pair
Affinity DataIC50: 6.11E+4nMAssay Description:Inhibition of Clostridium perfringenes neuraminidase activity using 4-methylumbelliferyl-1-alpha-D-N-acetylneuramic acid sodium salt hydrate as subst...More data for this Ligand-Target Pair
Affinity DataIC50: 0.870nMAssay Description:Inhibition of Influenza A H1N1 virus neuraminidase after 1 hr by spectrofluorimetry using 2-(4-meythylumbelliferyl)-alpha-D-acetylneuramic acid as su...More data for this Ligand-Target Pair
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of MBP-fused recombinant human neuraminidase 4 expressed in Escherichia coli using 4MU-NANA as substrate preincubated for 15 mins followed...More data for this Ligand-Target Pair
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of MBP-fused recombinant human neuraminidase 2 expressed in Escherichia coli using 4MU-NANA as substrate preincubated for 15 mins followed...More data for this Ligand-Target Pair
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of MBP-fused recombinant human neuraminidase 3 expressed in Escherichia coli using 4MU-NANA as substrate preincubated for 15 mins followed...More data for this Ligand-Target Pair
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of recombinant His6-tagged human neuraminidase 1 expressed in HEK293 cells using 4MU-NANA as substrate preincubated for 15 mins followed b...More data for this Ligand-Target Pair
Affinity DataIC50: 1.06E+3nMAssay Description:Inhibition of Influenza A virus type A H3N2 neuraminidaseMore data for this Ligand-Target Pair
Affinity DataIC50: 1.06E+3nMAssay Description:Inhibition of Influenza A virus type A H3N2 neuraminidaseMore data for this Ligand-Target Pair
Affinity DataIC50: 127nMAssay Description:Inhibition of influenza A virus H1N1 Neuraminidase using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid sodium salt hydrate substrateMore data for this Ligand-Target Pair
Affinity DataIC50: 15.8nMAssay Description:Inhibition of influenza A virus H9N2 Neuraminidase using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid sodium salt hydrate substrateMore data for this Ligand-Target Pair
Affinity DataIC50: 150nMAssay Description:Inhibition of oseltamivir-resistant Influenza A virus H3N2 neuraminidaseMore data for this Ligand-Target Pair
Affinity DataIC50: 210nMAssay Description:Inhibition of Influenza A virus H1N1 wild type neuraminidaseMore data for this Ligand-Target Pair
Affinity DataIC50: 7.99E+4nMAssay Description:Inhibition of Influenza A virus H1N1 neuraminidase H275Y mutantMore data for this Ligand-Target Pair
Affinity DataIC50: 4.19E+3nMAssay Description:Inhibition of oseltamivir-resistant Influenza A virus H3N2 neuraminidase E119V mutantMore data for this Ligand-Target Pair
Affinity DataIC50: 1.60nMAssay Description:Inhibition of Influenza A virus (A/Kitakyushu/159/1993(H3N2)) neuraminidase after 30 mins by fluorescence analysisMore data for this Ligand-Target Pair
Affinity DataIC50: 1.70nMAssay Description:Inhibition of Influenza A virus (A/duck/Memphis/546/1974(H11N9)) neuraminidase after 30 mins by fluorescence analysisMore data for this Ligand-Target Pair
Affinity DataIC50: 0.885nMAssay Description:Inhibition of Influenza A virus (A/Saitama/07/2006(H3N2)) neuraminidase after 30 mins by fluorescence analysisMore data for this Ligand-Target Pair
Affinity DataIC50: 0.925nMAssay Description:Inhibition of Influenza A virus (A/Singapore/1/1957(H2N2)) neuraminidase after 30 mins by fluorescence analysisMore data for this Ligand-Target Pair