BDBM50343682 ((1S,5R,6R)-6-acetamido-3-carboxy-5-(pentan-3-yloxy)cyclohex-2-enylamino)(amino)methaniminium 2,2,2-trifluoroacetate::(3S,4R,5R)-4-Acetamido-5-(1-ethylpropoxy)-3-guanidinocyclohex-1-ene-1-carboxylic Acid TrifluoroacetateSalt::CHEMBL1270126

SMILES [#6]-[#6]-[#6](-[#6]-[#6])-[#8]-[#6@@H]-1-[#6]-[#6](=[#6]-[#6@H](\[#7]=[#6](/[#7])-[#7])-[#6@H]-1-[#7]-[#6](-[#6])=O)-[#6](-[#8])=O

InChI Key InChIKey=HGYRNBWLYZJBDT-YNEHKIRRSA-N

Data  1 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50343682   

TargetNeuraminidase(Influenza A virus)
Simon Fraser University

Curated by ChEMBL
LigandPNGBDBM50343682(((1S,5R,6R)-6-acetamido-3-carboxy-5-(pentan-3-ylox...)
Affinity DataKi:  0.460nMAssay Description:Inhibition of influenza A nuraminidase N1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSialidase-3(Homo sapiens (Human))
University Of Alberta

Curated by ChEMBL
LigandPNGBDBM50343682(((1S,5R,6R)-6-acetamido-3-carboxy-5-(pentan-3-ylox...)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human NEU3 using 4MU-NA as substrate after 1 hr by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSialidase-4(Homo sapiens (Human))
University Of Alberta

Curated by ChEMBL
LigandPNGBDBM50343682(((1S,5R,6R)-6-acetamido-3-carboxy-5-(pentan-3-ylox...)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human NEU4 using 4MU-NA as substrate after 1 hr by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed