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.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 5025   

TargetNeuraminidase(Influenza A virus)
Universidade Federal Fluminense

Curated by ChEMBL
LigandPNGBDBM5025(Oseltamivir | US10919856, POSITIVE CONTROL | ethyl...)copy SMILEScopy InChI
Affinity DataIC50: 150nMAssay Description:Inhibition of oseltamivir-resistant Influenza A virus H3N2 neuraminidaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2FB55X5PubMed
TargetNeuraminidase(Influenza A virus)
Universidade Federal Fluminense

Curated by ChEMBL
LigandPNGBDBM5025(Oseltamivir | US10919856, POSITIVE CONTROL | ethyl...)copy SMILEScopy InChI
Affinity DataIC50: 210nMAssay Description:Inhibition of Influenza A virus H1N1 wild type neuraminidaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2FB55X5PubMed
TargetNeuraminidase(Influenza A virus)
Universidade Federal Fluminense

Curated by ChEMBL
LigandPNGBDBM5025(Oseltamivir | US10919856, POSITIVE CONTROL | ethyl...)copy SMILEScopy InChI
Affinity DataIC50: 7.99E+4nMAssay Description:Inhibition of Influenza A virus H1N1 neuraminidase H275Y mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2FB55X5PubMed
TargetNeuraminidase(Influenza A virus)
Universidade Federal Fluminense

Curated by ChEMBL
LigandPNGBDBM5025(Oseltamivir | US10919856, POSITIVE CONTROL | ethyl...)copy SMILEScopy InChI
Affinity DataIC50: 4.19E+3nMAssay Description:Inhibition of oseltamivir-resistant Influenza A virus H3N2 neuraminidase E119V mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2FB55X5PubMed