BDBM50294837 CHEMBL4161045

SMILES CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(=O)N[C@H](C(C)C)C(O)=O

InChI Key InChIKey=XPVQAQNKOLGKPP-UHFFFAOYSA-N

Data  4 IC50

  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 = 50294837   

TargetNeuraminidase(Influenza A virus)
Shandong University

Curated by ChEMBL
LigandPNGBDBM50294837(CHEMBL4161045)
Affinity DataIC50: 88nMAssay Description:Inhibition of influenza A virus chicken/china/1220/2012(H5N1) neuraminidase using 4-MU-NANA as substrate pre-incubated for 10 mins followed by substr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/5/2020
Entry Details Article
PubMed
TargetNeuraminidase(Influenza A virus)
Shandong University

Curated by ChEMBL
LigandPNGBDBM50294837(CHEMBL4161045)
Affinity DataIC50: 97nMAssay Description:Inhibition of influenza A virus duck/Guangdong/674/2014(H5N6) neuraminidase using 4-MU-NANA as substrate pre-incubated for 10 mins followed by substr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/5/2020
Entry Details Article
PubMed
TargetNeuraminidase(Influenza A virus)
Shandong University

Curated by ChEMBL
LigandPNGBDBM50294837(CHEMBL4161045)
Affinity DataIC50: 3.78E+4nMAssay Description:Inhibition of influenza A virus chicken/china/1220/2012(H5N1) neuraminidase H274Y mutant using 4-MU-NANA as substrate pre-incubated for 10 mins follo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/5/2020
Entry Details Article
PubMed
TargetNeuraminidase(Influenza A virus)
Shandong University

Curated by ChEMBL
LigandPNGBDBM50294837(CHEMBL4161045)
Affinity DataIC50: 4.18E+3nMAssay Description:Inhibition of Influenza A virus A/Anhui/2005(H5N1) neuraminidase using MUNANA as substrate pretreated for 10 mins followed by substrate addition and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed