BDBM50078329 1-[4-CARBOXY-2-(3-PENTYLAMINO)PHENYL]-5,5'-DI(HYDROXYMETHYL)PYRROLIDIN-2-ONE::1-[4-carboxy-2-(3-pentylamino)phenyl]-5,5-bis(hydroxymethyl)pyrrolidin-2-one::4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-[(1-ethylpropyl)amino]benzoic acid::CHEMBL307189

SMILES CCC(CC)Nc1cc(ccc1N2C(=O)CCC2(CO)CO)C(=O)O

InChI Key InChIKey=BNIJJJRESBVRNB-UHFFFAOYSA-N

Data  6 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50078329   

TargetNeuraminidase(Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)
University of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50078329(4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-...)
Affinity DataIC50: 48nMAssay Description:In vitro inhibitory activity against H1N9 Influenza A Neuraminidase.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetNeuraminidase(Influenza B virus (B/Lee/40))
University of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50078329(4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-...)
Affinity DataIC50: 1.04E+5nMAssay Description:In vitro inhibitory activity against B/Lee/40 Influenza B Neuraminidase.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetNeuraminidase(Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)
University of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50078329(4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-...)
Affinity DataIC50: 7.90E+4nMAssay Description:Inhibition of Influenza A virus (A/Puerto Rico/8/1934(H1N1)) neuraminidase using fluorogenic substrate 2'-(4-methylumbelliferyl)-alpha-D-N-acetylneur...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMed
TargetNeuraminidase(Influenza A virus (A/Udorn/307/1972(H3N2)))
University of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50078329(4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-...)
Affinity DataIC50: 490nMAssay Description:Inhibition of Influenza A virus (A/udorn/1972(H3N2)) neuraminidase using fluorogenic substrate 2'-(4-methylumbelliferyl)-alpha-D-N-acetylneuraminic a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMed
TargetNeuraminidase(Influenza B virus (B/Lee/40))
University of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50078329(4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-...)
Affinity DataIC50: 2.71E+5nMAssay Description:Inhibition of Influenza B virus (B/Lee/1940) neuraminidase using fluorogenic substrate 2'-(4-methylumbelliferyl)-alpha-D-N-acetylneuraminic acid prei...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetNeuraminidase(Influenza A virus)
Lanzhou University

Curated by ChEMBL
LigandPNGBDBM50078329(4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-...)
Affinity DataIC50: 0.0500nMAssay Description:Inhibition of influenza virus neuraminidaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2020
Entry Details Article
PubMed