BDBM50182248 CHEMBL3818654

SMILES OC(=O)C(F)(F)F.[H][C@]1(OC(=C[C@H](NC(N)=N)[C@H]1NC(C)=O)C(O)=O)[C@H](O)[C@H](O)CNC(=O)C1CC1

InChI Key InChIKey=PJACZVKRCAPZRL-ZGVNSRHASA-N

Data  21 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 21 hits for monomerid = 50182248   

TargetSialidase-1(Homo sapiens (Human))
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human Neu1 expressed in HEK293T cells using 4MU-Neu5Ac as substrate incubated for 30 mins by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  6.40nMAssay Description:Inhibition of Influenza A virus (A/Aichi/102/2008(H3N2)) neuraminidase N2 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins followed by...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSialidase-3(Homo sapiens (Human))
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human Neu3 expressed in HEK293T cells using GM3 as substrate incubated for 30 mins by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSialidase-4(Homo sapiens (Human))
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human Neu4 expressed in HEK293T cells using 4MU-Neu5Ac as substrate incubated for 30 mins by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSialidase-4(Homo sapiens (Human))
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human Neu4 expressed in HEK293T cells using GM3 as substrate incubated for 30 mins by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  8.70nMAssay Description:Inhibition of Influenza A virus (A/duck/Tsukuba/67/2005(H1N1)) neuraminidase N1 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins follo...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  11nMAssay Description:Inhibition of Influenza A virus (A/mallard/Hokkaido/24/2009(H5N1)) neuraminidase N1 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins f...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  2.40nMAssay Description:Inhibition of Influenza A virus (A/duck/Tsukuba/28/2005(H6N2)) neuraminidase N2 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins follo...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  6.90nMAssay Description:Inhibition of Influenza A virus (A/duck/Tsukuba/394/2005(H5N3)) neuraminidase N3 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins foll...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  5.70nMAssay Description:Inhibition of Influenza A virus (A/duck/Tsukuba/20/2007(H8N4)) neuraminidase N4 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins follo...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  4.5nMAssay Description:Inhibition of Influenza A virus A/duck/Chiba/13/06(H12N5) neuraminidase N5 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins followed b...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  11nMAssay Description:Inhibition of Influenza A virus (A/duck/Shiga/8/2004(H4N6)) neuraminidase N6 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins followed...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  5.70nMAssay Description:Inhibition of Influenza A virus (A/duck/Tsukuba/700/2007(H7N7)) neuraminidase N7 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins foll...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  46nMAssay Description:Inhibition of Influenza A virus (A/duck/Tsukuba/28/2006(H3N8)) neuraminidase N8 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins follo...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  33nMAssay Description:Inhibition of Influenza A virus A/duck/Tsukuba/441/05(H11N9) neuraminidase N9 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins followe...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  14nMAssay Description:Inhibition of Influenza A virus (A/California/04/2009(H1N1)) neuraminidase N1 V149I mutant activity using 4MU-Neu5Ac as substrate preincubated for 15...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  29nMAssay Description:Inhibition of Influenza A virus (A/Narita/1/2009(H1N1)) neuraminidase N1 V149I mutant activity using 4MU-Neu5Ac as substrate preincubated for 15 mins...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  14nMAssay Description:Inhibition of Influenza A virus A/Yamaguchi/20/06(H1N1) neuraminidase N1 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins followed by ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  94nMAssay Description:Inhibition of Influenza A virus A/Kitakyushu/10/06(H1N1) neuraminidase N1 H274Y mutant activity using 4MU-Neu5Ac as substrate preincubated for 15 min...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuraminidase(Influenza A virus)
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50:  14nMAssay Description:Inhibition of Influenza A virus (A/Aichi/75/2008(H3N2)) neuraminidase N2 activity using 4MU-Neu5Ac as substrate preincubated for 15 mins followed by ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSialidase-2(Homo sapiens (Human))
Thammasat University

Curated by ChEMBL
LigandPNGBDBM50182248(CHEMBL3818654)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human Neu2 expressed in HEK293T cells using 4MU-Neu5Ac as substrate incubated for 30 mins by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed