BDBM50355116 CHEMBL493923::US10278929, Compound 22::US11337935, Compound 22

SMILES Oc1ccccc1C1NC(=O)C(C#N)=C(SCc2ccccc2)S1

InChI Key InChIKey=CBPDTXHHGBVEIJ-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 50355116   

TargetTransthyretin(Homo sapiens (Human))
The Board Of Trustees Of The Leland Stanford Junior University

US Patent
LigandPNGBDBM50355116(CHEMBL493923 | US10278929, Compound 22 | US1133793...)
Affinity DataIC50:  4.79E+3nMAssay Description:The FP assay was then adapted for HTS and used to screen ~120,000 small molecule library for compounds that displaced probe 5 from the T4 binding of ...More data for this Ligand-Target Pair
In DepthDetails US Patent
Target4-diphosphocytidyl-2-C-methyl-D-erythritol kinase(Yersinia pestis)
University Of Utah

Curated by ChEMBL
LigandPNGBDBM50355116(CHEMBL493923 | US10278929, Compound 22 | US1133793...)
Affinity DataIC50:  9.00E+3nMAssay Description:Inhibition of His6-tagged Yersinia pestis KIM6 CDP-ME kinase assessed as ADP production after 30 mins by Kinase Glo luminescence-based assay or stand...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetTransthyretin(Homo sapiens (Human))
The Board Of Trustees Of The Leland Stanford Junior University

US Patent
LigandPNGBDBM50355116(CHEMBL493923 | US10278929, Compound 22 | US1133793...)
Affinity DataIC50:  4.79E+3nMAssay Description:Table 3: The FP assay was then adapted for HTS and used to screen 120,000 small molecule library for compounds that displaced probe 5 from the T4 bin...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetTransthyretin(Homo sapiens (Human))
The Board Of Trustees Of The Leland Stanford Junior University

US Patent
LigandPNGBDBM50355116(CHEMBL493923 | US10278929, Compound 22 | US1133793...)
Affinity DataIC50:  4.79E+3nMAssay Description:The FP assay was then adapted for HTS and used to screen a ˜120,000 member small molecule library for compounds that displaced the FP probe from the ...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetGalactokinase(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50355116(CHEMBL493923 | US10278929, Compound 22 | US1133793...)
Affinity DataIC50:  1.20E+4nMAssay Description:Inhibition of human galactokinase after 30 mins by Kinase-GloTM assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed