BDBM50580671 CHEMBL5083166

SMILES CC1(C)CC(=O)C2=C(C1)NC1=C(C2c2ccc(Br)cc2)C(=O)c2ccccc12

InChI Key InChIKey=KQWHDJSPWCHABU-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50580671   

TargetBis(5'-adenosyl)-triphosphatase(Homo sapiens (Human))
Nagoya City University

Curated by ChEMBL
LigandPNGBDBM50580671(CHEMBL5083166)
Affinity DataIC50:  8.80E+3nMAssay Description:Inhibition of recombinant human FHIT incubated for 1hr in presence of tokyogreen-labeled CMP probe by fluorescence based analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetBis(5'-adenosyl)-triphosphatase(Homo sapiens (Human))
Nagoya City University

Curated by ChEMBL
LigandPNGBDBM50580671(CHEMBL5083166)
Affinity DataIC50:  49nMAssay Description:Inhibition of human FHIT expressed in Escherichia coli BL21(DE3)-RIL cells using AP3A as substrate pretreated for 10 mins followed by substrate addit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetBis(5'-adenosyl)-triphosphatase(Homo sapiens (Human))
Nagoya City University

Curated by ChEMBL
LigandPNGBDBM50580671(CHEMBL5083166)
Affinity DataIC50:  2.30E+4nMAssay Description:Inhibition of recombinant human FHIT assessed as reduction in AP3Aase activity measured after 45 mins by HPLC analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed