BDBM50394675 PURPURONE

SMILES Oc1ccc(CCn2c3=C(C(=O)c4cc(O)c(O)cc4-c3c3-c4cc(O)c(O)cc4C(=O)C(c4ccc(O)c(O)c4)=c23)c2ccc(O)c(O)c2)cc1

InChI Key InChIKey=USHRRYVVGLGHAL-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50394675   

TargetATP-citrate synthase(Homo sapiens (Human))
University Of Pisa

Curated by ChEMBL
LigandPNGBDBM50394675(PURPURONE)
Affinity DataIC50:  7.00E+3nMAssay Description:Inhibition of ACLY (unknown origin)More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetATP-citrate synthase(Rattus norvegicus)
Wayne State University

Curated by ChEMBL
LigandPNGBDBM50394675(PURPURONE)
Affinity DataIC50:  7.00E+3nMAssay Description:Inhibition of rat liver ACLYMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed