BDBM63499 2-[4-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-fluorobenzyl]-1-(3-methylbut-2-en-1-yl)piperazin-2-yl]ethanol::2-[4-[2-(3,5-dimethylpyrazol-1-yl)-5-fluoro-benzyl]-1-(3-methylbut-2-enyl)piperazin-2-yl]ethanol::2-[4-[[2-(3,5-dimethyl-1-pyrazolyl)-5-fluorophenyl]methyl]-1-(3-methylbut-2-enyl)-2-piperazinyl]ethanol::2-[4-[[2-(3,5-dimethylpyrazol-1-yl)-5-fluoranyl-phenyl]methyl]-1-(3-methylbut-2-enyl)piperazin-2-yl]ethanol::2-[4-[[2-(3,5-dimethylpyrazol-1-yl)-5-fluorophenyl]methyl]-1-(3-methylbut-2-enyl)piperazin-2-yl]ethanol::MLS000733967::SMR000317126::cid_16191785

SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-c2cc(F)ccc2-n2nc(-[#6])cc2-[#6])-[#6]-[#6]-1-[#6]-[#6]-[#8]

InChI Key InChIKey=QPVYHCUMXUTEIY-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 63499   

TargetHeat shock factor protein 1(Mouse)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM63499(cid_16191785 | 2-[4-[[2-(3,5-dimethyl-1-pyrazolyl)...)
Affinity DataEC50: >1.95E+5nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/10/2011
Entry Details
PCBioAssay