BDBM32253 2-[(5-amino-7-keto-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]acetonitrile::2-[(5-amino-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetonitrile::2-[(5-amino-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)thio]acetonitrile::2-[(5-azanyl-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]ethanenitrile::BAS_05347024::cid_1588020

SMILES Nc1cc(=O)[nH]c2nnc(SCC#N)n12

InChI Key InChIKey=UPTCPLAJBGGGDV-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 32253   

TargetHeat shock protein HSP 90-alpha(Human)
Emory University

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32253BDBM32253(2-[(5-amino-7-oxo-1H-[1,2,4]triazolo[4,3-a]pyrimid...)
Affinity DataIC50: 5.00E+4nMpH: 7.4 T: 2°CAssay Description:A fluorescence polarization based HTS assay has been developed and optimized for the identification of Hsp90 inhibitors by using tumor cell lysate Hs...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/9/2009
Entry Details
PCBioAssay