BDBM71649 2-Amino-7,7-dimethyl-5-oxo-4-phenylethynyl-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile::2-amino-5-keto-7,7-dimethyl-4-(2-phenylethynyl)-6,8-dihydro-4H-chromene-3-carbonitrile::2-amino-7,7-dimethyl-5-oxo-4-(2-phenylethynyl)-6,8-dihydro-4H-1-benzopyran-3-carbonitrile::2-amino-7,7-dimethyl-5-oxo-4-(2-phenylethynyl)-6,8-dihydro-4H-chromene-3-carbonitrile::2-azanyl-7,7-dimethyl-5-oxidanylidene-4-(2-phenylethynyl)-6,8-dihydro-4H-chromene-3-carbonitrile::MLS000033619::SMR000013816::cid_651376

SMILES CC1(C)CC(=O)C2=C(C1)OC(=N)C(C#N)C2C#Cc1ccccc1

InChI Key InChIKey=OGWSXENZOIBOGG-UHFFFAOYSA-N

Data  1 EC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 71649   

TargetHeat shock factor protein 1(Mouse)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM71649(SMR000013816 | MLS000033619 | 2-Amino-7,7-dimethyl...)
Affinity DataEC50:  3.83E+4nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay