BDBM34379 2-amino-7-keto-8,10-dimethyl-4-[4-(methylthio)phenyl]-4H-furo[1,2]cyclohepta[4,6-d]pyran-3-carbonitrile::2-amino-8,10-dimethyl-4-(4-methylsulfanylphenyl)-7-oxo-4H-furo[1,2]cyclohepta[4,6-d]pyran-3-carbonitrile::2-amino-8,10-dimethyl-4-[4-(methylthio)phenyl]-7-oxo-4H,7H-furo[3',4':6,7]cyclohepta[1,2-b]pyran-3-carbonitrile::2-amino-8,10-dimethyl-4-[4-(methylthio)phenyl]-7-oxo-4H-furo[1,2]cyclohepta[4,6-d]pyran-3-carbonitrile::2-azanyl-8,10-dimethyl-4-(4-methylsulfanylphenyl)-7-oxidanylidene-4H-furo[1,2]cyclohepta[4,6-d]pyran-3-carbonitrile::MLS000085593::SMR000020528::cid_3241124

SMILES CSc1ccc(cc1)C1C(C#N)C(=N)Oc2c1ccc(=O)c1c(C)oc(C)c21

InChI Key InChIKey=MYKZHYZSKHWMEO-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 = 34379   

TargetGag-Pol polyprotein(HIV-1)
University of Pittsburgh

Curated by PubChem BioAssay
LigandPNGBDBM34379(2-amino-8,10-dimethyl-4-(4-methylsulfanylphenyl)-7...)
Affinity DataIC50: 5.81E+3nMpH: 8.0 T: 2°CAssay Description:A fluorescence resonance energy transfer assay is developed in 96-well and 384-well microplate formats with robotic manipulation to enable high-throu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/24/2009
Entry Details
PCBioAssay
TargetEstrogen receptor beta(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM34379(2-amino-8,10-dimethyl-4-(4-methylsulfanylphenyl)-7...)
Affinity DataIC50: 5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
TargetEstrogen receptor(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM34379(2-amino-8,10-dimethyl-4-(4-methylsulfanylphenyl)-7...)
Affinity DataIC50: 5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2011
Entry Details
PCBioAssay