BDBM41600 3-(3-nitrophenyl)-1-phenyl-2-propyn-1-one::3-(3-nitrophenyl)-1-phenyl-prop-2-yn-1-one::3-(3-nitrophenyl)-1-phenylprop-2-yn-1-one::MLS000532224::SMR000137164::cid_1211724

SMILES [O-][N+](=O)c1cccc(c1)C#CC(=O)c1ccccc1

InChI Key InChIKey=PPFBVVKWYQVYKJ-UHFFFAOYSA-N

Data  3 IC50  2 EC50

  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 5 hits for monomerid = 41600   

TargetSphingosine 1-phosphate receptor 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41600(3-(3-nitrophenyl)-1-phenylprop-2-yn-1-one | 3-(3-n...)
Affinity DataIC50: 3.69E+3nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/12/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41600(3-(3-nitrophenyl)-1-phenylprop-2-yn-1-one | 3-(3-n...)
Affinity DataIC50: 2.27E+3nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetKappa-type opioid receptor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM41600(3-(3-nitrophenyl)-1-phenylprop-2-yn-1-one | 3-(3-n...)
Affinity DataIC50: 2.28E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2011
Entry Details
PCBioAssay
TargetGeneral amino acid permease AGP1(Baker's yeast)
Nmmlsc

Curated by PubChem BioAssay
LigandPNGBDBM41600(3-(3-nitrophenyl)-1-phenylprop-2-yn-1-one | 3-(3-n...)
Affinity DataEC50:  305nMAssay Description:University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2011
Entry Details
PCBioAssay
TargetHeat shock factor protein 1(Mouse)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM41600(3-(3-nitrophenyl)-1-phenylprop-2-yn-1-one | 3-(3-n...)
Affinity DataEC50:  1.09E+3nMAssay 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