BDBM47498 2-(2-formyl-1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile::2-(2-formylpyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile::2-(2-formylpyrrol-1-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile::2-(2-methanoylpyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile::MLS000717132::SMR000280099::cid_2063413

SMILES O=Cc1cccn1-c1sc2CCCCc2c1C#N

InChI Key InChIKey=WMVXDJRDVGEDTF-UHFFFAOYSA-N

Data  1 IC50  1 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 2 hits for monomerid = 47498   

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

Curated by PubChem BioAssay
LigandPNGBDBM47498(2-(2-methanoylpyrrol-1-yl)-4,5,6,7-tetrahydro-1-be...)
Affinity DataEC50: >4.98E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2011
Entry Details
PCBioAssay
TargetMitochondrial peptide methionine sulfoxide reductase(Bovine)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM47498(2-(2-methanoylpyrrol-1-yl)-4,5,6,7-tetrahydro-1-be...)
Affinity DataIC50: 1.55E+5nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay