BDBM83496 3-[4-(1-azepanylsulfonyl)anilino]-2-(2-pyridinyl)-3H-isoindol-1-one::3-[4-(azepan-1-ylsulfonyl)anilino]-2-(2-pyridyl)isoindolin-1-one::3-[4-(azepan-1-ylsulfonyl)anilino]-2-pyridin-2-yl-3H-isoindol-1-one::3-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-2-pyridin-2-yl-3H-isoindol-1-one::MLS000522898::SMR000128164::cid_9550095

SMILES O=C1N(C(Nc2ccc(cc2)S(=O)(=O)N2CCCCCC2)c2ccccc12)c1ccccn1

InChI Key InChIKey=GXDUOTNAHXTHLZ-UHFFFAOYSA-N

Data  3 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 83496   

TargetEndoribonuclease toxin MazF(Escherichia coli (strain K12))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83496(SMR000128164 | 3-[4-(azepan-1-ylsulfonyl)anilino]-...)
Affinity DataEC50:  1.61E+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:
1/5/2012
Entry Details
PCBioAssay
TargetEndoribonuclease toxin MazF(Escherichia coli (strain K12))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83496(SMR000128164 | 3-[4-(azepan-1-ylsulfonyl)anilino]-...)
Affinity DataEC50:  1.93E+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:
1/6/2012
Entry Details
PCBioAssay
TargetEndoribonuclease toxin MazF(Escherichia coli (strain K12))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83496(SMR000128164 | 3-[4-(azepan-1-ylsulfonyl)anilino]-...)
Affinity DataEC50: >9.90E+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:
1/5/2012
Entry Details
PCBioAssay