BDBM70386 2-cyano-3-(3-keto-5-methyl-3-pyrazolin-4-yl)-3-(3-pyridyl)propionic acid methyl ester::2-cyano-3-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-3-(3-pyridinyl)propanoic acid methyl ester::MLS000050718::SMR000078194::cid_2962035::methyl 2-cyano-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-3-(3-pyridinyl)propanoate::methyl 2-cyano-3-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-3-pyridin-3-yl-propanoate::methyl 2-cyano-3-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-3-pyridin-3-ylpropanoate

SMILES COC(=O)C(C#N)C(c1c(C)[nH][nH]c1=O)c1cccnc1

InChI Key InChIKey=GNECYJJIQOMFRE-UHFFFAOYSA-N

Data  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 2 hits for monomerid = 70386   

TargetProtein RecA(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM70386(methyl 2-cyano-3-(3-hydroxy-5-methyl-1H-pyrazol-4-...)
Affinity DataEC50:  1.20E+3nMAssay Description:Keywords: GFP-RecA intein, protein splicing, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, whi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay
TargetProtein RecA(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM70386(methyl 2-cyano-3-(3-hydroxy-5-methyl-1H-pyrazol-4-...)
Affinity DataEC50:  7.80E+3nMAssay Description:Keywords: GFP, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, which interrupt the DnaB, RecA, a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay