BDBM45298 1-(2-furanylmethyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-[4-[2-furanyl(oxo)methoxy]phenyl]-2-oxoethyl] ester::1-(2-furfuryl)-5-keto-pyrrolidine-3-carboxylic acid [2-[4-(2-furoyloxy)phenyl]-2-keto-ethyl] ester::1-Furan-2-ylmethyl-5-oxo-pyrrolidine-3-carboxylic acid 2-[4-(furan-2-carbonyloxy)-phenyl]-2-oxo-ethyl ester::MLS000076430::SMR000015232::[2-[4-(furan-2-carbonyloxy)phenyl]-2-oxoethyl] 1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate::[2-[4-(furan-2-ylcarbonyloxy)phenyl]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxylate::cid_648230

SMILES O=C(OCC(=O)c1ccc(OC(=O)c2ccco2)cc1)C1CN(Cc2ccco2)C(=O)C1

InChI Key InChIKey=DOOUQJWJCXODNY-UHFFFAOYSA-N

Data  1 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 3 hits for monomerid = 45298   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45298(SMR000015232 | MLS000076430 | 1-(2-furanylmethyl)-...)
Affinity DataIC50: 1.33E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay
TargetProtein RecA(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM45298(SMR000015232 | MLS000076430 | 1-(2-furanylmethyl)-...)
Affinity DataEC50: >3.80E+5nMAssay 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
TargetProtein RecA(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM45298(SMR000015232 | MLS000076430 | 1-(2-furanylmethyl)-...)
Affinity DataEC50:  1.80E+4nMAssay 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