BDBM45549 (E)-3-(2-furanyl)-2-propenoic acid [2-(3-nitroanilino)-2-oxoethyl] ester::(E)-3-(2-furyl)acrylic acid [2-keto-2-(3-nitroanilino)ethyl] ester::MLS000390820::SMR000259858::[2-(3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate::[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(furan-2-yl)prop-2-enoate::cid_2347806

SMILES [O-][N+](=O)c1cccc(NC(=O)COC(=O)\C=C\c2ccco2)c1

InChI Key InChIKey=VAZOCERXUAXWJG-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 45549   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45549BDBM45549([2-(3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)...)
Affinity DataIC50: 5.00E+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
TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45549BDBM45549([2-(3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)...)
Affinity DataIC50: 5.00E+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:
6/8/2011
Entry Details
PCBioAssay