BDBM56072 2,6-dimethyl-4-oxopyran-3,5-dicarboxylic acid dimethyl ester::4-keto-2,6-dimethyl-pyran-3,5-dicarboxylic acid dimethyl ester::MLS000043723::SMR000020735::cid_957562::dimethyl 2,6-dimethyl-4-oxidanylidene-pyran-3,5-dicarboxylate::dimethyl 2,6-dimethyl-4-oxo-4H-pyran-3,5-dicarboxylate::dimethyl 2,6-dimethyl-4-oxopyran-3,5-dicarboxylate

SMILES COC(=O)c1c(C)oc(C)c(C(=O)OC)c1=O

InChI Key InChIKey=MRBGYAHOMCAKSH-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 56072   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM56072(dimethyl 2,6-dimethyl-4-oxopyran-3,5-dicarboxylate...)
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