BDBM56276 2-[(3,3-dimethyl-5-oxidanylidene-cyclohexylidene)amino]ethanoic acid::2-[(3,3-dimethyl-5-oxocyclohexylidene)amino]acetic acid::2-[(5-keto-3,3-dimethyl-cyclohexylidene)amino]acetic acid::MLS000106973::SMR000111348::cid_676799

SMILES CC1(C)CC(=O)C=C(C1)NCC(O)=O

InChI Key InChIKey=MKILHWOJDFVJNQ-UHFFFAOYSA-N

Data  1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 56276   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM56276(2-[(3,3-dimethyl-5-oxocyclohexylidene)amino]acetic...)
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