BDBM50399288 CHEMBL2180830::US9102622, 13.1

SMILES FS(=O)(=O)CCCCCCCc1ccc(OCc2ccccc2)cc1

InChI Key InChIKey=LDYCDYVYRFNQEB-UHFFFAOYSA-N

Data  1 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50399288   

TargetFatty-acid amide hydrolase 1 [30-579](Rat)
University of Connecticut

US Patent
LigandPNGBDBM50399288(CHEMBL2180830 | US9102622, 13.1)
Affinity DataKi:  39nM ΔG°:  -10.5kcal/mole IC50: 168nMT: 2°CAssay Description:All compound solutions are made to a concentration of 10 mM in DMSO. To test the stability of the compounds in enzyme assay conditions, 25 nmoles of ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/4/2016
Entry Details
US Patent

TargetMonoglyceride lipase(Human)
Northeastern University

Curated by ChEMBL
LigandPNGBDBM50399288(CHEMBL2180830 | US9102622, 13.1)
Affinity DataIC50: 249nMAssay Description:Inhibition of recombinant human hexahistidine-tagged MGL expressed in Escherichia coli using AHMMCE as substrate after 15 mins by medium throughput f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed