BDBM50275658 (S)-2-((R)-3-(hexanoyloxy)tetradecanamido)-3-((2R,3R,4R,5S,6R)-3-((R)-3-(hexanoyloxy)tetradecanamido)-4-((R)-3-(hexanoyloxy)tetradecanoyloxy)-6-(hydroxymethyl)-5-(phosphonooxy)tetrahydro-2H-pyran-2-yloxy)propanoic acid::CHEMBL505526

SMILES CCCCCCCCCCC[C@H](CC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H](OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCC)[C@H]1NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCC)C(O)=O)OC(=O)CCCCC

InChI Key InChIKey=PRIXXGNJDNLMBH-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 50275658   

TargetToll-like receptor 4(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50275658((S)-2-((R)-3-(hexanoyloxy)tetradecanamido)-3-((2R,...)
Affinity DataIC50: 2.40nMAssay Description:Antagonist activity at TLR4 in human PBMC assessed as inhibition of LPS-stimulated TNFalpha production pre-incubated for 30 mins before LPS challenge...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed