BDBM50241033 CHEMBL414311::N-[(1R)-2-{[(2R)-2-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-5-amino-1-{[(1S)-5-amino-1-{[(1S)-5-amino-1-carbamoylpentyl]carbamoyl}pentyl]carbamoyl}pentyl]carbamoyl}pentyl]carbamoyl}-2-hydroxyethyl]carbamoyl}-2-tetradecanamidoethyl]sulfanyl}-1-(octylcarbamoyl)ethyl]tetradecanamide

SMILES CCCCCCCCCCCCCC(=O)N[C@@H](CSC[C@H](NC(=O)CCCCCCCCCCCCC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O)C(=O)NCCCCCCCC

InChI Key InChIKey=QTSBRADNRQVFRV-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 = 50241033   

TargetToll-like receptor 2(Human)
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50241033(N-[(1R)-2-{[(2R)-2-{[(1S)-1-{[(1S)-5-amino-1-{[(1S...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of TLR2-mediated IL8 secretion in human THP1 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed