BDBM50067553 CHEMBL133134::N-Methyl-3-[(R)-2-(2-tetradecyl-hexadecanoylamino)-3-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-propionylamino]-succinamic acid

SMILES CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)N[C@H](COC1OC(C)C(O)C(O)C1O)C(=O)NC(CC(O)=O)C(=O)NC

InChI Key InChIKey=DVACAGDTEQQYSM-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50067553   

TargetP-selectin(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50067553(N-Methyl-3-[(R)-2-(2-tetradecyl-hexadecanoylamino)...)
Affinity DataIC50: 3.60E+3nMAssay Description:Inhibition of Selectin P bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed
TargetL-selectin(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50067553(N-Methyl-3-[(R)-2-(2-tetradecyl-hexadecanoylamino)...)
Affinity DataIC50: 3.80E+3nMAssay Description:Inhibition of Selectin L bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed
TargetE-selectin(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50067553(N-Methyl-3-[(R)-2-(2-tetradecyl-hexadecanoylamino)...)
Affinity DataIC50: 5.00E+5nMAssay Description:Displacement of sialyl Lewis X (sLex) from selectin EMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed