BDBM50137078 2-[4-benzyloxy-1-isobutoxymethyl-5a,9a-dimethoxy-(5aS,9aR)-perhydrobenzo[b]pyrano[3,4-e][1,4]dioxin-3-yloxy]acetic acid::CHEMBL2374235

SMILES [H][C@]12O[C@]3(CCCC[C@@]3(OC)OC1[C@H](COCC(C)C)O[C@@H](OCC(O)=O)[C@@H]2OCc1ccccc1)OC

InChI Key InChIKey=QEHUKKQTQIYBMJ-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 = 50137078   

TargetIntegrin beta-7(Human)
Technische UniversitäT MüNchen

Curated by ChEMBL
LigandPNGBDBM50137078(2-[4-benzyloxy-1-isobutoxymethyl-5a,9a-dimethoxy-(...)
Affinity DataIC50: 4.20E+5nMAssay Description:Inhibition of alpha4-beta7 interaction to mucosal addressin cell adhesion molecule-1 (MAdCAM-1) was determinedMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed