BDBM50322761 CHEMBL1171258::clematernoside C

SMILES COc1ccc(\C=C\C(=O)O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3CO[C@@H](O[C@@H]4[C@@H](O)[C@H](C)O[C@@H](O[C@@H]5[C@@H](O)[C@@H](O)CO[C@H]5O[C@H]5CC[C@@]6(C)[C@@H](CC[C@]7(C)[C@@H]6CC=C6[C@@H]8CC(C)(C)CC[C@@]8(CC[C@@]76C)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)C5(C)C)[C@@H]4O)[C@H](O)[C@@H]3O)[C@H](O)[C@H]2O)cc1O

InChI Key InChIKey=LMPGKAHRTFPCEF-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50322761   

TargetProstaglandin G/H synthase 1(Human)
Peking University Health Science Center

Curated by ChEMBL
LigandPNGBDBM50322761(clematernoside C | CHEMBL1171258)
Affinity DataIC50: 7.60E+3nMAssay Description:Inhibition of COX1 by microplate readerMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2010
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Human)
Peking University Health Science Center

Curated by ChEMBL
LigandPNGBDBM50322761(clematernoside C | CHEMBL1171258)
Affinity DataIC50: 8.80E+3nMAssay Description:Inhibition of COX2 by microplate readerMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2010
Entry Details Article
PubMed