BDBM50269603 CHEMBL502059::cyclotheonamide E5

SMILES [#6]-[#6]-[#6](-[#6])-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@H]-1-[#6]-[#7]-[#6](=O)\[#6]=[#6]\[#6@H](-[#6]-c2ccc(-[#8])c(-[#8])c2)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6]-1=O)-[#6@H](-[#6])-[#6]-[#6]

InChI Key InChIKey=RHQXVVQZUARMLP-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50269603   

TargetProthrombin(Human)
Kirin Brewery

Curated by ChEMBL
LigandPNGBDBM50269603(cyclotheonamide E5 | CHEMBL502059)
Affinity DataIC50: 67.9nMAssay Description:Inhibition of human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed