BDBM50100939 3-[(2S,3S,3aR,4aS,6aR,7R,9aS,9bS)-7-((R)-1,5-Dimethyl-hex-4-enyl)-2-hydroxy-6a,9a-dimethyl-3-vinyl-decahydro-cyclopenta[a]cyclopropa[e]naphthalen-3a-yl]-propionic acid::CHEMBL39521

SMILES [#6]-[#6@H](-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H]3-[#6]-[#6@H](-[#8])-[#6@@H](-[#6]=[#6])[C@@]4([#6]-[#6]-[#6](-[#8])=O)[#6][C@@]34[#6]-[#6][C@]12[#6]

InChI Key InChIKey=CLDLKHAPCFFHNJ-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50100939   

TargetProstaglandin G/H synthase 1(Human)
University of Illinois At Chicago

Curated by ChEMBL
LigandPNGBDBM50100939(3-[(2S,3S,3aR,4aS,6aR,7R,9aS,9bS)-7-((R)-1,5-Dimet...)
Affinity DataIC50: 4.37E+4nMAssay Description:Inhibitory concentration against Prostaglandin G/H synthase 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Human)
University of Illinois At Chicago

Curated by ChEMBL
LigandPNGBDBM50100939(3-[(2S,3S,3aR,4aS,6aR,7R,9aS,9bS)-7-((R)-1,5-Dimet...)
Affinity DataIC50: 4.70E+3nMAssay Description:Inhibitory concentration against Prostaglandin G/H synthase 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed