BDBM50189988 CHEMBL214101::Rofecoxib analogue

SMILES O=C1OCC(=C1c1ccccc1)c1ccc(cc1)-c1nnn[nH]1

InChI Key InChIKey=YIBBBUDMCSMNAO-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50189988   

TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
Tehran University Of Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50189988(CHEMBL214101 | Rofecoxib analogue)
Affinity DataIC50:  1.80nMAssay Description:Inhibition of COX2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
Tehran University Of Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50189988(CHEMBL214101 | Rofecoxib analogue)
Affinity DataIC50:  3.80nMAssay Description:Inhibition of COX1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed