BDBM50344973 2-((3R,5S)-7-chloro-5-(2,3-dimethoxyphenyl)-1-(3-hydroxy-2,2-dimethylpropyl)-2-oxo-1,2,3,5-tetrahydrobenzo[e][1,4]oxazepin-3-yl)acetic acid::CHEMBL1778455

SMILES COc1cccc([C@H]2O[C@H](CC(O)=O)C(=O)N(CC(C)(C)CO)c3ccc(Cl)cc23)c1OC

InChI Key InChIKey=JIGKRELXCKTDLL-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 = 50344973   

TargetSqualene synthase(Human)
Bayer Pharma

Curated by ChEMBL
LigandPNGBDBM50344973(2-((3R,5S)-7-chloro-5-(2,3-dimethoxyphenyl)-1-(3-h...)
Affinity DataIC50: 223nMAssay Description:Inhibition of recombinant squalene synthase assessed as conversion of trans,trans-[1-3H]farnesyl pyrophosphate to [3H]squalene after 10 mins by liqui...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2011
Entry Details Article
PubMed