BDBM50052739 (2R,3R,4R,5R,6R,7R)-3,6-Bis-(3-amino-benzyloxy)-2,7-dibenzyl-1,1-dioxo-1lambda*6*-thiepane-4,5-diol::CHEMBL324071

SMILES Nc1cccc(CO[C@@H]2[C@H](O)[C@@H](O)[C@@H](OCc3cccc(N)c3)[C@@H](Cc3ccccc3)S(=O)(=O)[C@@H]2Cc2ccccc2)c1

InChI Key InChIKey=JFKIHXVQWVFSNI-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50052739   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Gilead Sciences

Curated by ChEMBL
LigandPNGBDBM50052739((2R,3R,4R,5R,6R,7R)-3,6-Bis-(3-amino-benzyloxy)-2,...)
Affinity DataIC50: 1nMAssay Description:Concentration needed to inhibit HIV- protease activity by 50%.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed