BDBM50178816 ((1S)-1-{N'-Benzyl-N'-[(2S)-2-hydroxy-2-((1S,2R)-2-hydroxy-indan-1-ylcarbamoyl)-3-phenyl-propyl]-hydrazinocarbonyl}-2,2-dimethyl-propyl)-carbamic acid methyl ester::(1R,2R)-1-((3S,8S)-3,5-dibenzyl-8-tert-butyl-3-methyl-2,7,10-trimethylenedodecyl)-2-methyl-2,3-dihydro-1H-indene::CHEMBL436755::Methyl(S)-1-(benzyl((S)-2-benzyl-2-hydroxy-3-((1S,2R)-2-hydroxy-2,3-dihydro-1Hinden-1-ylamino)-3-oxopropyl)amino)-3,3-dimethyl-1-oxobutan-2-ylcarbamate

SMILES COC(=O)N[C@H](C(=O)NN(Cc1ccccc1)C[C@@](O)(Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(C)(C)C

InChI Key InChIKey=XSDFQERHLPEHEB-UHFFFAOYSA-N

Data  2 KI

  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 2 hits for monomerid = 50178816   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Uppsala University

Curated by ChEMBL
LigandPNGBDBM50178816((1R,2R)-1-((3S,8S)-3,5-dibenzyl-8-tert-butyl-3-met...)
Affinity DataKi:  6nMAssay Description:Inhibitory activity against HIV1 protease expressed in Escherichia coli in a fluorometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProtease(Human immunodeficiency virus type 1)
Uppsala University

Curated by ChEMBL
LigandPNGBDBM50178816((1R,2R)-1-((3S,8S)-3,5-dibenzyl-8-tert-butyl-3-met...)
Affinity DataKi: >5.00E+3nMAssay Description:Inhibition of HIV1 protease expressed in Escherichia coli by fluorometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2020
Entry Details Article
PubMed