BDBM463 5-tert-butyl-4-{[4-hydroxy-2-oxo-6-(2-phenylethyl)-6-(propan-2-yl)-5,6-dihydro-2H-pyran-3-yl]sulfanyl}-2-methylphenyl N-ethylsulfamate::6-Alkyl-5,6-Dihydropyran-2-one 32::CHEMBL67867::Dihydropyran-2-one deriv. 68

SMILES CCNS(=O)(=O)Oc1cc(c(SC2C(=O)CC(CCc3ccccc3)(OC2=O)C(C)C)cc1C)C(C)(C)C

InChI Key InChIKey=IEYXIHIOKLKWDH-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 463   

TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Parke-Davis Pharmaceutical Research

LigandPNGBDBM463(CHEMBL67867 | 6-Alkyl-5,6-Dihydropyran-2-one 32 | ...)
Affinity DataIC50: 8.90nMpH: 6.2 T: 2°CAssay Description:For determination of IC50 values, HIV-1 protease was added to assay buffer containing inhibitor and the substrate (H-His-Lys-Ala-Arg-Val-Leu- (p-NO2)...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2004
Entry Details Article
PubMed
TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Parke-Davis Pharmaceutical Research

LigandPNGBDBM463(CHEMBL67867 | 6-Alkyl-5,6-Dihydropyran-2-one 32 | ...)
Affinity DataIC50: 8.90nMAssay Description:Sensitivity of HIV-1 protease activity to protease inhibitors was determined by a peptide substrate cleavage assay. Protease products were analyzed o...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2004
Entry Details Article
PubMed
TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Parke-Davis Pharmaceutical Research

LigandPNGBDBM463(CHEMBL67867 | 6-Alkyl-5,6-Dihydropyran-2-one 32 | ...)
Affinity DataIC50: 8.90nMAssay Description:Sensitivity of HIV-1 protease activity to protease inhibitors was determined by a peptide substrate cleavage assay. Protease products were analyzed o...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2004
Entry Details Article
PubMed