BDBM2198 (3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-isopropyl-6-phenethyl-5,6-dihydro-pyran-2-one::3-[(2-tert-butyl-5-methylphenyl)sulfanyl]-4-hydroxy-6-(2-phenylethyl)-6-(propan-2-yl)-5,6-dihydro-2H-pyran-2-one::CHEMBL372040::PD 178390 Analog 37

SMILES CC(C)C1(CCc2ccccc2)CC(=O)C(Sc2cc(C)ccc2C(C)(C)C)C(=O)O1

InChI Key InChIKey=FPODAFKDQIBIAN-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  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 = 2198   

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

LigandPNGBDBM2198((3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydrox...)
Affinity DataIC50:  1.10nMAssay 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 DepthDetails ArticlePubMed
TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Peking University

Curated by ChEMBL
LigandPNGBDBM2198((3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydrox...)
Affinity DataEC50:  1.50E+4nMAssay Description:Effective concentration required to inhibit human immunodeficiency virus 1 protease in MT-4 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Peking University

Curated by ChEMBL
LigandPNGBDBM2198((3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydrox...)
Affinity DataIC50:  1.10nMAssay Description:Inhibitory concentration against human immunodeficiency virus 1 protease in MT-4 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed