BDBM50056877 6-(2,4-Dihydroxy-phenyl)-6-oxo-hexanoic acid 2-hydroxy-ethyl ester::CHEMBL172756::NSC-49858

SMILES OCCOC(=O)CCCCC(=O)c1ccc(O)cc1O

InChI Key InChIKey=RSLGVIMRGJWJHL-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50056877   

TargetIntegrase(Human immunodeficiency virus type 1)
National Cancer Institute-Bethesda

Curated by ChEMBL
LigandPNGBDBM50056877(6-(2,4-Dihydroxy-phenyl)-6-oxo-hexanoic acid 2-hyd...)
Affinity DataIC50: 1.85E+5nMAssay Description:Inhibitory concentration against purified recombinant integrase by strand transfer in vitro assay (experiment 1)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrase(Human immunodeficiency virus type 1)
National Cancer Institute-Bethesda

Curated by ChEMBL
LigandPNGBDBM50056877(6-(2,4-Dihydroxy-phenyl)-6-oxo-hexanoic acid 2-hyd...)
Affinity DataIC50: 2.33E+5nMAssay Description:Inhibitory concentration against purified recombinant integrase by strand transfer in vitro assay (experiment 2)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrase(Human immunodeficiency virus type 1)
National Cancer Institute-Bethesda

Curated by ChEMBL
LigandPNGBDBM50056877(6-(2,4-Dihydroxy-phenyl)-6-oxo-hexanoic acid 2-hyd...)
Affinity DataIC50: 2.94E+5nMAssay Description:Inhibitory concentration against purified recombinant integrase by 3'-processing in vitro assay (experiment 1)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrase(Human immunodeficiency virus type 1)
National Cancer Institute-Bethesda

Curated by ChEMBL
LigandPNGBDBM50056877(6-(2,4-Dihydroxy-phenyl)-6-oxo-hexanoic acid 2-hyd...)
Affinity DataIC50: 3.67E+5nMAssay Description:Inhibitory concentration against purified recombinant integrase by 3'-processing in vitro assay (experiment 2)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed