BDBM50004152 (HEPT) 1-(2-Hydroxy-ethoxymethyl)-5-methyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione::1-((2-hydroxyethoxy)methyl)-5-methyl-6-(phenylthio)pyrimidine-2,4(1H,3H)-dione::1-(2-HYDROXYETHYLOXYMETHYL)-6-PHENYL THIOTHYMINE::1-(2-Hydroxy-ethoxymethyl)-5-methyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione::1-(2-Hydroxy-ethoxymethyl)-5-methyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione(HEPT)::1-[(2-hydroxyethoxy)methyl]-6-(phenylsulfanyl)thymine::1-[(2-hydroxyethoxy)methyl]-6-(phenylthio)-thymine::CHEMBL31871

SMILES CC1=C(N(C(=O)NC1=O)COCCO)Sc2ccccc2

InChI Key InChIKey=HDMHBHNRWDNNCD-UHFFFAOYSA-N

Data  8 IC50  1 EC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50004152   

TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 1.75E+4nMAssay Description:Inhibition of HIV-1 reverse transcriptase from peripheral blood mononuclear cells.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibitory effect on HIV-1 reverse transcriptase activity using poly(rA)-oligo(dT) template primerMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 5.06E+3nMAssay Description:Concentration required to protect the cell against HIV-1 strain IIIB viral cytopathogenicity by 50% in MT-4 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 6.00E+3nMAssay Description:Inhibition of HIV-1 reverse transcriptase (RT)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 1.70E+4nMAssay Description:Inhibitory activity against HIV-1 reverse transcriptaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataEC50:  7.00E+3nMAssay Description:Inhibition of HIV-1 reverse transcriptase at 37 degree CentigradeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 1.70E+4nMAssay Description:The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2004
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 4.05E+5nMAssay Description:Inhibitory concentration against SO561945 (HIV 1 mutant RT) viral infection of MT-4 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Veterans Affairs Medical Center

Curated by ChEMBL
LigandPNGBDBM50004152(CHEMBL31871 | 1-(2-Hydroxy-ethoxymethyl)-5-methyl-...)
Affinity DataIC50: 1.50E+5nMAssay Description:Inhibitory effect on HIV-1 reverse transcriptase activity using poly(rC)-oligo(dG) template primerMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)