null

SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(CSc2ccc(F)cc2Cl)cc1

InChI Key InChIKey=WORXHPZHYHJBAR-UHFFFAOYSA-N

  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 17 hits for monomerid = 50339536   

TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  10nMAssay Description:Inhibition of HIV1 wild type reverse transcriptase/poly(rA)/oligo(dT) DNA/dTTP ternary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  20nMAssay Description:Inhibition of HIV1 reverse transcriptase K103N mutant/poly(rA)/oligo(dT) DNA/dTTP ternary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  90nMAssay Description:Inhibition of HIV1 wild type reverse transcriptase/poly(rA)/oligo(dT) DNA binary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  90nMAssay Description:Inhibition of HIV1 free wild type reverse transcriptaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  120nMAssay Description:Inhibition of HIV1 reverse transcriptase V179D mutant/poly(rA)/oligo(dT) DNA/dTTP ternary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  140nMAssay Description:Inhibition of HIV1 reverse transcriptase V179D mutant/poly(rA)/oligo(dT) DNA binary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  140nMAssay Description:Inhibition of HIV1 free reverse transcriptase V179D mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  150nMAssay Description:Inhibition of HIV1 reverse transcriptase L100I mutant/poly(rA)/oligo(dT) DNA/dTTP ternary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  200nMAssay Description:Inhibition of HIV1 free reverse transcriptase L100I mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  200nMAssay Description:Inhibition of HIV1 reverse transcriptase L100I mutant/poly(rA)/oligo(dT) DNA binary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  510nMAssay Description:Inhibition of HIV1 reverse transcriptase K103N mutant/poly(rA)/oligo(dT) DNA binary complexMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataKi:  510nMAssay Description:Inhibition of HIV1 free reverse transcriptase K103N mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataIC50: 2.05E+4nMAssay Description:Inhibition of HIV1 reverse transcriptase K103N mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase protein(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataIC50: 4.00E+5nMAssay Description:Inhibition of HIV1 reverse transcriptase L100I mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetAdenosine kinase(Homo sapiens (Human))
Universita` di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataIC50: 2.50E+3nMAssay Description:Inhibition of human adenosine kinaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XD120BPubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of HIV1 reverse transcriptase V179D mutantMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
2-Universit£ di Siena

Curated by ChEMBL
LigandPNGBDBM50339536((+/-)-6-Ethyl-6-[4-[(2-chloro-4-fluorophenylthio)m...)copy SMILEScopy InChI
Affinity DataIC50: 610nMAssay Description:Inhibition of HIV1 wild type reverse transcriptaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2319ZQ9PubMed