Compound ID |
Cluster
|
Compound Type
|
Target/Cell | Structure | Activity | Assay Description | Source | ||||
---|---|---|---|---|---|---|---|---|---|---|---|
Type
|
Relation
|
Value
|
Unit
|
||||||||
NAs.000071 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Ki | = | 210.0 | nM | Inhibition of HIV1 reverse transcriptase by steady state nucleotide incorporation assay | CHEMBL1155161 | |
NAs.000071 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.47 | None | Ratio of Ki to Km for HIV1 reverse transcriptase by steady state nucleotide incorporation assay | CHEMBL1155161 | |
NAs.000071 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Ki | = | 110.0 | nM | Inhibition of HIV1 reverse transcriptase M41L/D67N/L210W/T215Y mutant by steady state nucleotide incorporation assay | CHEMBL1155161 | |
NAs.000071 | 7 | all-match | Unchecked | ![]() |
Other | = | 0.5 | None | Ratio of Ki for HIV1 reverse transcriptase M41L/D67N/L210W/T215Y mutant to Ki for wild-type reverse transcriptase | CHEMBL1155161 | |
NAs.000071 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.19 | None | Ratio of Ki to Km for HIV1 reverse transcriptase M41L/D67N/L210W/T215Y mutant by steady state nucleotide incorporation assay | CHEMBL1155161 | |
NAs.000071 | 7 | all-match | Unchecked | ![]() |
Other | = | 0.4 | None | Ratio of Ki/Km for HIV1 reverse transcriptase M41L/D67N/L210W/T215Y mutant to Ki/Km for wild-type reverse transcriptase | CHEMBL1155161 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 18000.0 | nM | Binding affinity to HIV1 recombinant reverse transcriptase p66/p51 K65R mutant expressed in Escherichia coli assessed as incorporation of drug to DNA by gel electrophoresis | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
IC50 | = | 170000.0 | nM | Inhibition of HIV1 reverse transcriptase p66/p51 K65R mutant expressed in Escherichia coli using calf thymus DNA substrate | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
IC50 | = | 22000.0 | nM | Inhibition of HIV1 wild type reverse transcriptase p66/p51 expressed in Escherichia coli using calf thymus DNA substrate | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
Other | = | 8.0 | None | Ratio of IC50 for HIV1 reverse transcriptase p66/p51 K65R mutant to IC50 for HIV1 wild type reverse transcriptase | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 23000.0 | nM | Binding affinity to HIV1 wild type reverse transcriptase p66/p51 expressed in Escherichia coli assessed as incorporation of drug to DNA by gel electrophoresis | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 13000.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/67N/70R/210W/215Y mutant in presence of 5'-A12-(GTCA)5-3' by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 24000.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/69S-SG/184V/210W/215Y mutant in presence of 5'-A12-(GTCA)5-3' by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.3 | None | Binding affinity to wild type reverse transcriptase assessed as ratio of catalytic rate constant to Kd for incorporation of drug to DNA by gel electrophoresis | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 2800.0 | nM | Inhibition of HIV1 reverse transcriptase wild type HXB2(a) in presence of 5'-A12-(GACT)5-3' by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 3300.0 | nM | Inhibition of HIV1 reverse transcriptase wild type HXB2(a) in presence of 5'-A12-(GTCA)5-3' by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 49000.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/67N/70R/210W/215Y mutant in presence of 20 uM dNTP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 17000.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/69S-SG/184V/210W/215Y mutant in presence of 5'-A12-(GACT)5-3' by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.02 | None | Binding affinity to HIV1 recombinant reverse transcriptase p66/p51 K65R mutant expressed in Escherichia coli assessed as ratio of catalytic rate constant to Kd for incorporation of drug to DNA by gel electrophoresis | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 74.0 | % | Inhibition of HIV1 wild type reverse transcriptase p66/p51 DNA polymerase activity assessed as formation of terminated DNA products | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 97.8 | None | Binding affinity to HIV1 recombinant reverse transcriptase p66/p51 K65R mutant assessed as ratio of catalytic rate constant to Kd for dATP to drug by gel electrophoresis | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 13000.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/67N/70R/210W/215Y mutant in presence of 1 uM dNTP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
Other | = | 0.2 | % | Inhibition of HIV1 wild type reverse transcriptase p66/p51 R72A mutant DNA polymerase activity assessed as formation of terminated DNA products | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus 1 | ![]() |
Other | = | 2.1 | None | Antiviral activity against HIV1 LAI with reverse transcriptase K70E mutation relative to wild type HIV1 LAI | CHEMBL1151429 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.79 | /s | Binding affinity to wild type HIV1 reverse transcriptase assessed as compound incorporation in presence of 50 nM primer template and 10 mM MgCl2 by pre-steady state kinetics study | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 16500.0 | nM | Binding affinity to wild type HIV1 reverse transcriptase by pre-steady state kinetics study | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 56.0 | None | Discrimination index, ratio of incorporation efficiency of TFV-DP to incorporation efficiency of compound for wild type HIV1 reverse transcriptase | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.048 | /s/microM | Inhibition of wild type HIV1 reverse transcriptase assessed as compound incorporation efficiency in presence of 50 nM primer template and 10 mM MgCl2 by pre-steady state kinetics study | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.15 | /s | Binding affinity to HIV1 reverse transcriptase K65R mutant assessed as compound incorporation in presence of 50 nM primer template and 10 mM MgCl2 by pre-steady state kinetics study | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 29100.0 | nM | Binding affinity to HIV1 reverse transcriptase K65R mutant by pre-steady state kinetics study | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 0.005 | /s/microM | Inhibition of HIV1 reverse transcriptase K65R mutant assessed as compound incorporation efficiency in presence of 50 nM primer template and 10 mM MgCl2 by pre-steady state kinetics study | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 122.0 | None | Discrimination index, ratio of incorporation efficiency of TFV-DP to incorporation efficiency of compound for wild type HIV1 reverse transcriptase K65R mutant | CHEMBL2046281 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
Other | = | 21.9 | None | Binding affinity to HIV1 wild type reverse transcriptase p66/p51 assessed as ratio of catalytic rate constant to Kd for dATP to drug by gel electrophoresis | CHEMBL1154421 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 19000.0 | nM | Inhibition of HIV1 reverse transcriptase wild type HXB2(a) in presence of 20 uM dNTP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 8600.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/67N/70R/210W/215Y mutant in presence of 5'-A12-(GACT)5-3' by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 1100.0 | nM | Inhibition of HIV1 pNL4-3 reverse transcriptase 115F mutant by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 3300.0 | nM | Inhibition of HIV1 reverse transcriptase wild type HXB2(a) in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 2300.0 | nM | Inhibition of HIV1 reverse transcriptase 184V mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 13000.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/67N/70R/210W/215Y mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 5900.0 | nM | Inhibition of HIV1 reverse transcriptase 41L/67N/70R/184V/210W/215Y mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 3300.0 | nM | Inhibition of HIV1 reverse transcriptase wild type HXB2(a) in presence of 1 uM dNTP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | None | None | None | Inhibition of HIV1 reverse transcriptase 41L/69S-SG/184V/210W/215Y mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 4600.0 | nM | Inhibition of HIV1 reverse transcriptase 75I/77L/116Y/151M/184V mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 11000.0 | nM | Inhibition of HIV1 reverse transcriptase 75I/77L/116Y/151M mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 3200.0 | nM | Inhibition of HIV1 reverse transcriptase wild type HXB2(b) in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 10500.0 | nM | Inhibition of HIV1 LAI reverse transcriptase 41L/67N/70R/215Y/219Q mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
IC50 | = | 1300.0 | nM | Inhibition of HIV1 LAI reverse transcriptase wild type in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 21000.0 | nM | Inhibition of HIV1 LAI reverse transcriptase 65R mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Human immunodeficiency virus type 1 reverse transcriptase | ![]() |
IC50 | = | 4000.0 | nM | Inhibition of HIV1 pNL4-3 reverse transcriptase wild type pNL4-3 in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 | |
NAs.000599 | 7 | all-match | Unchecked | ![]() |
IC50 | = | 3700.0 | nM | Inhibition of HIV1 pNL4-3 reverse transcriptase 115F mutant in presence of 5 mM ATP by heteropolymeric DNA polymerase assay | CHEMBL1143844 |