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Compile Data Set for Download or QSAR

Found 43 hits of ic50 for UniProtKB: P03366   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17667
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES COc1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,7.81,;1.21,6.27,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C21H14F4N2O/c1-28-18-10-4-9-17-20(18)26-21(19-15(24)7-3-8-16(19)25)27(17)11-12-13(22)5-2-6-14(12)23/h2-10H,11H2,1H3
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n/an/a 7.30n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17666
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES Fc1cccc(F)c1Cn1c(nc2ccccc12)-c1c(F)cccc1F |(-3.45,3.05,;-4.22,1.72,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;-3.45,.39,;-1.91,.34,;-1.14,1.68,;.39,1.52,;1.02,2.92,;-.12,3.95,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C20H12F4N2/c21-13-5-3-6-14(22)12(13)11-26-18-10-2-1-9-17(18)25-20(26)19-15(23)7-4-8-16(19)24/h1-10H,11H2
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n/an/a 110n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17665
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES Cc1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,6.27,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C21H14F4N2/c1-12-5-2-10-18-20(12)26-21(19-16(24)8-4-9-17(19)25)27(18)11-13-14(22)6-3-7-15(13)23/h2-10H,11H2,1H3
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n/an/a 200n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17672
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES Nc1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,6.27,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C20H13F4N3/c21-12-4-1-5-13(22)11(12)10-27-17-9-3-8-16(25)19(17)26-20(27)18-14(23)6-2-7-15(18)24/h1-9H,10,25H2
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n/an/a 280n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17668
PNG
(CHEMBL58494 | N-[2-(2,6-difluorophenyl)-1-[(2,6-di...)
Show SMILES CN(C(C)=O)c1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,7.81,;1.21,6.27,;2.54,5.49,;3.88,6.26,;2.54,3.95,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C23H17F4N3O/c1-13(31)29(2)19-10-5-11-20-22(19)28-23(21-17(26)8-4-9-18(21)27)30(20)12-14-15(24)6-3-7-16(14)25/h3-11H,12H2,1-2H3
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n/an/a 320n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17673
PNG
(4-bromo-2-(2,6-difluorophenyl)-1-[(2,6-difluorophe...)
Show SMILES Fc1cccc(F)c1Cn1c(nc2c(Br)cccc12)-c1c(F)cccc1F |(-3.45,3.05,;-4.22,1.72,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;-3.45,.39,;-1.91,.34,;-1.14,1.68,;.39,1.52,;1.02,2.92,;-.12,3.95,;-.12,5.5,;1.21,6.27,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C20H11BrF4N2/c21-12-4-1-9-17-19(12)26-20(18-15(24)7-3-8-16(18)25)27(17)10-11-13(22)5-2-6-14(11)23/h1-9H,10H2
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n/an/a 1.61E+3n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM1434
PNG
(11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3...)
Show SMILES Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12
Show InChI InChI=1S/C15H14N4O/c1-9-6-8-17-14-12(9)18-15(20)11-3-2-7-16-13(11)19(14)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,18,20)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17670
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES [O-][N+](=O)c1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,7.81,;1.21,6.27,;2.75,6.27,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C20H11F4N3O2/c21-12-4-1-5-13(22)11(12)10-26-16-8-3-9-17(27(28)29)19(16)25-20(26)18-14(23)6-2-7-15(18)24/h1-9H,10H2
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n/an/a 1.88E+3n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM33045
PNG
(2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophe...)
Show SMILES NC(=O)c1c(N)sc2CCCCCc12
Show InChI InChI=1S/C10H14N2OS/c11-9(13)8-6-4-2-1-3-5-7(6)14-10(8)12/h1-5,12H2,(H2,11,13)
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n/an/a 2.00E+3n/an/an/an/a8.020



National Cancer Institute



Assay Description
RNaseH assays were performed using an 18-nucleotide 3-fluorescein-labeled RNA annealed to a complementary 18-nucleotide 5-dabcyl conjugated DNA. The ...

ACS Chem Biol 3: 635-44 (2008)


Article DOI: 10.1021/cb8001039
BindingDB Entry DOI: 10.7270/Q29P300F
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17674
PNG
(4-chloro-2-(2,6-difluorophenyl)-1-[(2,6-difluoroph...)
Show SMILES Fc1cccc(F)c1Cn1c(nc2c(Cl)cccc12)-c1c(F)cccc1F |(-3.45,3.05,;-4.22,1.72,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;-3.45,.39,;-1.91,.34,;-1.14,1.68,;.39,1.52,;1.02,2.92,;-.12,3.95,;-.12,5.5,;1.21,6.27,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C20H11ClF4N2/c21-12-4-1-9-17-19(12)26-20(18-15(24)7-3-8-16(18)25)27(17)10-11-13(22)5-2-6-14(11)23/h1-9H,10H2
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n/an/a 2.63E+3n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM33963
PNG
(vinylogous urea, NSC727448)
Show SMILES Cc1sc(NC(=O)c2ccco2)c(C(N)=O)c1C
Show InChI InChI=1S/C12H12N2O3S/c1-6-7(2)18-12(9(6)10(13)15)14-11(16)8-4-3-5-17-8/h3-5H,1-2H3,(H2,13,15)(H,14,16)
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n/an/a 3.20E+3n/an/an/an/a8.020



National Cancer Institute



Assay Description
RNaseH assays were performed using an 18-nucleotide 3-fluorescein-labeled RNA annealed to a complementary 18-nucleotide 5-dabcyl conjugated DNA. The ...

ACS Chem Biol 3: 635-44 (2008)


Article DOI: 10.1021/cb8001039
BindingDB Entry DOI: 10.7270/Q29P300F
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16189
PNG
(4-(3-Iodophenyl)-3-oxobutanenitrile | beta-ketonit...)
Show SMILES Ic1cccc(CC(=O)CC#N)c1
Show InChI InChI=1S/C10H8INO/c11-9-3-1-2-8(6-9)7-10(13)4-5-12/h1-3,6H,4,7H2
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n/an/a 3.50E+3n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16185
PNG
(3-(3-Chlorophenyl)-3-oxopropanenitrile | beta-keto...)
Show SMILES Clc1cccc(c1)C(=O)CC#N
Show InChI InChI=1S/C9H6ClNO/c10-8-3-1-2-7(6-8)9(12)4-5-11/h1-3,6H,4H2
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n/an/a 4.10E+3n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17676
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES CNc1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,7.81,;1.21,6.27,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C21H15F4N3/c1-26-17-9-4-10-18-20(17)27-21(19-15(24)7-3-8-16(19)25)28(18)11-12-13(22)5-2-6-14(12)23/h2-10,26H,11H2,1H3
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n/an/a 4.94E+3n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16187
PNG
(3-(3-benzoylphenyl)-3-oxopropanenitrile | 3-Benzoy...)
Show SMILES O=C(CC#N)c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C16H11NO2/c17-10-9-15(18)13-7-4-8-14(11-13)16(19)12-5-2-1-3-6-12/h1-8,11H,9H2
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n/an/a 9.80E+3n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16196
PNG
(4-(3-Bromo-4-chlorophenyl)-1H-imidazole-5-carboxam...)
Show SMILES NC(=O)c1[nH]cnc1-c1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C10H7BrClN3O/c11-6-3-5(1-2-7(6)12)8-9(10(13)16)15-4-14-8/h1-4H,(H2,13,16)(H,14,15)
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n/an/a 9.90E+3n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16208
PNG
(4-(3-Benzoylphenyl)thiazole-5-carboxamide | 4-(3-b...)
Show SMILES NC(=O)c1scnc1-c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C17H12N2O2S/c18-17(21)16-14(19-10-22-16)12-7-4-8-13(9-12)15(20)11-5-2-1-3-6-11/h1-10H,(H2,18,21)
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n/an/a 1.63E+4n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17669
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES CCc1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,7.81,;1.21,6.27,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C22H16F4N2/c1-2-13-6-3-11-19-21(13)27-22(20-17(25)9-5-10-18(20)26)28(19)12-14-15(23)7-4-8-16(14)24/h3-11H,2,12H2,1H3
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n/an/a 1.75E+4n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16191
PNG
(3-(3-Iodophenyl)-3-oxopropanamide | beta-ketoamide...)
Show SMILES NC(=O)CC(=O)c1cccc(I)c1
Show InChI InChI=1S/C9H8INO2/c10-7-3-1-2-6(4-7)8(12)5-9(11)13/h1-4H,5H2,(H2,11,13)
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n/an/a 2.96E+4n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16188
PNG
(3-Phenyl-3-oxopropanenitrile | 3-oxo-3-(3-phenylph...)
Show SMILES O=C(CC#N)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C15H11NO/c16-10-9-15(17)14-8-4-7-13(11-14)12-5-2-1-3-6-12/h1-8,11H,9H2
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n/an/a 3.34E+4n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17677
PNG
(2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)meth...)
Show SMILES CN(C)c1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(1.21,7.81,;1.21,6.27,;2.54,5.49,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C22H17F4N3/c1-28(2)18-10-5-11-19-21(18)27-22(20-16(25)8-4-9-17(20)26)29(19)12-13-14(23)6-3-7-15(13)24/h3-11H,12H2,1-2H3
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n/an/a 4.00E+4n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16203
PNG
(2-Amino-4-(3-benzoylphenyl)thiazole-5-carboxamide ...)
Show SMILES NC(=O)c1sc(N)nc1-c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C17H13N3O2S/c18-16(22)15-13(20-17(19)23-15)11-7-4-8-12(9-11)14(21)10-5-2-1-3-6-10/h1-9H,(H2,18,22)(H2,19,20)
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n/an/a 4.41E+4n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16201
PNG
(2-Amino-4-(3-chlorophenyl)thiazole-5-carboxamide |...)
Show SMILES NC(=O)c1sc(N)nc1-c1cccc(Cl)c1
Show InChI InChI=1S/C10H8ClN3OS/c11-6-3-1-2-5(4-6)7-8(9(12)15)16-10(13)14-7/h1-4H,(H2,12,15)(H2,13,14)
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n/an/a 5.44E+4n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17675
PNG
(CHEMBL58358 | N-[2-(2,6-difluorophenyl)-1-[(2,6-di...)
Show SMILES CC(=O)Nc1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(2.54,8.57,;1.21,7.81,;-.12,8.58,;1.21,6.27,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C22H15F4N3O/c1-12(30)27-18-9-4-10-19-21(18)28-22(20-16(25)7-3-8-17(20)26)29(19)11-13-14(23)5-2-6-15(13)24/h2-10H,11H2,1H3,(H,27,30)
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n/an/a 5.47E+4n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16204
PNG
(2-Amino-4-(3-phenylphenyl)thiazole-5-carboxamide |...)
Show SMILES NC(=O)c1sc(N)nc1-c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C16H13N3OS/c17-15(20)14-13(19-16(18)21-14)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H,(H2,17,20)(H2,18,19)
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n/an/a 5.92E+4n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16190
PNG
(3-(2-Cyanoacetyl)phenyl Diethyl Phosphate | [3-(2-...)
Show SMILES CCOP(=O)(OCC)Oc1cccc(c1)C(=O)CC#N
Show InChI InChI=1S/C13H16NO5P/c1-3-17-20(16,18-4-2)19-12-7-5-6-11(10-12)13(15)8-9-14/h5-7,10H,3-4,8H2,1-2H3
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n/an/a 6.43E+4n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16195
PNG
(4-(3-Chlorophenyl)-1H-imidazole-5-carboxamide | Im...)
Show SMILES NC(=O)c1[nH]cnc1-c1cccc(Cl)c1
Show InChI InChI=1S/C10H8ClN3O/c11-7-3-1-2-6(4-7)8-9(10(12)15)14-5-13-8/h1-5H,(H2,12,15)(H,13,14)
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n/an/a 7.98E+4n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16205
PNG
(2-Amino-4-phenylthiazole-5-carboxamide | 2-amino-4...)
Show SMILES NC(=O)c1sc(N)nc1-c1ccccc1
Show InChI InChI=1S/C10H9N3OS/c11-9(14)8-7(13-10(12)15-8)6-4-2-1-3-5-6/h1-5H,(H2,11,14)(H2,12,13)
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n/an/a 8.07E+4n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16207
PNG
(4-(3-Bromo-4-chlorophenyl)thiazole-5-carboxamide |...)
Show SMILES NC(=O)c1scnc1-c1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C10H6BrClN2OS/c11-6-3-5(1-2-7(6)12)8-9(10(13)15)16-4-14-8/h1-4H,(H2,13,15)
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n/an/a 8.75E+4n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16202
PNG
(2-Amino-4-(3-bromo-4-chlorophenyl)thiazole-5-carbo...)
Show SMILES NC(=O)c1sc(N)nc1-c1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C10H7BrClN3OS/c11-5-3-4(1-2-6(5)12)7-8(9(13)16)17-10(14)15-7/h1-3H,(H2,13,16)(H2,14,15)
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n/an/a 1.18E+5n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16200
PNG
(2-Amino-4-(3-iodophenyl)thiazole-5-carboxamide | 2...)
Show SMILES NC(=O)c1sc(N)nc1-c1cccc(I)c1
Show InChI InChI=1S/C10H8IN3OS/c11-6-3-1-2-5(4-6)7-8(9(12)15)16-10(13)14-7/h1-4H,(H2,12,15)(H2,13,14)
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n/an/a 1.25E+5n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM17671
PNG
(benzimidazole analogue, 50 | methyl 2-(2,6-difluor...)
Show SMILES COC(=O)c1cccc2n(Cc3c(F)cccc3F)c(nc12)-c1c(F)cccc1F |(2.54,8.57,;1.21,7.81,;1.21,6.27,;2.54,5.49,;-.12,5.5,;-1.46,6.27,;-2.79,5.5,;-2.79,3.95,;-1.46,3.18,;-1.14,1.68,;-1.91,.34,;-3.45,.39,;-4.22,1.72,;-3.45,3.05,;-5.76,1.72,;-6.53,.39,;-5.76,-.95,;-4.22,-.95,;-3.45,-2.28,;.39,1.52,;1.02,2.92,;-.12,3.95,;1.16,.18,;2.7,.18,;3.47,1.52,;3.47,-1.15,;2.7,-2.48,;1.16,-2.48,;.39,-1.15,;-1.15,-1.15,)|
Show InChI InChI=1S/C22H14F4N2O2/c1-30-22(29)12-5-2-10-18-20(12)27-21(19-16(25)8-4-9-17(19)26)28(18)11-13-14(23)6-3-7-15(13)24/h2-10H,11H2,1H3
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n/an/a 1.58E+5n/an/an/an/a8.037



NCI-FCRDC



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 4003-4015 (2007)


Article DOI: 10.1021/jm060103d
BindingDB Entry DOI: 10.7270/Q25M6409
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16210
PNG
(4-Phenylthiazole-5-carboxamide | 4-phenyl-1,3-thia...)
Show SMILES NC(=O)c1scnc1-c1ccccc1
Show InChI InChI=1S/C10H8N2OS/c11-10(13)9-8(12-6-14-9)7-4-2-1-3-5-7/h1-6H,(H2,11,13)
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n/an/a 2.83E+5n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16199
PNG
(4-Phenyl-1H-imidazole-5-carboxamide | Imidazole 8g)
Show SMILES NC(=O)c1[nH]cnc1-c1ccccc1
Show InChI InChI=1S/C10H9N3O/c11-10(14)9-8(12-6-13-9)7-4-2-1-3-5-7/h1-6H,(H2,11,14)(H,12,13)
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n/an/a 3.00E+5n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16206
PNG
(4-(3-Iodophenyl)thiazole-5-carboxamide | 4-(3-iodo...)
Show SMILES NC(=O)c1scnc1-c1cccc(I)c1
Show InChI InChI=1S/C10H7IN2OS/c11-7-3-1-2-6(4-7)8-9(10(12)14)15-5-13-8/h1-5H,(H2,12,14)
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n/an/a>3.12E+5n/an/an/an/an/an/a



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16197
PNG
(4-(3-Benzoylphenyl)-1H-imidazole-5-carboxamide | I...)
Show SMILES NC(=O)c1[nH]cnc1-c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C17H13N3O2/c18-17(22)15-14(19-10-20-15)12-7-4-8-13(9-12)16(21)11-5-2-1-3-6-11/h1-10H,(H2,18,22)(H,19,20)
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n/an/a>3.12E+5n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16193
PNG
(3-(3-Benzoylphenyl)-3-oxopropanamide | beta-ketoam...)
Show SMILES NC(=O)CC(=O)c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C16H13NO3/c17-15(19)10-14(18)12-7-4-8-13(9-12)16(20)11-5-2-1-3-6-11/h1-9H,10H2,(H2,17,19)
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n/an/a>3.12E+5n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16209
PNG
(4-(3-Phenylphenyl)thiazole-5-carboxamide | 4-(3-ph...)
Show SMILES NC(=O)c1scnc1-c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C16H12N2OS/c17-16(19)15-14(18-10-20-15)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,17,19)
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Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16184
PNG
(3-(3-Iodophenyl)-3-oxopropanenitrile | beta-ketoni...)
Show SMILES Ic1cccc(c1)C(=O)CC#N
Show InChI InChI=1S/C9H6INO/c10-8-3-1-2-7(6-8)9(12)4-5-11/h1-3,6H,4H2
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n/an/a>3.12E+5n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16186
PNG
(3-(3-Bromo-4-chlorophenyl)-3-oxopropanenitrile | b...)
Show SMILES Clc1ccc(cc1Br)C(=O)CC#N
Show InChI InChI=1S/C9H5BrClNO/c10-7-5-6(1-2-8(7)11)9(13)3-4-12/h1-2,5H,3H2
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n/an/a>3.12E+5n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16198
PNG
(4-(3-Phenylphenyl)-1H-imidazole-5-carboxamide | Im...)
Show SMILES NC(=O)c1[nH]cnc1-c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C16H13N3O/c17-16(20)15-14(18-10-19-15)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,17,20)(H,18,19)
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Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16192
PNG
(3-(3-Chlorophenyl)-3-oxopropanamide | beta-ketoami...)
Show SMILES NC(=O)CC(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C9H8ClNO2/c10-7-3-1-2-6(4-7)8(12)5-9(11)13/h1-4H,5H2,(H2,11,13)
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n/an/a>3.12E+5n/an/an/an/a7.537



Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [600-1029,C879S]/[600-1159,C879S]


(Human immunodeficiency virus type 1)		BDBM16194
PNG
(3-Oxo-3-(3-phenylphenyl)propanamide | beta-ketoami...)
Show SMILES NC(=O)CC(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C15H13NO2/c16-15(18)10-14(17)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-9H,10H2,(H2,16,18)
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Bar Ilan University



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.

J Med Chem 50: 2370-84 (2007)


Article DOI: 10.1021/jm0613121
BindingDB Entry DOI: 10.7270/Q2VM49J0
More data for this
Ligand-Target Pair