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Found 20 hits Enz. Inhib. hit(s) with Target = 'DENV2 protease (NS2B-NS3)' AND taxid = 11065   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152653
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-(4-ethylphenyl)benz...)
Show SMILES CCc1ccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
Show InChI InChI=1S/C30H20Cl4N4S/c31-17-4-9-26-21(11-17)23(14-35-26)29(24-15-36-27-10-5-18(32)12-22(24)27)16-1-6-20(7-2-16)37-30(39)38-28-13-19(33)3-8-25(28)34/h1-15,29,35-36H,(H2,37,38,39)
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n/an/a 4.82E+4n/an/an/an/an/an/a



Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152657
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-phenethylbenzenesul...)
Show SMILES O=C1N(C(=O)c2ccccc12)c1ccc(cc1)S(=O)(=O)NCCc1ccccc1
Show InChI InChI=1S/C32H27BrN4S/c1-19-6-3-10-25-27(17-34-30(19)25)29(28-18-35-31-20(2)7-4-11-26(28)31)21-12-14-23(15-13-21)36-32(38)37-24-9-5-8-22(33)16-24/h3-18,29,34-35H,1-2H3,(H2,36,37,38)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152640
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N,N-diethyl benzenesu...)
Show SMILES Brc1cccc(NC(=S)Nc2ccc(cc2)C(c2c[nH]c3ccccc23)c2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C30H23BrN4S/c31-20-6-5-7-22(16-20)35-30(36)34-21-14-12-19(13-15-21)29(25-17-32-27-10-3-1-8-23(25)27)26-18-33-28-11-4-2-9-24(26)28/h1-18,29,32-33H,(H2,34,35,36)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152640
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N,N-diethyl benzenesu...)
Show SMILES Brc1cccc(NC(=S)Nc2ccc(cc2)C(c2c[nH]c3ccccc23)c2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C30H23BrN4S/c31-20-6-5-7-22(16-20)35-30(36)34-21-14-12-19(13-15-21)29(25-17-32-27-10-3-1-8-23(25)27)26-18-33-28-11-4-2-9-24(26)28/h1-18,29,32-33H,(H2,34,35,36)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152642
PNG
(2-(4-(Piperidin-1-ylsulphonyl)phenyl)isoindoline-1...)
Show SMILES O=C1N(C(=O)c2ccccc12)c1ccc(cc1)S(=O)(=O)N1CCCCC1
Show InChI InChI=1S/C30H23ClN4S/c31-20-6-5-7-22(16-20)35-30(36)34-21-14-12-19(13-15-21)29(25-17-32-27-10-3-1-8-23(25)27)26-18-33-28-11-4-2-9-24(26)28/h1-18,29,32-33H,(H2,34,35,36)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152643
PNG
(2-(4-(4-Methylpiperazin-1-ylsulphonyl)phenyl)isoin...)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C30H23N5O2S/c36-35(37)22-15-13-21(14-16-22)34-30(38)33-20-11-9-19(10-12-20)29(25-17-31-27-7-3-1-5-23(25)27)26-18-32-28-8-4-2-6-24(26)28/h1-18,29,31-32H,(H2,33,34,38)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152644
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-phenylbenzenesulpho...)
Show SMILES O=C1N(C(=O)c2ccccc12)c1ccc(cc1)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C30H22Br2N4S/c31-19-8-12-27-23(14-19)25(16-33-27)29(26-17-34-28-13-9-20(32)15-24(26)28)18-6-10-22(11-7-18)36-30(37)35-21-4-2-1-3-5-21/h1-17,29,33-34H,(H2,35,36,37)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152645
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-(2-hydroxyphenyl)be...)
Show SMILES Oc1ccccc1NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C27H22Br2N4O2S/c1-2-35-27(34)33-26(36)32-18-7-3-15(4-8-18)25(21-13-30-23-9-5-16(28)11-19(21)23)22-14-31-24-10-6-17(29)12-20(22)24/h3-14,25,30-31H,2H2,1H3,(H2,32,33,34,36)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152646
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-(3-methoxyphenyl)be...)
Show SMILES COc1cccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C30H21Br3N4S/c31-18-2-1-3-22(12-18)37-30(38)36-21-8-4-17(5-9-21)29(25-15-34-27-10-6-19(32)13-23(25)27)26-16-35-28-11-7-20(33)14-24(26)28/h1-16,29,34-35H,(H2,36,37,38)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152647
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-(4-methoxyphenyl)be...)
Show SMILES COc1ccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
Show InChI InChI=1S/C30H21Br2ClN4S/c31-18-6-10-27-23(12-18)25(15-34-27)29(26-16-35-28-11-7-19(32)13-24(26)28)17-4-8-21(9-5-17)36-30(38)37-22-3-1-2-20(33)14-22/h1-16,29,34-35H,(H2,36,37,38)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152648
PNG
(N-(3-chlorophenyl)-4-(1,3-dioxoisoindolin-2-yl)ben...)
Show SMILES Clc1cccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN2O4S/c21-13-4-3-5-14(12-13)22-28(26,27)16-10-8-15(9-11-16)23-19(24)17-6-1-2-7-18(17)20(23)25/h1-12,22H
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152649
PNG
(N-(4-chlorophenyl)-4-(1,3-dioxoisoindolin-2-yl)ben...)
Show SMILES Clc1ccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
Show InChI InChI=1S/C30H20Br2Cl2N4S/c31-17-3-9-26-21(11-17)23(14-35-26)29(24-15-36-27-10-4-18(32)12-22(24)27)16-1-6-20(7-2-16)37-30(39)38-28-13-19(33)5-8-25(28)34/h1-15,29,35-36H,(H2,37,38,39)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152650
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-o-tolylbenzenesulph...)
Show SMILES Cc1ccccc1NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C30H21BrCl2N4S/c31-18-2-1-3-22(12-18)37-30(38)36-21-8-4-17(5-9-21)29(25-15-34-27-10-6-19(32)13-23(25)27)26-16-35-28-11-7-20(33)14-24(26)28/h1-16,29,34-35H,(H2,36,37,38)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152651
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-m-tolylbenzenesulph...)
Show SMILES Cc1cccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C30H21Cl2N5O2S/c31-18-3-11-27-23(13-18)25(15-33-27)29(26-16-34-28-12-4-19(32)14-24(26)28)17-1-5-20(6-2-17)35-30(40)36-21-7-9-22(10-8-21)37(38)39/h1-16,29,33-34H,(H2,35,36,40)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152652
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-p-tolylbenzenesulph...)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
Show InChI InChI=1S/C30H21Cl3N4S/c31-18-2-1-3-22(12-18)37-30(38)36-21-8-4-17(5-9-21)29(25-15-34-27-10-6-19(32)13-23(25)27)26-16-35-28-11-7-20(33)14-24(26)28/h1-16,29,34-35H,(H2,36,37,38)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152654
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-(4-nitrophenyl)benz...)
Show SMILES [O-][N+](=O)c1ccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
Show InChI InChI=1S/C27H22Cl2N4O2S/c1-2-35-27(34)33-26(36)32-18-7-3-15(4-8-18)25(21-13-30-23-9-5-16(28)11-19(21)23)22-14-31-24-10-6-17(29)12-20(22)24/h3-14,25,30-31H,2H2,1H3,(H2,32,33,34,36)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152655
PNG
(4-(4-(1,3-Dioxoisoindolin-2-yl)phenylsulphonamido)...)
Show SMILES OC(=O)c1ccc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
Show InChI InChI=1S/C32H28N4S/c1-20-8-6-12-25-27(18-33-30(20)25)29(28-19-34-31-21(2)9-7-13-26(28)31)22-14-16-24(17-15-22)36-32(37)35-23-10-4-3-5-11-23/h3-19,29,33-34H,1-2H3,(H2,35,36,37)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152638
PNG
(4-(1,3-Dioxoisoindolin-2-yl)benzenesulphonamide (1...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C30H24N4S/c35-30(33-21-8-2-1-3-9-21)34-22-16-14-20(15-17-22)29(25-18-31-27-12-6-4-10-23(25)27)26-19-32-28-13-7-5-11-24(26)28/h1-19,29,31-32H,(H2,33,34,35)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152639
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N,N-dimethyl benzenes...)
Show SMILES CN(C)S(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C27H24N4O2S/c1-2-33-27(32)31-26(34)30-18-13-11-17(12-14-18)25(21-15-28-23-9-5-3-7-19(21)23)22-16-29-24-10-6-4-8-20(22)24/h3-16,25,28-29H,2H2,1H3,(H2,30,31,32,34)
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Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

More data for this
Ligand-Target Pair
DENV2 protease (NS2B-NS3)


(Dengue virus 2 (Virus))
BDBM152656
PNG
(4-(1,3-Dioxoisoindolin-2-yl)-N-(naphthalen-1-yl)be...)
Show SMILES O=C1N(C(=O)c2ccccc12)c1ccc(cc1)S(=O)(=O)Nc1cccc2ccccc12
Show InChI InChI=1S/C32H26Cl2N4S/c1-18-5-3-7-23-25(16-35-30(18)23)29(26-17-36-31-19(2)6-4-8-24(26)31)20-9-12-22(13-10-20)37-32(39)38-28-15-21(33)11-14-27(28)34/h3-17,29,35-36H,1-2H3,(H2,37,38,39)
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n/an/a 1.22E+5n/an/an/an/an/an/a



Birla Institute of Technology



Assay Description
To measure the inhibitory activities of the compounds, the DENV2 NS2B-NS3 protease activities were measured in the presence of the compounds using Bz...


Bioorg Chem 62: 74-82 (2015)

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