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Compile Data Set for Download or QSAR

Found 35 hits with Last Name = 'ho' and Initial = 'my'   
Target/Host
(Institution)		LigandTarget/Host
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
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59242
PNG
(Benzotriazole ester, 8 | acs.jmedchem.1c00409_ST.6...)
Show SMILES O=C(On1nnc2ccccc12)c1ccc2[nH]ccc2c1
Show InChI InChI=1S/C15H10N4O2/c20-15(11-5-6-12-10(9-11)7-8-16-12)21-19-14-4-2-1-3-13(14)17-18-19/h1-9,16H
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 7.5n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59240
PNG
(Benzotriazole ester, 6 | acs.jmedchem.1c00409_ST.8)
Show SMILES CCN(CC)c1ccc(cc1)C(=O)On1nnc2ccccc12
Show InChI InChI=1S/C17H18N4O2/c1-3-20(4-2)14-11-9-13(10-12-14)17(22)23-21-16-8-6-5-7-15(16)18-19-21/h5-12H,3-4H2,1-2H3
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 11.1n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59239
PNG
(Benzotriazole ester, 5 | acs.jmedchem.1c00409_ST.9)
Show SMILES CNc1ccc(cc1)C(=O)On1nnc2ccccc12
Show InChI InChI=1S/C14H12N4O2/c1-15-11-8-6-10(7-9-11)14(19)20-18-13-5-3-2-4-12(13)16-17-18/h2-9,15H,1H3
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 12.1n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59243
PNG
(Benzotriazole ester, 9 | acs.jmedchem.1c00409_ST.1...)
Show SMILES O=C(On1nnc2ccccc12)c1cc2ccccc2[nH]1
Show InChI InChI=1S/C15H10N4O2/c20-15(13-9-10-5-1-2-6-11(10)16-13)21-19-14-8-4-3-7-12(14)17-18-19/h1-9,16H
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 12.3n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59244
PNG
(Benzotriazole ester, 10 | acs.jmedchem.1c00409_ST....)
Show SMILES Fc1ccc2[nH]c(cc2c1)C(=O)On1nnc2ccccc12
Show InChI InChI=1S/C15H9FN4O2/c16-10-5-6-11-9(7-10)8-13(17-11)15(21)22-20-14-4-2-1-3-12(14)18-19-20/h1-8,17H
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 13.8n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59238
PNG
(Benzotriazole ester, 4 | acs.jmedchem.1c00409_ST.1...)
Show SMILES CN(C)c1ccc(cc1)C(=O)On1nnc2ccccc12
Show InChI InChI=1S/C15H14N4O2/c1-18(2)12-9-7-11(8-10-12)15(20)21-19-14-6-4-3-5-13(14)16-17-19/h3-10H,1-2H3
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 17.4n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59237
PNG
(Benzotriazole ester, 3 | acs.jmedchem.1c00409_ST.1...)
Show SMILES Nc1ccccc1C(=O)On1nnc2ccccc12
Show InChI InChI=1S/C13H10N4O2/c14-10-6-2-1-5-9(10)13(18)19-17-12-8-4-3-7-11(12)15-16-17/h1-8H,14H2
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 19.5n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59241
PNG
(Benzotriazole ester, 7)
Show SMILES O=C(On1nnc2ccccc12)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C14H9N5O2/c20-14(9-5-6-10-12(7-9)16-8-15-10)21-19-13-4-2-1-3-11(13)17-18-19/h1-8H,(H,15,16)
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 22.9n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59246
PNG
(Benzotriazole ester, 14)
Show SMILES CCN(CC)c1ccc(cc1)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C18H20N4O/c1-3-21(4-2)15-11-9-14(10-12-15)18(23)13-22-17-8-6-5-7-16(17)19-20-22/h5-12H,3-4,13H2,1-2H3
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 1.00E+3n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59249
PNG
(Benzotriazole ester, 17 | acs.jmedchem.1c00409_ST....)
Show SMILES CNc1ccc(cc1)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C15H14N4O/c1-16-12-8-6-11(7-9-12)15(20)10-19-14-5-3-2-4-13(14)17-18-19/h2-9,16H,10H2,1H3
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 4.50E+3n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59250
PNG
(Benzotriazole ester, 18 | acs.jmedchem.1c00409_ST....)
Show SMILES CN(C)c1ccc(cc1)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C16H16N4O/c1-19(2)13-9-7-12(8-10-13)16(21)11-20-15-6-4-3-5-14(15)17-18-20/h3-10H,11H2,1-2H3
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 6.70E+3n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59252
PNG
(Benzotriazole ester, 20)
Show SMILES CN(C)c1ccc(cc1)C(O)Cn1nnc2ccccc12
Show InChI InChI=1S/C16H18N4O/c1-19(2)13-9-7-12(8-10-13)16(21)11-20-15-6-4-3-5-14(15)17-18-20/h3-10,16,21H,11H2,1-2H3
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>5.00E+4n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59251
PNG
(Benzotriazole ester, 19)
Show SMILES CNc1ccc(cc1)C(O)Cn1nnc2ccccc12
Show InChI InChI=1S/C15H16N4O/c1-16-12-8-6-11(7-9-12)15(20)10-19-14-5-3-2-4-13(14)17-18-19/h2-9,15-16,20H,10H2,1H3
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>5.00E+4n/an/an/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577060
PNG
(SIGA-246 | ST 246 | ST-246 | Tecovirimat | Tpoxx)
Show SMILES [H][C@]12C[C@@]1([H])[C@@]1([H])C=C[C@]2([H])[C@]2([H])C(=O)N(NC(=O)c3ccc(cc3)C(F)(F)F)C(=O)[C@]12[H] |r,c:8|
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n/an/a 2.70n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577042
PNG
(CHEMBL4864184)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:12:13:16.15.20:18,THB:14:15:18:22.13.21,14:13:16.15.20:18,12:13:16:20.19.18,21:13:16:20.19.18,21:19:16:22.14.13|
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n/an/a 133n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577048
PNG
(CHEMBL4867155)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:22:21:17.16.15:19,THB:22:16:19:13.20.21,12:13:17.16.15:19,17:16:13:18.19.20,17:18:13:16.15.22,(26.21,-18.12,;24.88,-17.36,;24.87,-15.82,;26.2,-16.57,;23.54,-18.13,;22.21,-17.37,;20.88,-18.14,;20.88,-19.68,;22.21,-20.45,;23.55,-19.68,;19.54,-20.45,;19.54,-21.99,;18.21,-19.68,;16.88,-20.45,;16.87,-21.98,;15.47,-22.32,;14.14,-21.83,;12.94,-23.11,;14.45,-22.69,;15.85,-23.25,;14.43,-21.1,;15.48,-19.87,;14.13,-20.35,)|
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n/an/a 216n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577045
PNG
(CHEMBL4871145)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NCC12CC3CC(CC(C3)C1)C2 |TLB:13:14:17:21.20.19,THB:15:16:19:23.14.22,15:14:17.16.21:19,22:14:17:21.20.19,22:20:17:23.15.14|
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n/an/a 270n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577057
PNG
(CHEMBL4878636)
Show SMILES CC(NNC(=O)c1ccc(cc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2 |TLB:1:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,1:16:19:23.22.21,24:16:19:23.22.21,24:22:19:25.17.16|
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n/an/a 515n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577049
PNG
(CHEMBL4850454)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2 |TLB:14:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,14:16:19:23.22.21,24:16:19:23.22.21,24:22:19:25.17.16|
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n/an/a 1.07E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577058
PNG
(CHEMBL4872088)
Show SMILES CCC12CC3CC(C1)CC(C3)(C2)NNC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:5.4.3:7,THB:10:4:7:8.9.11,12:9:5:3.2.7,12:9:5.4.3:7,1:2:5:8.10.9,11:9:5:3.2.7,11:2:5:8.10.9|
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n/an/a 1.66E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577054
PNG
(CHEMBL4857491)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC1C2CC3CC(C2)CC1C3 |TLB:20:19:23:16.15.14,20:15:18.19.21:23,THB:13:14:18.19.21:23,14:15:18:21.22.23,14:22:18:16.20.15,(50.85,-35.86,;50.85,-34.32,;52.18,-33.55,;52.17,-35.09,;49.51,-33.55,;48.18,-34.32,;46.84,-33.55,;46.84,-32.01,;48.17,-31.24,;49.51,-32,;45.51,-31.24,;45.51,-29.7,;44.18,-32.01,;42.84,-31.24,;41.51,-32.01,;41.5,-33.54,;40.1,-33.88,;38.77,-33.39,;37.58,-34.67,;39.08,-34.25,;40.48,-34.81,;39.07,-32.66,;40.11,-31.43,;38.77,-31.91,)|
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n/an/a 2.80E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577047
PNG
(CHEMBL4865942)
Show SMILES Brc1ccc(cc1)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:19:18:14.13.12:16,THB:19:13:16:10.17.18,9:10:14.13.12:16,14:13:10:15.16.17,14:15:10:13.12.19,(12.3,-17.39,;10.97,-18.17,;10.97,-19.72,;9.64,-20.49,;8.3,-19.72,;8.3,-18.18,;9.63,-17.41,;6.97,-20.49,;6.97,-22.03,;5.63,-19.72,;4.3,-20.49,;4.29,-22.01,;2.89,-22.36,;1.56,-21.87,;.37,-23.15,;1.87,-22.73,;3.27,-23.29,;1.86,-21.14,;2.9,-19.91,;1.56,-20.39,)|
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n/an/a 3.06E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577055
PNG
(CHEMBL4852852)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC1C2CC3CC1CC(Cl)(C3)C2 |TLB:24:21:18:16.15.14,13:14:23.21.20:18,22:21:18:16.15.14,14:15:23:20.19.18,THB:24:15:23.21.20:18,14:19:23:16.24.15,(68.62,-36.56,;68.62,-35.02,;69.95,-34.25,;69.95,-35.79,;67.29,-34.25,;65.95,-35.02,;64.61,-34.25,;64.62,-32.71,;65.94,-31.94,;67.28,-32.7,;63.28,-31.94,;63.28,-30.4,;61.95,-32.71,;60.61,-31.94,;59.28,-32.71,;59.27,-34.24,;57.87,-34.58,;56.55,-34.09,;56.54,-32.61,;57.88,-32.13,;56.84,-33.36,;56.85,-34.95,;56.84,-36.49,;55.35,-35.37,;58.26,-35.51,)|
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n/an/a 3.52E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577043
PNG
(CHEMBL4879134)
Show SMILES CCC12CC3CC(C1)CC(C3)(C2)NC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:5.4.3:7,THB:10:4:7:8.9.11,12:9:5:3.2.7,12:9:5.4.3:7,1:2:5:8.10.9,11:9:5:3.2.7,11:2:5:8.10.9|
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n/an/a 4.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577044
PNG
(CHEMBL4877767)
Show SMILES CN(C(=O)c1ccc(cc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2 |TLB:1:14:17.16.21:19,THB:15:16:19:23.14.22,15:14:17.16.21:19,1:14:17:21.20.19,22:14:17:21.20.19,22:20:17:23.15.14|
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n/an/a 4.85E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577046
PNG
(CHEMBL4860346)
Show SMILES Brc1ccc(cc1)C(=O)NCC12CC3CC(CC(C3)C1)C2 |TLB:10:11:14:18.17.16,THB:12:13:16:20.11.19,12:11:14.13.18:16,19:11:14:18.17.16,19:17:14:20.12.11|
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n/an/a 8.30E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577059
PNG
(CHEMBL4856490)
Show SMILES CC12CC3CC(C1)CC(C3)(C2)NC(=O)c1ccc(cc1)C(F)(F)F |TLB:9:8:4.3.2:6,THB:10:8:4:2.1.6,10:1:4:7.9.8,11:8:4:2.1.6,11:8:4.3.2:6,9:3:10.7.8:6,0:1:4:7.9.8|
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n/an/a 8.98E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577056
PNG
(CHEMBL4853135)
Show SMILES C\C(=N/NC(=O)c1ccc(cc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2 |TLB:1:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,1:16:19:23.22.21,24:16:19:23.22.21,24:22:19:25.17.16|
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n/an/a 1.06E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577051
PNG
(CHEMBL4865823)
Show SMILES CCC12CC3CC(C1)CC(C3)(C2)C(=O)NNC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:5.4.3:7,THB:10:4:7:8.9.11,12:9:5:3.2.7,12:9:5.4.3:7,11:9:5:3.2.7,11:2:5:8.10.9,1:2:5:8.10.9|
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n/an/a 1.25E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577050
PNG
(CHEMBL4873414)
Show SMILES CC12CC3CC(C)(C1)CC(C3)(C2)C(=O)NNC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:4.3.2:7,THB:10:3:7:8.9.11,12:9:4:2.1.7,12:9:4.3.2:7,11:9:4:2.1.7,11:1:4:8.10.9,0:1:4:8.10.9|
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n/an/a 3.09E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577052
PNG
(CHEMBL4866978)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:16:17:20:24.23.22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17|
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n/an/a 3.63E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59245
PNG
(Benzotriazole ester, 13)
Show SMILES O=C(Cn1nnc2ccccc12)c1ccc(cc1)N(=O)=O
Show InChI InChI=1S/C14H10N4O3/c19-14(10-5-7-11(8-6-10)18(20)21)9-17-13-4-2-1-3-12(13)15-16-17/h1-8H,9H2
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n/an/a>5.00E+4n/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59247
PNG
(Benzotriazole ester, 15)
Show SMILES Nc1ccc(cc1)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C14H12N4O/c15-11-7-5-10(6-8-11)14(19)9-18-13-4-2-1-3-12(13)16-17-18/h1-8H,9,15H2
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n/an/a>5.00E+4n/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)		BDBM59248
PNG
(Benzotriazole ester, 16)
Show SMILES Nc1ccc(cc1)C(O)Cn1nnc2ccccc12
Show InChI InChI=1S/C14H14N4O/c15-11-7-5-10(6-8-11)14(19)9-18-13-4-2-1-3-12(13)16-17-18/h1-8,14,19H,9,15H2
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n/an/a>5.00E+4n/an/an/an/a7.5n/a



Academia Sinica



Assay Description
Inhibition assay against SARS-CoV 3CL protease, a fluorometric assay was utilized to determine the inhibition constants of the samples.

Chem Biol 13: 261-8 (2006)


Article DOI: 10.1016/j.chembiol.2005.12.008
BindingDB Entry DOI: 10.7270/Q21C1V9G
More data for this
Ligand-Target Pair
Envelope phospholipase F13


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)		BDBM50577053
PNG
(CHEMBL4876679)
Show SMILES FC(F)(F)c1ccc(cc1)-[#6](=O)-[#7]\[#7]=[#6]-1/[#6]-2-[#6]-[#6]-3-[#6]-[#6](-[#6]2)-[#6]-[#6]-1-[#6]-3 |TLB:20:19:23:16.15.14,20:15:18.19.21:23,THB:13:14:18.19.21:23,14:15:18:21.22.23,14:22:18:16.20.15|
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n/an/a 1.98E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...

Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113485
BindingDB Entry DOI: 10.7270/Q20G3Q08
More data for this
Ligand-Target Pair