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PubMed code 15950190

Compile data set for download or QSAR
Found 10 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM31712
PNG
(HEXACHLOROPHENE | MLS000028433 | SMR000058356 | ci...)
Show SMILES Oc1c(Cl)cc(Cl)c(Cl)c1Cc1c(O)c(Cl)cc(Cl)c1Cl
Show InChI InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2
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PubMed
4.00E+3n/an/an/an/an/an/an/an/a



National Taiwan University



Assay Description
Kinetic parameters were obtained using various concentrations of FRET peptide in the fluorescent assay. The maximal velocity (Vmax) and Michaelis–Men...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM96545
PNG
(2,4-dichloro-6-(3,5-dichloro-2-hydroxy-phenyl)sulf...)
Show SMILES Oc1c(Cl)cc(Cl)cc1S(=O)c1cc(Cl)cc(Cl)c1O
Show InChI InChI=1S/C12H6Cl4O3S/c13-5-1-7(15)11(17)9(3-5)20(19)10-4-6(14)2-8(16)12(10)18/h1-4,17-18H
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PC cid
PC sid
UniChem
PubMed
n/an/a 7.60E+3n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM420290
PNG
(HL-8)
Show SMILES Oc1c(Cl)cc(Cl)cc1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
Show InChI InChI=1S/C12H6Cl4O4S/c13-5-1-7(15)11(17)9(3-5)21(19,20)10-4-6(14)2-8(16)12(10)18/h1-4,17-18H
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PubMed
n/an/a 9.20E+3n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM420285
PNG
(HL-4)
Show SMILES Oc1c(Br)cc(Cl)cc1Sc1cc(Cl)cc(Br)c1O
Show InChI InChI=1S/C12H6Br2Cl2O2S/c13-7-1-5(15)3-9(11(7)17)19-10-4-6(16)2-8(14)12(10)18/h1-4,17-18H
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PubMed
n/an/a 4.60E+4n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM420287
PNG
(HL-6)
Show SMILES CC(=O)Oc1c(Cl)cc(Cl)c(Cl)c1Sc1c(Cl)c(Cl)cc(Cl)c1OC(C)=O
Show InChI InChI=1S/C16H8Cl6O4S/c1-5(23)25-13-9(19)3-7(17)11(21)15(13)27-16-12(22)8(18)4-10(20)14(16)26-6(2)24/h3-4H,1-2H3
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PubMed
n/an/a 4.60E+4n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM420289
PNG
(HL-7)
Show SMILES Oc1c(Cl)cc(Cl)c(Cl)c1S(=O)(=O)c1c(O)c(Cl)cc(Cl)c1Cl
Show InChI InChI=1S/C12H4Cl6O4S/c13-3-1-5(15)9(19)11(7(3)17)23(21,22)12-8(18)4(14)2-6(16)10(12)20/h1-2,19-20H
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PubMed
n/an/a 4.60E+4n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM420286
PNG
(HL-5)
Show SMILES Oc1c(Sc2cc(Cl)cc(c2O)[N+]([O-])=O)cc(Cl)cc1[N+]([O-])=O
Show InChI InChI=1S/C12H6Cl2N2O6S/c13-5-1-7(15(19)20)11(17)9(3-5)23-10-4-6(14)2-8(12(10)18)16(21)22/h1-4,17-18H
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PubMed
n/an/a 4.60E+4n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM420281
PNG
(HL-1)
Show SMILES Cc1cc(Cl)cc(Cc2cc(Cl)cc(C)c2O)c1O
Show InChI InChI=1S/C15H14Cl2O2/c1-8-3-12(16)6-10(14(8)18)5-11-7-13(17)4-9(2)15(11)19/h3-4,6-7,18-19H,5H2,1-2H3
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PubMed
n/an/a 4.60E+4n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM420282
PNG
(HL-2)
Show SMILES Oc1c(Br)cc(Cl)cc1Cc1cc(Cl)cc(Br)c1O
Show InChI InChI=1S/C13H8Br2Cl2O2/c14-10-4-8(16)2-6(12(10)18)1-7-3-9(17)5-11(15)13(7)19/h2-5,18-19H,1H2
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PubMed
n/an/a 4.60E+4n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM36880
PNG
(2,2'-THIOBIS(4,6-DICHLOROPHENOL) | 2,4-dichlor...)
Show SMILES Oc1c(Cl)cc(Cl)cc1Sc1cc(Cl)cc(Cl)c1O
Show InChI InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H
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CHEBI
DrugBank
KEGG
PC cid
PC sid
PDB
UniChem

Patents


Similars

PubMed
n/an/a 4.60E+4n/an/an/an/an/an/a



National Taiwan University



Assay Description
To establish a high-throughput screening method, we designed a FRET peptide, Abz-SAVLQSGFRK-Dnp, as 3CLpro substrate. The FRET peptide was synthesize...


Biochem Biophys Res Commun 333: 194-9 (2005)


BindingDB Entry DOI: 10.7270/Q2N58PRD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%