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Compile Data Set for Download or QSAR

Found 6 hits of ph data with Target = 'Serum paraoxonase/arylesterase 1'   
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
Serum paraoxonase/arylesterase 1


(Homo sapiens (Human))
BDBM92331
PNG
(Lornoxicam)
Show SMILES CN1C(C(=O)Nc2ccccn2)=C(O)c2sc(Cl)cc2S1(=O)=O
Show InChI InChI=1S/C13H10ClN3O4S2/c1-17-10(13(19)16-9-4-2-3-5-15-9)11(18)12-7(23(17,20)21)6-8(14)22-12/h2-6,18H,1H3,(H,15,16,19)
KEGG

UniProtKB/SwissProt

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UniChem

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Article
PubMed
9.00E+3 -28.8 1.36E+5n/an/an/an/a10.525



Atatürk University



Assay Description
The enzyme assay was based on the estimation of p-nitrophenol at 412nm. The molar extinction coefficient of p-nitrophenol was used to calculate enzy...


J Enzyme Inhib Med Chem 24: 1034-9 (2009)


Article DOI: 10.1080/14756360802608351
BindingDB Entry DOI: 10.7270/Q2TT4PKR
More data for this
Ligand-Target Pair
Serum paraoxonase/arylesterase 1


(Homo sapiens (Human))
BDBM17638
PNG
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)
Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
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CHEMBL
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PC sid
PDB
UniChem

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Article
PubMed
9.70E+4 -22.9 1.95E+5n/an/an/an/a10.525



Atatürk University



Assay Description
The enzyme assay was based on the estimation of p-nitrophenol at 412nm. The molar extinction coefficient of p-nitrophenol was used to calculate enzy...


J Enzyme Inhib Med Chem 24: 1034-9 (2009)


Article DOI: 10.1080/14756360802608351
BindingDB Entry DOI: 10.7270/Q2TT4PKR
More data for this
Ligand-Target Pair
Serum paraoxonase/arylesterase 1


(Homo sapiens (Human))
BDBM92332
PNG
(Tenoxicam)
Show SMILES CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O
Show InChI InChI=1S/C13H11N3O4S2/c1-16-10(13(18)15-9-4-2-3-6-14-9)11(17)12-8(5-7-21-12)22(16,19)20/h2-7,17H,1H3,(H,14,15,18)
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Article
PubMed
3.06E+5 -20.1 3.40E+5n/an/an/an/a10.525



Atatürk University



Assay Description
The enzyme assay was based on the estimation of p-nitrophenol at 412nm. The molar extinction coefficient of p-nitrophenol was used to calculate enzy...


J Enzyme Inhib Med Chem 24: 1034-9 (2009)


Article DOI: 10.1080/14756360802608351
BindingDB Entry DOI: 10.7270/Q2TT4PKR
More data for this
Ligand-Target Pair
Serum paraoxonase/arylesterase 1


(Homo sapiens (Human))
BDBM50174201
PNG
(ARTHROTEC | DICLOFENAC SODIUM | GP 45840 | SOLARAZ...)
Show SMILES [O-]C(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
Show InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)/p-1
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Article
PubMed
8.05E+5 -17.7 1.64E+6n/an/an/an/a10.525



Atatürk University



Assay Description
The enzyme assay was based on the estimation of p-nitrophenol at 412nm. The molar extinction coefficient of p-nitrophenol was used to calculate enzy...


J Enzyme Inhib Med Chem 24: 1034-9 (2009)


Article DOI: 10.1080/14756360802608351
BindingDB Entry DOI: 10.7270/Q2TT4PKR
More data for this
Ligand-Target Pair
Serum paraoxonase/arylesterase 1


(Homo sapiens (Human))
BDBM92333
PNG
(Lincomycine)
Show SMILES CCCC1CC(N(C)C1)C(=O)NC(C(C)O)C1OC(SC)C(O)C(O)C1O
Show InChI InChI=1S/C18H34N2O6S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)
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PC cid
PC sid
PDB
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Article
PubMed
1.11E+7 -11.2 1.30E+7n/an/an/an/a10.525



Atatürk University



Assay Description
The enzyme assay was based on the estimation of p-nitrophenol at 412nm. The molar extinction coefficient of p-nitrophenol was used to calculate enzy...


J Enzyme Inhib Med Chem 24: 1034-9 (2009)


Article DOI: 10.1080/14756360802608351
BindingDB Entry DOI: 10.7270/Q2TT4PKR
More data for this
Ligand-Target Pair
Serum paraoxonase/arylesterase 1


(Homo sapiens (Human))
BDBM50022271
PNG
(2-(3-Benzoylphenyl)propionic acid | 2-(3-benzoylph...)
Show SMILES CC(C(O)=O)c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)
KEGG

UniProtKB/SwissProt

DrugBank
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CHEMBL
DrugBank
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.30E+7 -10.8 6.23E+6n/an/an/an/a10.525



Atatürk University



Assay Description
The enzyme assay was based on the estimation of p-nitrophenol at 412nm. The molar extinction coefficient of p-nitrophenol was used to calculate enzy...


J Enzyme Inhib Med Chem 24: 1034-9 (2009)


Article DOI: 10.1080/14756360802608351
BindingDB Entry DOI: 10.7270/Q2TT4PKR
More data for this
Ligand-Target Pair