BindingDB logo
myBDB logout

PubMed code 19665385

Compile data set for download or QSAR
Found 14 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/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304136
PNG
(1,12-Bis(3',4'-dipentylpyridinium)dodecane dichlor...)
Show SMILES CCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCC)c(CCCCC)c2)cc1CCCCC
Show InChI InChI=1S/C42H74N2/c1-5-9-21-27-39-31-35-43(37-41(39)29-23-11-7-3)33-25-19-17-15-13-14-16-18-20-26-34-44-36-32-40(28-22-10-6-2)42(38-44)30-24-12-8-4/h31-32,35-38H,5-30,33-34H2,1-4H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.20E+4n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304137
PNG
(1,12-Bis(4'-(5''-nonylpyridinium)dodecane dichlori...)
Show SMILES CCCCC(CCCC)c1cc[n+](CCCCCCCCCCCC[n+]2ccc(cc2)C(CCCC)CCCC)cc1
Show InChI InChI=1S/C40H70N2/c1-5-9-23-37(24-10-6-2)39-27-33-41(34-28-39)31-21-19-17-15-13-14-16-18-20-22-32-42-35-29-40(30-36-42)38(25-11-7-3)26-12-8-4/h27-30,33-38H,5-26,31-32H2,1-4H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.30E+4n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304129
PNG
(1,12-Bis[4'-(1''-pentenyl)pyridinium]dodecanedichl...)
Show SMILES C=CCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCC=C)cc2)cc1
Show InChI InChI=1S/C32H50N2/c1-3-5-15-19-31-21-27-33(28-22-31)25-17-13-11-9-7-8-10-12-14-18-26-34-29-23-32(24-30-34)20-16-6-4-2/h3-4,21-24,27-30H,1-2,5-20,25-26H2/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.60E+4n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304130
PNG
(1,12-Bis(4'-isopentylpyridinium)dodecane dichlorid...)
Show SMILES CC(C)CCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCC(C)C)cc2)cc1
Show InChI InChI=1S/C32H54N2/c1-29(2)15-17-31-19-25-33(26-20-31)23-13-11-9-7-5-6-8-10-12-14-24-34-27-21-32(22-28-34)18-16-30(3)4/h19-22,25-30H,5-18,23-24H2,1-4H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.70E+4n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304133
PNG
(1,12-Bis[4'-(3' '-phenylpropyl)pyridinium]dodecane...)
Show SMILES C(CCCCCC[n+]1ccc(CCCc2ccccc2)cc1)CCCCC[n+]1ccc(CCCc2ccccc2)cc1
Show InChI InChI=1S/C40H54N2/c1(3-5-7-15-31-41-33-27-39(28-34-41)25-17-23-37-19-11-9-12-20-37)2-4-6-8-16-32-42-35-29-40(30-36-42)26-18-24-38-21-13-10-14-22-38/h9-14,19-22,27-30,33-36H,1-8,15-18,23-26,31-32H2/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.04E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304135
PNG
(1,12-Bis(3'-methyl-4'-pentylpyridinium)dodecane di...)
Show SMILES CCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCC)c(C)c2)cc1C
Show InChI InChI=1S/C34H58N2/c1-5-7-17-21-33-23-27-35(29-31(33)3)25-19-15-13-11-9-10-12-14-16-20-26-36-28-24-34(32(4)30-36)22-18-8-6-2/h23-24,27-30H,5-22,25-26H2,1-4H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.34E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50119793
PNG
(1,1'-(dodecane-1,12-diyl)dipyridinium bromide | 1,...)
Show SMILES C(CCCCCC[n+]1ccccc1)CCCCC[n+]1ccccc1
Show InChI InChI=1S/C22H34N2/c1(3-5-7-11-17-23-19-13-9-14-20-23)2-4-6-8-12-18-24-21-15-10-16-22-24/h9-10,13-16,19-22H,1-8,11-12,17-18H2/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304125
PNG
(1,1'-(dodecane-1,12-diyl)bis(4-methylpyridinium)br...)
Show SMILES Cc1cc[n+](CCCCCCCCCCCC[n+]2ccc(C)cc2)cc1
Show InChI InChI=1S/C24H38N2/c1-23-13-19-25(20-14-23)17-11-9-7-5-3-4-6-8-10-12-18-26-21-15-24(2)16-22-26/h13-16,19-22H,3-12,17-18H2,1-2H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304127
PNG
(1,12-Bis-(4-tert-butylpyridinium)dodecane dibromid...)
Show SMILES CC(C)(C)c1cc[n+](CCCCCCCCCCCC[n+]2ccc(cc2)C(C)(C)C)cc1
Show InChI InChI=1S/C30H50N2/c1-29(2,3)27-17-23-31(24-18-27)21-15-13-11-9-7-8-10-12-14-16-22-32-25-19-28(20-26-32)30(4,5)6/h17-20,23-26H,7-16,21-22H2,1-6H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304131
PNG
(1,12-Bis(4'-hexylpyridinium)dodecane dichloride | ...)
Show SMILES CCCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCCC)cc2)cc1
Show InChI InChI=1S/C34H58N2/c1-3-5-7-17-21-33-23-29-35(30-24-33)27-19-15-13-11-9-10-12-14-16-20-28-36-31-25-34(26-32-36)22-18-8-6-4-2/h23-26,29-32H,3-22,27-28H2,1-2H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304132
PNG
(1,12-Bis(4'-isohexylpyridinium)dodecane dichloride...)
Show SMILES CC(C)CCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCC(C)C)cc2)cc1
Show InChI InChI=1S/C34H58N2/c1-31(2)17-15-19-33-21-27-35(28-22-33)25-13-11-9-7-5-6-8-10-12-14-26-36-29-23-34(24-30-36)20-16-18-32(3)4/h21-24,27-32H,5-20,25-26H2,1-4H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304128
PNG
(1,12-Bis(4'-pentylpyridinium)dodecane dichloride |...)
Show SMILES CCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCC)cc2)cc1
Show InChI InChI=1S/C32H54N2/c1-3-5-15-19-31-21-27-33(28-22-31)25-17-13-11-9-7-8-10-12-14-18-26-34-29-23-32(24-30-34)20-16-6-4-2/h21-24,27-30H,3-20,25-26H2,1-2H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304126
PNG
(1,12-Bis(4'-ethylpyridinium)dodecane dibromide | C...)
Show SMILES CCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CC)cc2)cc1
Show InChI InChI=1S/C26H42N2/c1-3-25-15-21-27(22-16-25)19-13-11-9-7-5-6-8-10-12-14-20-28-23-17-26(4-2)18-24-28/h15-18,21-24H,3-14,19-20H2,1-2H3/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
Phospholipase A2, major isoenzyme


(Sus scrofa (pig))
BDBM50304134
PNG
(1,12-Bis(4'-pyridinium propanol)dodecane dichlorid...)
Show SMILES OCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCO)cc2)cc1
Show InChI InChI=1S/C28H46N2O2/c31-25-11-13-27-15-21-29(22-16-27)19-9-7-5-3-1-2-4-6-8-10-20-30-23-17-28(18-24-30)14-12-26-32/h15-18,21-24,31-32H,1-14,19-20,25-26H2/q+2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method


Bioorg Med Chem 17: 6329-39 (2009)


Article DOI: 10.1016/j.bmc.2009.07.037
BindingDB Entry DOI: 10.7270/Q27081JD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%