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PubMed code 9934459

Compile data set for download or QSAR
Found 6 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, membrane associated


(Homo sapiens (Human))		BDBM50073194
PNG
((2-{[2-((S)-Dodecanoylamino)-hexyloxy]-hydroxy-pho...)
Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCCC)COP([O-])(=O)OCC[N+](C)(C)C
Show InChI InChI=1S/C23H49N2O5P/c1-6-8-10-11-12-13-14-15-16-18-23(26)24-22(17-9-7-2)21-30-31(27,28)29-20-19-25(3,4)5/h22H,6-21H2,1-5H3,(H-,24,26,27,28)/t22-/m1/s1
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n/an/a 5.30E+3n/an/an/an/an/an/a



Kwansei Gakuin University

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against type II Phospholipase A2 (PLA2) isolated from japanese mamushi (A. halys blomhoffii) venom

Bioorg Med Chem Lett 8: 3495-8 (1999)


BindingDB Entry DOI: 10.7270/Q2WW7GTV
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))		BDBM50073196
PNG
(CHEMBL442205 | {2-[((4R,5S)-3-Dodecanoyl-2-oxo-4-p...)
Show SMILES CCCCCCCCCCCC(=O)N1[C@H](CCC)[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)OC1=O
Show InChI InChI=1S/C24H47N2O7P/c1-6-8-9-10-11-12-13-14-15-17-23(27)25-21(16-7-2)22(33-24(25)28)20-32-34(29,30)31-19-18-26(3,4)5/h21-22H,6-20H2,1-5H3/t21-,22-/m1/s1
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n/an/a 1.98E+4n/an/an/an/an/an/a



Kwansei Gakuin University

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against type II Phospholipase A2 (PLA2) isolated from japanese mamushi (A. halys blomhoffii) venom

Bioorg Med Chem Lett 8: 3495-8 (1999)


BindingDB Entry DOI: 10.7270/Q2WW7GTV
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))		BDBM50073197
PNG
(CHEMBL116362 | {2-[((R)-3-Dodecanoyl-2-oxo-oxazoli...)
Show SMILES CCCCCCCCCCCC(=O)N1[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)COC1=O
Show InChI InChI=1S/C21H41N2O7P/c1-5-6-7-8-9-10-11-12-13-14-20(24)22-19(17-28-21(22)25)18-30-31(26,27)29-16-15-23(2,3)4/h19H,5-18H2,1-4H3/t19-/m1/s1
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n/an/a 3.13E+4n/an/an/an/an/an/a



Kwansei Gakuin University

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against type II Phospholipase A2 (PLA2) isolated from japanese mamushi (A. halys blomhoffii) venom

Bioorg Med Chem Lett 8: 3495-8 (1999)


BindingDB Entry DOI: 10.7270/Q2WW7GTV
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))		BDBM50073199
PNG
(CHEMBL119325 | {2-[((4S,5S)-3-Dodecanoyl-2-oxo-4-p...)
Show SMILES CCCCCCCCCCCC(=O)N1[C@@H](CCC)[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC1=O
Show InChI InChI=1S/C24H47N2O7P/c1-6-8-9-10-11-12-13-14-15-17-23(27)25-21(16-7-2)22(33-24(25)28)20-32-34(29,30)31-19-18-26(3,4)5/h21-22H,6-20H2,1-5H3/t21-,22-/m0/s1
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n/an/a 4.01E+4n/an/an/an/an/an/a



Kwansei Gakuin University

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against type II Phospholipase A2 (PLA2) isolated from japanese mamushi (A. halys blomhoffii) venom

Bioorg Med Chem Lett 8: 3495-8 (1999)


BindingDB Entry DOI: 10.7270/Q2WW7GTV
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))		BDBM50073195
PNG
(CHEMBL117235 | {2-[((4R,5S)-3-Dodecanoyl-2-oxo-4-p...)
Show SMILES CCCCCCCCCCCC(=O)N1[C@H](CCC)[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC1=O
Show InChI InChI=1S/C24H47N2O7P/c1-6-8-9-10-11-12-13-14-15-17-23(27)25-21(16-7-2)22(33-24(25)28)20-32-34(29,30)31-19-18-26(3,4)5/h21-22H,6-20H2,1-5H3/t21-,22+/m1/s1
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n/an/a 4.58E+4n/an/an/an/an/an/a



Kwansei Gakuin University

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against type II Phospholipase A2 (PLA2) isolated from japanese mamushi (A. halys blomhoffii) venom

Bioorg Med Chem Lett 8: 3495-8 (1999)


BindingDB Entry DOI: 10.7270/Q2WW7GTV
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))		BDBM50073198
PNG
(CHEMBL419955 | {2-[((4S,5R)-3-Dodecanoyl-2-oxo-4-p...)
Show SMILES CCCCCCCCCCCC(=O)N1[C@@H](CCC)[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)OC1=O
Show InChI InChI=1S/C24H47N2O7P/c1-6-8-9-10-11-12-13-14-15-17-23(27)25-21(16-7-2)22(33-24(25)28)20-32-34(29,30)31-19-18-26(3,4)5/h21-22H,6-20H2,1-5H3/t21-,22+/m0/s1
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n/an/a 5.29E+4n/an/an/an/an/an/a



Kwansei Gakuin University

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against type II Phospholipase A2 (PLA2) isolated from japanese mamushi (A. halys blomhoffii) venom

Bioorg Med Chem Lett 8: 3495-8 (1999)


BindingDB Entry DOI: 10.7270/Q2WW7GTV
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%