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Compile Data Set for Download or QSAR

Found 24 hits Enz. Inhib. hit(s) with Target = 'Phospholipase A2 group IIC'   
Target
(Institution)
LigandTarget
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 group IIC


(Homo sapiens)
BDBM50289490
PNG
(4-Tridecanoylamino-octanoic acid | CHEMBL33789)
Show SMILES CCCCCCCCCCCCC(=O)NC(CCCC)CCC(O)=O
Show InChI InChI=1S/C21H41NO3/c1-3-5-7-8-9-10-11-12-13-14-16-20(23)22-19(15-6-4-2)17-18-21(24)25/h19H,3-18H2,1-2H3,(H,22,23)(H,24,25)
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n/an/a 400n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289485
PNG
(CHEMBL289247 | N-[1-Octadecyloxymethyl-3-(1H-tetra...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCc1nnn[nH]1)NC(C)=O
Show InChI InChI=1S/C25H49N5O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-32-22-24(26-23(2)31)19-20-25-27-29-30-28-25/h24H,3-22H2,1-2H3,(H,26,31)(H,27,28,29,30)
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n/an/a 570n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289494
PNG
(Phosphoric acid 2-hydroxy-ethyl ester 3-propoxy-2-...)
Show SMILES CCCCCCCCCCCCC(=O)NC(COCCC)COP([O-])(=O)OCCO
Show InChI InChI=1S/C21H44NO7P/c1-3-5-6-7-8-9-10-11-12-13-14-21(24)22-20(18-27-16-4-2)19-29-30(25,26)28-17-15-23/h20,23H,3-19H2,1-2H3,(H,22,24)(H,25,26)/p-1
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n/an/a 1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50366475
PNG
(CHEMBL1159973)
Show SMILES CCCCCCCCOC[C@H](CO[P@@](O)(=O)OCCN)O[P@](O)(=O)CCCCCCC
Show InChI InChI=1S/C20H45NO8P2/c1-3-5-7-9-10-12-15-26-18-20(19-28-31(24,25)27-16-14-21)29-30(22,23)17-13-11-8-6-4-2/h20H,3-19,21H2,1-2H3,(H,22,23)(H,24,25)/t20-/m1/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289473
PNG
(CHEMBL418592 | Tridecanoic acid {1-[2-(1H-tetrazol...)
Show SMILES CCCCCCCCCCCCC(=O)NC(CCCC)CCc1nnn[nH]1
Show InChI InChI=1S/C21H41N5O/c1-3-5-7-8-9-10-11-12-13-14-16-21(27)22-19(15-6-4-2)17-18-20-23-25-26-24-20/h19H,3-18H2,1-2H3,(H,22,27)(H,23,24,25,26)
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n/an/a 6.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289472
PNG
(CHEMBL33036 | N-(1-Octadecyloxymethyl-pent-4-enyl)...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCC=C)NC(C)=O
Show InChI InChI=1S/C26H51NO2/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-29-24-26(22-7-5-2)27-25(3)28/h5,26H,2,4,6-24H2,1,3H3,(H,27,28)
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n/an/a 8.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289487
PNG
(CHEMBL30265 | N-(4,5-Dihydroxy-1-octadecyloxymethy...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCC(O)CO)NC(C)=O
Show InChI InChI=1S/C26H53NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-31-23-25(27-24(2)29)19-20-26(30)22-28/h25-26,28,30H,3-23H2,1-2H3,(H,27,29)
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n/an/a 8.90E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289475
PNG
(4-Acetylamino-5-octadecyloxy-pentanoic acid | CHEM...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCC(O)=O)NC(C)=O
Show InChI InChI=1S/C25H49NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30-22-24(26-23(2)27)19-20-25(28)29/h24H,3-22H2,1-2H3,(H,26,27)(H,28,29)
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n/an/a 9.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289478
PNG
(CHEMBL418597 | N-[1-Octadecyloxymethyl-3-(toluene-...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCS(=O)(=O)c1ccc(C)cc1)NC(C)=O
Show InChI InChI=1S/C31H55NO4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-36-27-30(32-29(3)33)24-26-37(34,35)31-22-20-28(2)21-23-31/h20-23,30H,4-19,24-27H2,1-3H3,(H,32,33)
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n/an/a 5.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289486
PNG
(CHEMBL281041 | N-(1-Octadecyloxymethyl-pentyl)-ace...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCCC)NC(C)=O
Show InChI InChI=1S/C26H53NO2/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-29-24-26(22-7-5-2)27-25(3)28/h26H,4-24H2,1-3H3,(H,27,28)
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n/an/a 6.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289491
PNG
(CHEMBL33529 | N-[1-[(Octadecyloxy)methyl]-3-(methy...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCS(C)=O)NC(C)=O
Show InChI InChI=1S/C25H51NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-29-23-25(26-24(2)27)20-22-30(3)28/h25H,4-23H2,1-3H3,(H,26,27)
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n/an/a 6.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289483
PNG
(CHEMBL34115 | N-(3-Methanesulfonyl-1-octadecyloxym...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCS(C)(=O)=O)NC(C)=O
Show InChI InChI=1S/C25H51NO4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-30-23-25(26-24(2)27)20-22-31(3,28)29/h25H,4-23H2,1-3H3,(H,26,27)
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n/an/a 1.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289493
PNG
(CHEMBL284600 | N-[1-Octadecyloxymethyl-2-(2,2,2-tr...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(COCC(F)(F)F)NC(C)=O
Show InChI InChI=1S/C25H48F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-31-20-24(29-23(2)30)21-32-22-25(26,27)28/h24H,3-22H2,1-2H3,(H,29,30)
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TBA

Assay Description
Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289484
PNG
(CHEMBL34227 | N-(1-Octadecyloxymethyl-3-p-tolylsul...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCSc1ccc(C)cc1)NC(C)=O
Show InChI InChI=1S/C31H55NO2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-34-27-30(32-29(3)33)24-26-35-31-22-20-28(2)21-23-31/h20-23,30H,4-19,24-27H2,1-3H3,(H,32,33)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289481
PNG
(CHEMBL34562 | N-(1-Octadecyloxymethyl-4-oxo-pentyl...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCC(C)=O)NC(C)=O
Show InChI InChI=1S/C26H51NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30-23-26(27-25(3)29)21-20-24(2)28/h26H,4-23H2,1-3H3,(H,27,29)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289479
PNG
(CHEMBL33836 | N-(2-Acetylamino-1-octadecyloxymethy...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CNC(C)=O)NC(C)=O
Show InChI InChI=1S/C25H50N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-30-22-25(27-24(3)29)21-26-23(2)28/h25H,4-22H2,1-3H3,(H,26,28)(H,27,29)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inctive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289476
PNG
(CHEMBL34688 | N-(1-Octadecyloxymethyl-3-oxiranyl-p...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCC1CO1)NC(C)=O
Show InChI InChI=1S/C26H51NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-22-25(27-24(2)28)19-20-26-23-30-26/h25-26H,3-23H2,1-2H3,(H,27,28)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289489
PNG
(CHEMBL34385 | N-(2-Imidazol-1-yl-1-octadecyloxymet...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(Cn1ccnc1)NC(C)=O
Show InChI InChI=1S/C26H49N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-31-23-26(28-25(2)30)22-29-20-19-27-24-29/h19-20,24,26H,3-18,21-23H2,1-2H3,(H,28,30)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289482
PNG
(4-Acetylamino-5-octadecyloxy-pentanoic acid methyl...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCC(=O)OC)NC(C)=O
Show InChI InChI=1S/C26H51NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-31-23-25(27-24(2)28)20-21-26(29)30-3/h25H,4-23H2,1-3H3,(H,27,28)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289492
PNG
(CHEMBL34624 | N-[1-Octadecyloxymethyl-2-(toluene-4...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CNS(=O)(=O)c1ccc(C)cc1)NC(C)=O
Show InChI InChI=1S/C30H54N2O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-36-26-29(32-28(3)33)25-31-37(34,35)30-22-20-27(2)21-23-30/h20-23,29,31H,4-19,24-26H2,1-3H3,(H,32,33)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289474
PNG
(CHEMBL290121 | N-(4-Hydroxy-1-octadecyloxymethyl-b...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCCO)NC(C)=O
Show InChI InChI=1S/C25H51NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-29-23-25(20-19-21-27)26-24(2)28/h25,27H,3-23H2,1-2H3,(H,26,28)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289471
PNG
(CHEMBL34519 | N-(5-Hydroxy-1-octadecyloxymethyl-pe...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCCCO)NC(C)=O
Show InChI InChI=1S/C26H53NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-30-24-26(27-25(2)29)21-18-19-22-28/h26,28H,3-24H2,1-2H3,(H,27,29)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; Inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289480
PNG
(CHEMBL284373 | N-{1-(Octadecyloxymethyl)-3-[(4-met...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCS(=O)c1ccc(C)cc1)NC(C)=O
Show InChI InChI=1S/C31H55NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-35-27-30(32-29(3)33)24-26-36(34)31-22-20-28(2)21-23-31/h20-23,30H,4-19,24-27H2,1-3H3,(H,32,33)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase A2 group IIC


(Homo sapiens)
BDBM50289488
PNG
(CHEMBL33513 | N-(4-Hydroxy-1-octadecyloxymethyl-pe...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(CCC(C)O)NC(C)=O
Show InChI InChI=1S/C26H53NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30-23-26(27-25(3)29)21-20-24(2)28/h24,26,28H,4-23H2,1-3H3,(H,27,29)
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TBA

Assay Description
Compound was tested for the Inhibition of human Secretory phospholipase A 2 acyl hydrolysis using a membrane assay; inactive


Citation and Details
More data for this
Ligand-Target Pair