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Compile Data Set for Download or QSAR

Found 318 hits Enz. Inhib. hit(s) with all data for entry = 4940   
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


(Homo sapiens (Human))
BDBM80861
PNG
(4-[2-(2-Cyclohexyl-5,6-dimethyl-thieno[2,3-d]pyrim...)
Show SMILES Cc1sc2nc(nc(SCC(=O)N3CC(=O)Nc4ccccc34)c2c1C)C1CCCCC1
Show InChI InChI=1S/C24H26N4O2S2/c1-14-15(2)32-24-21(14)23(26-22(27-24)16-8-4-3-5-9-16)31-13-20(30)28-12-19(29)25-17-10-6-7-11-18(17)28/h6-7,10-11,16H,3-5,8-9,12-13H2,1-2H3,(H,25,29)
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n/an/a 182n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80856
PNG
(4-[(2,5-dichlorophenoxy)methyl]-N-[3,5-dimethyl-1-...)
Show SMILES Cc1nn(Cc2c(F)c(F)c(F)c(F)c2F)c(C)c1NC(=O)c1ccc(COc2cc(Cl)ccc2Cl)cc1
Show InChI InChI=1S/C26H18Cl2F5N3O2/c1-12-25(13(2)36(35-12)10-17-20(29)22(31)24(33)23(32)21(17)30)34-26(37)15-5-3-14(4-6-15)11-38-19-9-16(27)7-8-18(19)28/h3-9H,10-11H2,1-2H3,(H,34,37)
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n/an/a 270n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80913
PNG
(2-[(5-acetyl-2-methoxy-benzyl)thio]-3-(m-tolyl)qui...)
Show SMILES COc1ccc(cc1CSc1nc2ccccc2c(=O)n1-c1cccc(C)c1)C(C)=O
Show InChI InChI=1S/C25H22N2O3S/c1-16-7-6-8-20(13-16)27-24(29)21-9-4-5-10-22(21)26-25(27)31-15-19-14-18(17(2)28)11-12-23(19)30-3/h4-14H,15H2,1-3H3
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n/an/a 321n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80880
PNG
(7-Ethyl-5-(4-nitro-phenyl)-2-phenyl-3H-benzo[e][1,...)
Show SMILES CCc1ccc2N=C(N=[NH+][C-](c3ccc(cc3)[N+]([O-])=O)c2c1)c1ccccc1
Show InChI InChI=1S/C22H18N4O2/c1-2-15-8-13-20-19(14-15)21(16-9-11-18(12-10-16)26(27)28)24-25-22(23-20)17-6-4-3-5-7-17/h3-14,24H,2H2,1H3
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n/an/a 357n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM43254
PNG
((1Z)-1-[(benzylamino)methylene]-3-nitro-6,7,8,9-te...)
Show SMILES [O-][N+](=O)c1cc2oc3CCCCc3c2[c-](\C=[NH+]\Cc2ccccc2)c1=O
Show InChI InChI=1S/C20H17N2O4/c23-20-15(12-21-11-13-6-2-1-3-7-13)19-14-8-4-5-9-17(14)26-18(19)10-16(20)22(24)25/h1-3,6-7,10,12H,4-5,8-9,11H2/q-1/p+1/b21-12+
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n/an/a 502n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80867
PNG
((4Z)-4-[[5-(3-chlorophenyl)-2-furanyl]methylidene]...)
Show SMILES Clc1cccc(c1)-c1ccc(\C=C2/N=C(OC2=O)c2cccs2)o1
Show InChI InChI=1S/C18H10ClNO3S/c19-12-4-1-3-11(9-12)15-7-6-13(22-15)10-14-18(21)23-17(20-14)16-5-2-8-24-16/h1-10H/b14-10-
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n/an/a 605n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM57574
PNG
((6E)-5-azanylidene-6-[[2,5-dimethyl-1-(3-methylphe...)
Show SMILES CCC(CC)C1=NN2C(S1)=NC(=O)\C(=C\c1cc(C)n(c1C)-c1cccc(C)c1)C2=N
Show InChI InChI=1S/C24H27N5OS/c1-6-17(7-2)23-27-29-21(25)20(22(30)26-24(29)31-23)13-18-12-15(4)28(16(18)5)19-10-8-9-14(3)11-19/h8-13,17,25H,6-7H2,1-5H3/b20-13+,25-21?
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n/an/a 975n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80868
PNG
(MLS000582413 | N-(3-chloranyl-2-pyrrolidin-1-yl-ph...)
Show SMILES Clc1cccc(NC(=O)c2cccc(c2)-c2cc3ccccc3oc2=O)c1N1CCCC1
Show InChI InChI=1S/C26H21ClN2O3/c27-21-10-6-11-22(24(21)29-13-3-4-14-29)28-25(30)19-9-5-8-17(15-19)20-16-18-7-1-2-12-23(18)32-26(20)31/h1-2,5-12,15-16H,3-4,13-14H2,(H,28,30)
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n/an/a 978n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80901
PNG
(2-[(1-ketoisochroman-3-carbonyl)amino]-4,5,6,7-tet...)
Show SMILES COC(=O)c1c(NC(=O)C2Cc3ccccc3C(=O)O2)sc2CCCCc12
Show InChI InChI=1S/C20H19NO5S/c1-25-20(24)16-13-8-4-5-9-15(13)27-18(16)21-17(22)14-10-11-6-2-3-7-12(11)19(23)26-14/h2-3,6-7,14H,4-5,8-10H2,1H3,(H,21,22)
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n/an/a 1.02E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM48853
PNG
((6E)-2-(2-furanyl)-5-imino-6-[[1-(4-methoxyphenyl)...)
Show SMILES COc1ccc(cc1)-n1cccc1\C=C1\C(=O)N=C2SC(=NN2C1=N)c1ccco1
Show InChI InChI=1S/C21H15N5O3S/c1-28-15-8-6-13(7-9-15)25-10-2-4-14(25)12-16-18(22)26-21(23-19(16)27)30-20(24-26)17-5-3-11-29-17/h2-12,22H,1H3/b16-12+,22-18?
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n/an/a 1.09E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80894
PNG
(2-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2...)
Show SMILES [O-][N+](=O)c1ccccc1\C=C\C=N\NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H18ClN5O4S/c26-18-11-13-19(14-12-18)30-24(33)20-8-2-3-9-21(20)28-25(30)36-16-23(32)29-27-15-5-7-17-6-1-4-10-22(17)31(34)35/h1-15H,16H2,(H,29,32)/b7-5+,27-15+
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n/an/a 1.18E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM55197
PNG
(2-[5-(3,4-Dimethoxy-phenyl)-[1,3,4]oxadiazol-2-ylm...)
Show SMILES COc1ccc(cc1OC)-c1nnc(CSc2nc3ccccc3c(=O)n2CC(C)C)o1
Show InChI InChI=1S/C23H24N4O4S/c1-14(2)12-27-22(28)16-7-5-6-8-17(16)24-23(27)32-13-20-25-26-21(31-20)15-9-10-18(29-3)19(11-15)30-4/h5-11,14H,12-13H2,1-4H3
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n/an/a 1.19E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80912
PNG
(2-[(5-acetyl-2-ethoxy-benzyl)thio]-3-allyl-quinazo...)
Show SMILES CCOc1ccc(cc1CSc1nc2ccccc2c(=O)n1CC=C)C(C)=O
Show InChI InChI=1S/C22H22N2O3S/c1-4-12-24-21(26)18-8-6-7-9-19(18)23-22(24)28-14-17-13-16(15(3)25)10-11-20(17)27-5-2/h4,6-11,13H,1,5,12,14H2,2-3H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM50296454
PNG
(5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenyl...)
Show SMILES Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1
Show InChI InChI=1S/C18H11Cl2N3OS/c19-11-5-6-15(13(20)8-11)22-18-23-17(24)16(25-18)7-10-9-21-14-4-2-1-3-12(10)14/h1-9,21H,(H,22,23,24)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM47570
PNG
((1Z)-1-[[2-[4-(1H-imidazol-2-yl)phthalazin-1-yl]hy...)
Show SMILES Oc1ccc2ccccc2c1CN=Nc1nnc(-c2ncc[nH]2)c2ccccc12
Show InChI InChI=1S/C22H16N6O/c29-19-10-9-14-5-1-2-6-15(14)18(19)13-25-27-21-17-8-4-3-7-16(17)20(26-28-21)22-23-11-12-24-22/h1-12,29H,13H2,(H,23,24)
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n/an/a 1.51E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM33131
PNG
(MLS000336087 | N-[(2-bromophenyl)methylideneamino]...)
Show SMILES Clc1ccc2c(ccnc2c1)N=NCc1ccccc1Br
Show InChI InChI=1S/C16H11BrClN3/c17-14-4-2-1-3-11(14)10-20-21-15-7-8-19-16-9-12(18)5-6-13(15)16/h1-9H,10H2
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n/an/a 1.75E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM52539
PNG
(3-[5-({2,4-dioxo-3-[2-oxo-2-(2-toluidino)ethyl]-1,...)
Show SMILES Cc1ccccc1NC(=O)CN1C(=O)S\C(=C/c2ccc(o2)-c2cc(ccc2C)C(O)=O)C1=O
Show InChI InChI=1S/C25H20N2O6S/c1-14-7-8-16(24(30)31)11-18(14)20-10-9-17(33-20)12-21-23(29)27(25(32)34-21)13-22(28)26-19-6-4-3-5-15(19)2/h3-12H,13H2,1-2H3,(H,26,28)(H,30,31)/b21-12-
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n/an/a 1.77E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80896
PNG
((4-Oxo-3-p-tolyl-3,4-dihydro-quinazolin-2-ylsulfan...)
Show SMILES Cc1nn(c(C)c1C=NNC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(C)cc1)-c1ccccc1
Show InChI InChI=1S/C29H26N6O2S/c1-19-13-15-22(16-14-19)34-28(37)24-11-7-8-12-26(24)31-29(34)38-18-27(36)32-30-17-25-20(2)33-35(21(25)3)23-9-5-4-6-10-23/h4-17H,18H2,1-3H3,(H,32,36)
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n/an/a 1.86E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM50737
PNG
(4-[(5Z)-4-keto-5-[(E)-2-methyl-3-phenyl-prop-2-eny...)
Show SMILES C\C(\C=C1/SC(=S)N(C1=O)c1ccc(cc1)C(O)=O)=C/c1ccccc1
Show InChI InChI=1S/C20H15NO3S2/c1-13(11-14-5-3-2-4-6-14)12-17-18(22)21(20(25)26-17)16-9-7-15(8-10-16)19(23)24/h2-12H,1H3,(H,23,24)/b13-11+,17-12-
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n/an/a 1.88E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80843
PNG
(2-Phenyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-...)
Show SMILES O=c1oc(nc2sc3CCCc3c12)-c1ccccc1
Show InChI InChI=1S/C15H11NO2S/c17-15-12-10-7-4-8-11(10)19-14(12)16-13(18-15)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
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n/an/a 1.95E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM47026
PNG
((Z)-2-methyl-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-...)
Show SMILES CC(CC\C=C(\C)C(O)=O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3
Show InChI InChI=1S/C30H46O3/c1-19(9-8-10-20(2)26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h10,19,21,24H,8-9,11-18H2,1-7H3,(H,32,33)/b20-10-/t19?,21-,24+,28-,29-,30+/m1/s1
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n/an/a 2.04E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80846
PNG
(2-[[3-(cyclohexylmethyl)-4-keto-quinazolin-2-yl]th...)
Show SMILES CCOC(=O)C(C)Sc1nc2ccccc2c(=O)n1CC1CCCCC1
Show InChI InChI=1S/C20H26N2O3S/c1-3-25-19(24)14(2)26-20-21-17-12-8-7-11-16(17)18(23)22(20)13-15-9-5-4-6-10-15/h7-8,11-12,14-15H,3-6,9-10,13H2,1-2H3
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n/an/a 2.05E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM58417
PNG
(2-[4-[3-(1,3-benzodioxol-5-yl)-5-(3-thienyl)isoxaz...)
Show SMILES OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1c(noc1-c1ccsc1)-c1ccc2OCOc2c1
Show InChI InChI=1S/C30H18N2O5S/c33-30(34)22-14-24(31-23-4-2-1-3-21(22)23)17-5-7-18(8-6-17)27-28(32-37-29(27)20-11-12-38-15-20)19-9-10-25-26(13-19)36-16-35-25/h1-15H,16H2,(H,33,34)
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n/an/a 2.26E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM57514
PNG
((6E)-5-azanylidene-6-[[1-(3,5-dimethylphenyl)-2,5-...)
Show SMILES CC(C)CC1=NN2C(S1)=NC(=O)\C(=C\c1cc(C)n(c1C)-c1cc(C)cc(C)c1)C2=N
Show InChI InChI=1S/C24H27N5OS/c1-13(2)7-21-27-29-22(25)20(23(30)26-24(29)31-21)12-18-11-16(5)28(17(18)6)19-9-14(3)8-15(4)10-19/h8-13,25H,7H2,1-6H3/b20-12+,25-22?
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n/an/a 2.30E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80862
PNG
(3,5-bis(chloranyl)-N-[[3-(trifluoromethyl)phenyl]m...)
Show SMILES FC(F)(F)c1cccc(CNC(=O)c2cc(Cl)cc(Cl)c2)c1
Show InChI InChI=1S/C15H10Cl2F3NO/c16-12-5-10(6-13(17)7-12)14(22)21-8-9-2-1-3-11(4-9)15(18,19)20/h1-7H,8H2,(H,21,22)
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n/an/a 2.38E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM54372
PNG
((5Z)-5-[(6-methoxy-2-piperidin-1-yl-quinolin-3-yl)...)
Show SMILES COc1ccc2nc(N3CCCCC3)c(C=C3SC(S)=NC3=O)cc2c1
Show InChI InChI=1S/C19H19N3O2S2/c1-24-14-5-6-15-12(10-14)9-13(11-16-18(23)21-19(25)26-16)17(20-15)22-7-3-2-4-8-22/h5-6,9-11H,2-4,7-8H2,1H3,(H,21,23,25)
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n/an/a 2.47E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80876
PNG
((4-Oxo-3-p-tolyl-3,4-dihydro-quinazolin-2-ylsulfan...)
Show SMILES Cc1ccc(cc1)-n1c(SCC(=O)N\N=C\C=C\c2ccccc2[N+]([O-])=O)nc2ccccc2c1=O
Show InChI InChI=1S/C26H21N5O4S/c1-18-12-14-20(15-13-18)30-25(33)21-9-3-4-10-22(21)28-26(30)36-17-24(32)29-27-16-6-8-19-7-2-5-11-23(19)31(34)35/h2-16H,17H2,1H3,(H,29,32)/b8-6+,27-16+
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n/an/a 2.53E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80944
PNG
(1-(7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-d]pyri...)
Show SMILES CC(C)(C)C(=O)CSc1ncnc2sc3CCCc3c12
Show InChI InChI=1S/C15H18N2OS2/c1-15(2,3)11(18)7-19-13-12-9-5-4-6-10(9)20-14(12)17-8-16-13/h8H,4-7H2,1-3H3
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n/an/a 2.59E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80864
PNG
((3,4-dihydro-2H-naphthalen-1-ylideneamino) 4-methy...)
Show SMILES Cc1ccc(cc1)C(=O)ON=C1CCCc2ccccc12
Show InChI InChI=1S/C18H17NO2/c1-13-9-11-15(12-10-13)18(20)21-19-17-8-4-6-14-5-2-3-7-16(14)17/h2-3,5,7,9-12H,4,6,8H2,1H3
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n/an/a 2.83E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM61018
PNG
((6Z)-5-azanylidene-6-[[4-[3-(2,6-dimethylphenoxy)p...)
Show SMILES COc1cc(\C=C2/C(=O)N=C3SC=CN3C2=N)ccc1OCCCOc1c(C)cccc1C
Show InChI InChI=1S/C25H25N3O4S/c1-16-6-4-7-17(2)22(16)32-12-5-11-31-20-9-8-18(15-21(20)30-3)14-19-23(26)28-10-13-33-25(28)27-24(19)29/h4,6-10,13-15,26H,5,11-12H2,1-3H3/b19-14-,26-23?
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n/an/a 3.11E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM57436
PNG
(1-[2-[(3,4-dichlorobenzyl)thio]ethyl]-3-phenyl-thi...)
Show SMILES Clc1ccc(CSCCNC(=S)Nc2ccccc2)cc1Cl
Show InChI InChI=1S/C16H16Cl2N2S2/c17-14-7-6-12(10-15(14)18)11-22-9-8-19-16(21)20-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H2,19,20,21)
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n/an/a 3.24E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM65601
PNG
(6-bromo-4-formyl-5-hydroxy-2-phenyl-3-benzofuranca...)
Show SMILES CCOC(=O)c1c(oc2cc(Br)c(O)c(C=O)c12)-c1ccccc1
Show InChI InChI=1S/C18H13BrO5/c1-2-23-18(22)15-14-11(9-20)16(21)12(19)8-13(14)24-17(15)10-6-4-3-5-7-10/h3-9,21H,2H2,1H3
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n/an/a 3.36E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80858
PNG
(3-(2-Chloro-phenyl)-4,5-dihydro-isoxazole-5-carbox...)
Show SMILES Clc1ccccc1C1=NOC(C1)C(=O)Nc1sc2CCCc2c1C#N
Show InChI InChI=1S/C18H14ClN3O2S/c19-13-6-2-1-4-11(13)14-8-15(24-22-14)17(23)21-18-12(9-20)10-5-3-7-16(10)25-18/h1-2,4,6,15H,3,5,7-8H2,(H,21,23)
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n/an/a 3.48E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM39704
PNG
((3-methyl-4-propan-2-yl-phenyl) thiophene-2-carbox...)
Show SMILES CC(C)c1ccc(OC(=O)c2cccs2)cc1C
Show InChI InChI=1S/C15H16O2S/c1-10(2)13-7-6-12(9-11(13)3)17-15(16)14-5-4-8-18-14/h4-10H,1-3H3
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n/an/a 3.74E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80871
PNG
(MLS000581956 | N-({[3-chloro-2-(1-piperidinyl)phen...)
Show SMILES CCC(=O)NC(=S)Nc1cccc(Cl)c1N1CCCCC1
Show InChI InChI=1S/C15H20ClN3OS/c1-2-13(20)18-15(21)17-12-8-6-7-11(16)14(12)19-9-4-3-5-10-19/h6-8H,2-5,9-10H2,1H3,(H2,17,18,20,21)
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n/an/a 3.78E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM72097
PNG
(1-(3-chlorobenzyl)-2-keto-6-(trifluoromethyl)nicot...)
Show SMILES NC(=O)c1ccc(n(Cc2cccc(Cl)c2)c1=O)C(F)(F)F
Show InChI InChI=1S/C14H10ClF3N2O2/c15-9-3-1-2-8(6-9)7-20-11(14(16,17)18)5-4-10(12(19)21)13(20)22/h1-6H,7H2,(H2,19,21)
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n/an/a 3.93E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM55427
PNG
(MLS000556371 | N-(3-Cyano-5,6-dihydro-4H-cyclopent...)
Show SMILES COc1ccc(cc1OC)-c1ccc(C#N)c(SCC(=O)Nc2sc3CCCc3c2C#N)n1
Show InChI InChI=1S/C24H20N4O3S2/c1-30-19-9-7-14(10-20(19)31-2)18-8-6-15(11-25)23(27-18)32-13-22(29)28-24-17(12-26)16-4-3-5-21(16)33-24/h6-10H,3-5,13H2,1-2H3,(H,28,29)
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n/an/a 4.06E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80844
PNG
(MLS000531839 | N-[2-(3,4-dihydro-1H-isoquinolin-2-...)
Show SMILES CCN(CC(=O)N1CCc2ccccc2C1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C23H24N2O3S/c1-2-25(17-23(26)24-14-13-19-8-4-6-10-21(19)16-24)29(27,28)22-12-11-18-7-3-5-9-20(18)15-22/h3-12,15H,2,13-14,16-17H2,1H3
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n/an/a 4.17E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80873
PNG
(MLS000572384 | N-(3,4-dichlorophenyl)-2-[4-keto-2-...)
Show SMILES Oc1nc(N=NCc2cccs2)sc1CC(=O)Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C16H12Cl2N4O2S2/c17-11-4-3-9(6-12(11)18)20-14(23)7-13-15(24)21-16(26-13)22-19-8-10-2-1-5-25-10/h1-6,24H,7-8H2,(H,20,23)
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n/an/a 4.25E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80833
PNG
(Hexanoic acid [2-(4-phenyl-piperazin-1-yl)-phenyl]...)
Show SMILES CCCCCC(=O)Nc1ccccc1N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C22H29N3O/c1-2-3-5-14-22(26)23-20-12-8-9-13-21(20)25-17-15-24(16-18-25)19-10-6-4-7-11-19/h4,6-13H,2-3,5,14-18H2,1H3,(H,23,26)
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n/an/a 4.38E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM58388
PNG
(((5E)-5-{5-bromo-2-[(4-chlorobenzyl)oxy]benzyliden...)
Show SMILES OC(=O)CN1C(=S)S\C(=C\c2cc(Br)ccc2OCc2ccc(Cl)cc2)C1=O
Show InChI InChI=1S/C19H13BrClNO4S2/c20-13-3-6-15(26-10-11-1-4-14(21)5-2-11)12(7-13)8-16-18(25)22(9-17(23)24)19(27)28-16/h1-8H,9-10H2,(H,23,24)/b16-8+
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n/an/a 4.68E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM42535
PNG
(2-(4-chlorophenyl)sulfanyl-N-(2-phenylphenyl)propa...)
Show SMILES CC(Sc1ccc(Cl)cc1)C(=O)Nc1ccccc1-c1ccccc1
Show InChI InChI=1S/C21H18ClNOS/c1-15(25-18-13-11-17(22)12-14-18)21(24)23-20-10-6-5-9-19(20)16-7-3-2-4-8-16/h2-15H,1H3,(H,23,24)
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n/an/a 4.74E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM68008
PNG
(3-[(4-bromobenzoyl)oxy]-2-(3,5-dimethoxyphenyl)qui...)
Show SMILES COc1cc(OC)cc(c1)-c1nc2ccccc2c(=O)n1OC(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C23H17BrN2O5/c1-29-17-11-15(12-18(13-17)30-2)21-25-20-6-4-3-5-19(20)22(27)26(21)31-23(28)14-7-9-16(24)10-8-14/h3-13H,1-2H3
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n/an/a 4.74E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80874
PNG
(1-[2-(4-tert-butylphenoxy)ethyl]-7-methyl-1H-indol...)
Show SMILES Cc1cccc2C(=O)C(=O)N(CCOc3ccc(cc3)C(C)(C)C)c12
Show InChI InChI=1S/C21H23NO3/c1-14-6-5-7-17-18(14)22(20(24)19(17)23)12-13-25-16-10-8-15(9-11-16)21(2,3)4/h5-11H,12-13H2,1-4H3
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n/an/a 4.75E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM57349
PNG
((3-Amino-6-isopropyl-thieno[2,3-b]quinolin-2-yl)-(...)
Show SMILES CC(C)c1ccc2nc3sc(C(=O)N4CCc5ccccc5C4)c(N)c3cc2c1
Show InChI InChI=1S/C24H23N3OS/c1-14(2)16-7-8-20-18(11-16)12-19-21(25)22(29-23(19)26-20)24(28)27-10-9-15-5-3-4-6-17(15)13-27/h3-8,11-12,14H,9-10,13,25H2,1-2H3
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n/an/a 4.83E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM49153
PNG
(MLS000530403 | N'-[1-(1,3-dioxo-2,3-dihydro-1H...)
Show SMILES CC(NNC(=O)c1cc2ccccc2cc1O)=C1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C22H16N2O4/c1-12(19-20(26)15-8-4-5-9-16(15)21(19)27)23-24-22(28)17-10-13-6-2-3-7-14(13)11-18(17)25/h2-11,23,25H,1H3,(H,24,28)
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n/an/a 4.87E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80900
PNG
(2-(2-Chloro-benzylsulfanyl)-3-ethyl-6,7,8,9-tetrah...)
Show SMILES CCn1c(SCc2ccccc2Cl)nc2nc3CCCCc3cc2c1=O
Show InChI InChI=1S/C20H20ClN3OS/c1-2-24-19(25)15-11-13-7-4-6-10-17(13)22-18(15)23-20(24)26-12-14-8-3-5-9-16(14)21/h3,5,8-9,11H,2,4,6-7,10,12H2,1H3
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n/an/a 4.98E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80897
PNG
(2-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methyl...)
Show SMILES CCOC(=O)c1c(C)c(C)sc1NC=C1C(=O)CC(C)(C)CC1=O
Show InChI InChI=1S/C18H23NO4S/c1-6-23-17(22)15-10(2)11(3)24-16(15)19-9-12-13(20)7-18(4,5)8-14(12)21/h9,19H,6-8H2,1-5H3
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n/an/a 5.12E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM80943
PNG
(2-[6-[(5E)-2-keto-5-p-anisylidene-4-thioxo-thiazol...)
Show SMILES COc1ccc(\C=C2\SC(=O)N(CCCCCC(=O)Nc3ccccc3C(O)=O)C2=S)cc1
Show InChI InChI=1S/C24H24N2O5S2/c1-31-17-12-10-16(11-13-17)15-20-22(32)26(24(30)33-20)14-6-2-3-9-21(27)25-19-8-5-4-7-18(19)23(28)29/h4-5,7-8,10-13,15H,2-3,6,9,14H2,1H3,(H,25,27)(H,28,29)/b20-15+
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n/an/a 5.25E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
Phospholipase A2


(Homo sapiens (Human))
BDBM54244
PNG
(Benzoic acid N'-(4-{5-[1-(2-chloro-phenyl)-met...)
Show SMILES Clc1ccccc1\C=C1/SC(=S)N(CCCC(=O)NNC(=O)c2ccccc2)C1=O
Show InChI InChI=1S/C21H18ClN3O3S2/c22-16-10-5-4-9-15(16)13-17-20(28)25(21(29)30-17)12-6-11-18(26)23-24-19(27)14-7-2-1-3-8-14/h1-5,7-10,13H,6,11-12H2,(H,23,26)(H,24,27)/b17-13-
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n/an/a 5.28E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair
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