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PubMed code 27837994

Compile data set for download or QSAR
Found 30 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
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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PubMed
n/an/a 880n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235313
PNG
(CHEMBL4074825)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C21H20ClN3O2/c1-14-19(23-18-8-7-15(22)13-17(18)20(14)26)21(27)25-11-9-24(10-12-25)16-5-3-2-4-6-16/h2-8,13H,9-12H2,1H3,(H,23,26)
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n/an/a 1.13E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235315
PNG
(CHEMBL4069774)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCc1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H15ClN4O2/c1-10-17(24-13-7-6-11(20)8-12(13)18(10)25)19(26)21-9-16-22-14-4-2-3-5-15(14)23-16/h2-8H,9H2,1H3,(H,21,26)(H,22,23)(H,24,25)
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n/an/a 1.21E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against almonds Beta-glucosidase


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235320
PNG
(CHEMBL4087573)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NC1CCCCC1
Show InChI InChI=1S/C17H19ClN2O2/c1-10-15(17(22)19-12-5-3-2-4-6-12)20-14-8-7-11(18)9-13(14)16(10)21/h7-9,12H,2-6H2,1H3,(H,19,22)(H,20,21)
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n/an/a 1.41E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against Escherichia coli beta galactosidase


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235317
PNG
(CHEMBL4080473)
Show SMILES CN(C)c1ccc(CCNC(=O)c2nc3ccc(Cl)cc3c(O)c2C)cc1
Show InChI InChI=1S/C21H22ClN3O2/c1-13-19(24-18-9-6-15(22)12-17(18)20(13)26)21(27)23-11-10-14-4-7-16(8-5-14)25(2)3/h4-9,12H,10-11H2,1-3H3,(H,23,27)(H,24,26)
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n/an/a 1.67E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235314
PNG
(CHEMBL4103022)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCCc1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C23H24ClN3O2/c1-15-21(26-20-9-6-17(24)14-19(20)22(15)28)23(29)25-11-10-16-4-7-18(8-5-16)27-12-2-3-13-27/h4-9,14H,2-3,10-13H2,1H3,(H,25,29)(H,26,28)
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n/an/a 1.69E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235309
PNG
(CHEMBL4096972)
Show SMILES CN(C(=O)c1nc2ccc(Cl)cc2c(O)c1C)c1ccccc1
Show InChI InChI=1S/C18H15ClN2O2/c1-11-16(18(23)21(2)13-6-4-3-5-7-13)20-15-9-8-12(19)10-14(15)17(11)22/h3-10H,1-2H3,(H,20,22)
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n/an/a 1.74E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235311
PNG
(CHEMBL4095272)
Show SMILES CCOC(=O)C(Cc1ccccc1)NC(=O)c1nc2ccc(Cl)cc2c(O)c1C
Show InChI InChI=1S/C22H21ClN2O4/c1-3-29-22(28)18(11-14-7-5-4-6-8-14)25-21(27)19-13(2)20(26)16-12-15(23)9-10-17(16)24-19/h4-10,12,18H,3,11H2,1-2H3,(H,24,26)(H,25,27)
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n/an/a 1.91E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235308
PNG
(CHEMBL4089272)
Show SMILES CC1CCCN1c1ccc(CCNC(=O)c2nc3ccc(Cl)cc3c(O)c2C)cc1
Show InChI InChI=1S/C24H26ClN3O2/c1-15-4-3-13-28(15)19-8-5-17(6-9-19)11-12-26-24(30)22-16(2)23(29)20-14-18(25)7-10-21(20)27-22/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,26,30)(H,27,29)
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n/an/a 1.91E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235310
PNG
(CHEMBL4099420)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H26ClN3O2/c1-16-22(27-21-10-7-18(25)15-20(21)23(16)29)24(30)26-12-11-17-5-8-19(9-6-17)28-13-3-2-4-14-28/h5-10,15H,2-4,11-14H2,1H3,(H,26,30)(H,27,29)
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n/an/a 2.11E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235307
PNG
(CHEMBL4061105)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCCc1ccccc1
Show InChI InChI=1S/C19H17ClN2O2/c1-12-17(19(24)21-10-9-13-5-3-2-4-6-13)22-16-8-7-14(20)11-15(16)18(12)23/h2-8,11H,9-10H2,1H3,(H,21,24)(H,22,23)
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n/an/a 2.54E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235321
PNG
(CHEMBL4066211)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NC(CO)Cc1ccccc1
Show InChI InChI=1S/C20H19ClN2O3/c1-12-18(23-17-8-7-14(21)10-16(17)19(12)25)20(26)22-15(11-24)9-13-5-3-2-4-6-13/h2-8,10,15,24H,9,11H2,1H3,(H,22,26)(H,23,25)
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n/an/a 2.78E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against Escherichia coli beta galactosidase


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235319
PNG
(CHEMBL4066899)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCNCC1
Show InChI InChI=1S/C15H16ClN3O2/c1-9-13(15(21)19-6-4-17-5-7-19)18-12-3-2-10(16)8-11(12)14(9)20/h2-3,8,17H,4-7H2,1H3,(H,18,20)
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n/an/a 2.81E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235316
PNG
(CHEMBL4104705)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCCCC1
Show InChI InChI=1S/C16H17ClN2O2/c1-10-14(16(21)19-7-3-2-4-8-19)18-13-6-5-11(17)9-12(13)15(10)20/h5-6,9H,2-4,7-8H2,1H3,(H,18,20)
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n/an/a 3.14E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2


(Homo sapiens (Human))
BDBM50235318
PNG
(CHEMBL4076205)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NC1CCCN(Cc2ccccc2)C1
Show InChI InChI=1S/C23H24ClN3O2/c1-15-21(26-20-10-9-17(24)12-19(20)22(15)28)23(29)25-18-8-5-11-27(14-18)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,18H,5,8,11,13-14H2,1H3,(H,25,29)(H,26,28)
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n/an/a 3.54E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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n/an/a 7.32E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235314
PNG
(CHEMBL4103022)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCCc1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C23H24ClN3O2/c1-15-21(26-20-9-6-17(24)14-19(20)22(15)28)23(29)25-11-10-16-4-7-18(8-5-16)27-12-2-3-13-27/h4-9,14H,2-3,10-13H2,1H3,(H,25,29)(H,26,28)
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n/an/a 7.50E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235320
PNG
(CHEMBL4087573)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NC1CCCCC1
Show InChI InChI=1S/C17H19ClN2O2/c1-10-15(17(22)19-12-5-3-2-4-6-12)20-14-8-7-11(18)9-13(14)16(10)21/h7-9,12H,2-6H2,1H3,(H,19,22)(H,20,21)
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n/an/a 7.80E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235315
PNG
(CHEMBL4069774)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCc1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H15ClN4O2/c1-10-17(24-13-7-6-11(20)8-12(13)18(10)25)19(26)21-9-16-22-14-4-2-3-5-15(14)23-16/h2-8H,9H2,1H3,(H,21,26)(H,22,23)(H,24,25)
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n/an/a 7.90E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235309
PNG
(CHEMBL4096972)
Show SMILES CN(C(=O)c1nc2ccc(Cl)cc2c(O)c1C)c1ccccc1
Show InChI InChI=1S/C18H15ClN2O2/c1-11-16(18(23)21(2)13-6-4-3-5-7-13)20-15-9-8-12(19)10-14(15)17(11)22/h3-10H,1-2H3,(H,20,22)
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n/an/a 8.30E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against almonds Beta-glucosidase


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235317
PNG
(CHEMBL4080473)
Show SMILES CN(C)c1ccc(CCNC(=O)c2nc3ccc(Cl)cc3c(O)c2C)cc1
Show InChI InChI=1S/C21H22ClN3O2/c1-13-19(24-18-9-6-15(22)12-17(18)20(13)26)21(27)23-11-10-14-4-7-16(8-5-14)25(2)3/h4-9,12H,10-11H2,1-3H3,(H,23,27)(H,24,26)
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n/an/a 8.30E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235313
PNG
(CHEMBL4074825)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C21H20ClN3O2/c1-14-19(23-18-8-7-15(22)13-17(18)20(14)26)21(27)25-11-9-24(10-12-25)16-5-3-2-4-6-16/h2-8,13H,9-12H2,1H3,(H,23,26)
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n/an/a 8.60E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235311
PNG
(CHEMBL4095272)
Show SMILES CCOC(=O)C(Cc1ccccc1)NC(=O)c1nc2ccc(Cl)cc2c(O)c1C
Show InChI InChI=1S/C22H21ClN2O4/c1-3-29-22(28)18(11-14-7-5-4-6-8-14)25-21(27)19-13(2)20(26)16-12-15(23)9-10-17(16)24-19/h4-10,12,18H,3,11H2,1-2H3,(H,24,26)(H,25,27)
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n/an/a 9.60E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235308
PNG
(CHEMBL4089272)
Show SMILES CC1CCCN1c1ccc(CCNC(=O)c2nc3ccc(Cl)cc3c(O)c2C)cc1
Show InChI InChI=1S/C24H26ClN3O2/c1-15-4-3-13-28(15)19-8-5-17(6-9-19)11-12-26-24(30)22-16(2)23(29)20-14-18(25)7-10-21(20)27-22/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,26,30)(H,27,29)
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n/an/a 9.80E+3n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against bovine liver beta galactosidase


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235310
PNG
(CHEMBL4099420)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H26ClN3O2/c1-16-22(27-21-10-7-18(25)15-20(21)23(16)29)24(30)26-12-11-17-5-8-19(9-6-17)28-13-3-2-4-14-28/h5-10,15H,2-4,11-14H2,1H3,(H,26,30)(H,27,29)
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n/an/a 1.04E+4n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235319
PNG
(CHEMBL4066899)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCNCC1
Show InChI InChI=1S/C15H16ClN3O2/c1-9-13(15(21)19-6-4-17-5-7-19)18-12-3-2-10(16)8-11(12)14(9)20/h2-3,8,17H,4-7H2,1H3,(H,18,20)
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n/an/a 1.07E+4n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against almonds Beta-glucosidase


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235321
PNG
(CHEMBL4066211)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NC(CO)Cc1ccccc1
Show InChI InChI=1S/C20H19ClN2O3/c1-12-18(23-17-8-7-14(21)10-16(17)19(12)25)20(26)22-15(11-24)9-13-5-3-2-4-6-13/h2-8,10,15,24H,9,11H2,1H3,(H,22,26)(H,23,25)
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n/an/a 1.14E+4n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235307
PNG
(CHEMBL4061105)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NCCc1ccccc1
Show InChI InChI=1S/C19H17ClN2O2/c1-12-17(19(24)21-10-9-13-5-3-2-4-6-13)22-16-8-7-14(20)11-15(16)18(12)23/h2-8,11H,9-10H2,1H3,(H,21,24)(H,22,23)
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n/an/a 1.14E+4n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235316
PNG
(CHEMBL4104705)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCCCC1
Show InChI InChI=1S/C16H17ClN2O2/c1-10-14(16(21)19-7-3-2-4-8-19)18-13-6-5-11(17)9-12(13)15(10)20/h5-6,9H,2-4,7-8H2,1H3,(H,18,20)
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n/an/a 1.24E+4n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against Escherichia coli Alpha-galactosidase


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM50235318
PNG
(CHEMBL4076205)
Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)NC1CCCN(Cc2ccccc2)C1
Show InChI InChI=1S/C23H24ClN3O2/c1-15-21(26-20-10-9-17(24)12-19(20)22(15)28)23(29)25-18-8-5-11-27(14-18)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,18H,5,8,11,13-14H2,1H3,(H,25,29)(H,26,28)
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n/an/a 1.31E+4n/an/an/an/an/an/a



Al-Azhar University

Curated by ChEMBL


Assay Description
Inhibition of ovine COX1 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by substrate a...


Eur J Med Chem 127: 972-985 (2017)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%