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Compile Data Set for Download or QSAR

Found 91 hits with Last Name = 'ferro' and Initial = 'p'   
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 D2 receptor 2


(Homo sapiens (Human))
BDBM21599
PNG
(2-{5-chloro-1'-[(3-methyl-5-phenyl-1,2-oxazol-4-yl...)
Show SMILES Cc1noc(c1CN1CC2(CC1=O)C(=O)N(CC(O)=O)c1ccc(Cl)cc21)-c1ccccc1
Show InChI InChI=1S/C24H20ClN3O5/c1-14-17(22(33-26-14)15-5-3-2-4-6-15)11-27-13-24(10-20(27)29)18-9-16(25)7-8-19(18)28(23(24)32)12-21(30)31/h2-9H,10-13H2,1H3,(H,30,31)
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3.80n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385619
PNG
(CHEMBL2042237)
Show SMILES Cc1onc(c1CN1C(=O)NC2(C1=O)C(=O)N(CC(O)=O)c1ccc(Cl)cc21)-c1ccccc1
Show InChI InChI=1S/C23H17ClN4O6/c1-12-15(19(26-34-12)13-5-3-2-4-6-13)10-28-21(32)23(25-22(28)33)16-9-14(24)7-8-17(16)27(20(23)31)11-18(29)30/h2-9H,10-11H2,1H3,(H,25,33)(H,29,30)
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7n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM21611
PNG
(2-[(3S)-5-chloro-1'-[(5-chloro-2-fluorophenyl)meth...)
Show SMILES OC(=O)CN1C(=O)[C@]2(CN(Cc3cc(Cl)ccc3F)C(=O)C2)c2cc(Cl)ccc12 |r|
Show InChI InChI=1S/C20H15Cl2FN2O4/c21-12-1-3-15(23)11(5-12)8-24-10-20(7-17(24)26)14-6-13(22)2-4-16(14)25(19(20)29)9-18(27)28/h1-6H,7-10H2,(H,27,28)/t20-/m1/s1
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13n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385620
PNG
(CHEMBL2042238)
Show SMILES OC(=O)CN1C(=O)[C@@]2(NC(=O)N(Cc3cc(Cl)ccc3F)C2=O)c2cc(Cl)ccc12 |r|
Show InChI InChI=1S/C19H12Cl2FN3O5/c20-10-1-3-13(22)9(5-10)7-25-17(29)19(23-18(25)30)12-6-11(21)2-4-14(12)24(16(19)28)8-15(26)27/h1-6H,7-8H2,(H,23,30)(H,26,27)/t19-/m0/s1
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15n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385626
PNG
(CHEMBL2042378)
Show SMILES CN1C(=O)N(Cc2csc(n2)-c2ccccc2)C(=O)C11C(=O)N(CC(O)=O)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H17ClN4O5S/c1-26-22(33)28(10-15-12-34-19(25-15)13-5-3-2-4-6-13)21(32)23(26)16-9-14(24)7-8-17(16)27(20(23)31)11-18(29)30/h2-9,12H,10-11H2,1H3,(H,29,30)
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16n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385618
PNG
(CHEMBL2042236)
Show SMILES OC(=O)CN1C(=O)C2(NC(=O)N(Cc3cc(Cl)ccc3F)C2=O)c2cc(Cl)ccc12
Show InChI InChI=1S/C19H12Cl2FN3O5/c20-10-1-3-13(22)9(5-10)7-25-17(29)19(23-18(25)30)12-6-11(21)2-4-14(12)24(16(19)28)8-15(26)27/h1-6H,7-8H2,(H,23,30)(H,26,27)
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28n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385616
PNG
(CHEMBL2042239)
Show SMILES CN1C(=O)N(Cc2cc(Cl)ccc2F)C(=O)[C@]11C(=O)N(CC(O)=O)c2ccc(Cl)cc12 |r|
Show InChI InChI=1S/C20H14Cl2FN3O5/c1-24-19(31)26(8-10-6-11(21)2-4-14(10)23)18(30)20(24)13-7-12(22)3-5-15(13)25(17(20)29)9-16(27)28/h2-7H,8-9H2,1H3,(H,27,28)/t20-/m0/s1
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35n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385624
PNG
(CHEMBL2042243)
Show SMILES CN1C(=O)N(Cc2cn(nc2-c2ccccc2)-c2ccccc2)C(=O)C11C(=O)N(CC(O)=O)c2ccc(Cl)cc12
Show InChI InChI=1S/C29H22ClN5O5/c1-32-28(40)34(27(39)29(32)22-14-20(30)12-13-23(22)33(26(29)38)17-24(36)37)15-19-16-35(21-10-6-3-7-11-21)31-25(19)18-8-4-2-5-9-18/h2-14,16H,15,17H2,1H3,(H,36,37)
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96n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385625
PNG
(CHEMBL2042244)
Show SMILES CN1C(=O)N(Cc2c(C)onc2-c2ccccc2)C(=O)C11C(=O)N(CC(O)=O)c2ccc(Cl)cc12
Show InChI InChI=1S/C24H19ClN4O6/c1-13-16(20(26-35-13)14-6-4-3-5-7-14)11-29-22(33)24(27(2)23(29)34)17-10-15(25)8-9-18(17)28(21(24)32)12-19(30)31/h3-10H,11-12H2,1-2H3,(H,30,31)
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110n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385622
PNG
(CHEMBL2042241)
Show SMILES CCCN1C(=O)N(Cc2cc(Cl)ccc2F)C(=O)[C@]11C(=O)N(CC(O)=O)c2ccc(Cl)cc12 |r|
Show InChI InChI=1S/C22H18Cl2FN3O5/c1-2-7-28-21(33)27(10-12-8-13(23)3-5-16(12)25)20(32)22(28)15-9-14(24)4-6-17(15)26(19(22)31)11-18(29)30/h3-6,8-9H,2,7,10-11H2,1H3,(H,29,30)/t22-/m0/s1
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110n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385621
PNG
(CHEMBL2042240)
Show SMILES CCN1C(=O)N(Cc2cc(Cl)ccc2F)C(=O)[C@]11C(=O)N(CC(O)=O)c2ccc(Cl)cc12 |r|
Show InChI InChI=1S/C21H16Cl2FN3O5/c1-2-27-20(32)26(9-11-7-12(22)3-5-15(11)24)19(31)21(27)14-8-13(23)4-6-16(14)25(18(21)30)10-17(28)29/h3-8H,2,9-10H2,1H3,(H,28,29)/t21-/m0/s1
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260n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385628
PNG
(CHEMBL2042380)
Show SMILES COc1c(C)cnc(CN2C(=O)N(C)C3(C2=O)C(=O)N(CC(O)=O)c2ccc(Cl)cc32)c1C
Show InChI InChI=1S/C22H21ClN4O6/c1-11-8-24-15(12(2)18(11)33-4)9-27-20(31)22(25(3)21(27)32)14-7-13(23)5-6-16(14)26(19(22)30)10-17(28)29/h5-8H,9-10H2,1-4H3,(H,28,29)
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280n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385629
PNG
(CHEMBL2042381)
Show SMILES CN1C(=O)N(Cc2cc(F)ccc2F)C(=O)C11C(=O)N(CC(O)=O)c2ccc(Cl)cc12
Show InChI InChI=1S/C20H14ClF2N3O5/c1-24-19(31)26(8-10-6-12(22)3-4-14(10)23)18(30)20(24)13-7-11(21)2-5-15(13)25(17(20)29)9-16(27)28/h2-7H,8-9H2,1H3,(H,27,28)
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390n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385617
PNG
(CHEMBL2042235)
Show SMILES OC(=O)CN1C(=O)C2(NC(=O)N(Cc3ccccc3F)C2=O)c2cc(Cl)ccc12
Show InChI InChI=1S/C19H13ClFN3O5/c20-11-5-6-14-12(7-11)19(16(27)23(14)9-15(25)26)17(28)24(18(29)22-19)8-10-3-1-2-4-13(10)21/h1-7H,8-9H2,(H,22,29)(H,25,26)
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390n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385623
PNG
(CHEMBL2042242)
Show SMILES CC(C)c1nc(CN2C(=O)N(C)C3(C2=O)C(=O)N(CC(O)=O)c2ccc(Cl)cc32)cs1
Show InChI InChI=1S/C20H19ClN4O5S/c1-10(2)16-22-12(9-31-16)7-25-18(29)20(23(3)19(25)30)13-6-11(21)4-5-14(13)24(17(20)28)8-15(26)27/h4-6,9-10H,7-8H2,1-3H3,(H,26,27)
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490n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385627
PNG
(CHEMBL2042379)
Show SMILES CN1C(=O)N(Cc2nc3ccccc3s2)C(=O)C11C(=O)N(CC(O)=O)c2ccc(Cl)cc12
Show InChI InChI=1S/C21H15ClN4O5S/c1-24-20(31)26(9-16-23-13-4-2-3-5-15(13)32-16)19(30)21(24)12-8-11(22)6-7-14(12)25(18(21)29)10-17(27)28/h2-8H,9-10H2,1H3,(H,27,28)
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750n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM21600
PNG
(2-{5-chloro-1'-[(5-methyl-3-phenyl-1,2-oxazol-4-yl...)
Show SMILES Cc1onc(c1CN1CCC2(C1=O)C(=O)N(CC(O)=O)c1ccc(Cl)cc21)-c1ccccc1
Show InChI InChI=1S/C24H20ClN3O5/c1-14-17(21(26-33-14)15-5-3-2-4-6-15)12-27-10-9-24(22(27)31)18-11-16(25)7-8-19(18)28(23(24)32)13-20(29)30/h2-8,11H,9-10,12-13H2,1H3,(H,29,30)
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2.20E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from human CRTH2 receptor expressed in CHO cells after 90 mins by scintillation proximity assay


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385620
PNG
(CHEMBL2042238)
Show SMILES OC(=O)CN1C(=O)[C@@]2(NC(=O)N(Cc3cc(Cl)ccc3F)C2=O)c2cc(Cl)ccc12 |r|
Show InChI InChI=1S/C19H12Cl2FN3O5/c20-10-1-3-13(22)9(5-10)7-25-17(29)19(23-18(25)30)12-6-11(21)2-4-14(12)24(16(19)28)8-15(26)27/h1-6H,7-8H2,(H,23,30)(H,26,27)/t19-/m0/s1
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n/an/a 7.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at CRTH2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil chemotaxis


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086479
PNG
(4-Chloro-benzoic acid N'-p-tolyl-hydrazide | CHEMB...)
Show SMILES Cc1ccc(NNC(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C14H13ClN2O/c1-10-2-8-13(9-3-10)16-17-14(18)11-4-6-12(15)7-5-11/h2-9,16H,1H3,(H,17,18)
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n/an/a 10n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385616
PNG
(CHEMBL2042239)
Show SMILES CN1C(=O)N(Cc2cc(Cl)ccc2F)C(=O)[C@]11C(=O)N(CC(O)=O)c2ccc(Cl)cc12 |r|
Show InChI InChI=1S/C20H14Cl2FN3O5/c1-24-19(31)26(8-10-6-11(21)2-4-14(10)23)18(30)20(24)13-7-12(22)3-5-15(13)25(17(20)29)9-16(27)28/h2-7H,8-9H2,1H3,(H,27,28)/t20-/m0/s1
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n/an/a 47n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at CRTH2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil chemotaxis


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM21611
PNG
(2-[(3S)-5-chloro-1'-[(5-chloro-2-fluorophenyl)meth...)
Show SMILES OC(=O)CN1C(=O)[C@]2(CN(Cc3cc(Cl)ccc3F)C(=O)C2)c2cc(Cl)ccc12 |r|
Show InChI InChI=1S/C20H15Cl2FN2O4/c21-12-1-3-15(23)11(5-12)8-24-10-20(7-17(24)26)14-6-13(22)2-4-16(14)25(19(20)29)9-18(27)28/h1-6H,7-10H2,(H,27,28)/t20-/m1/s1
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n/an/a 62n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at CRTH2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil chemotaxis


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385620
PNG
(CHEMBL2042238)
Show SMILES OC(=O)CN1C(=O)[C@@]2(NC(=O)N(Cc3cc(Cl)ccc3F)C2=O)c2cc(Cl)ccc12 |r|
Show InChI InChI=1S/C19H12Cl2FN3O5/c20-10-1-3-13(22)9(5-10)7-25-17(29)19(23-18(25)30)12-6-11(21)2-4-14(12)24(16(19)28)8-15(26)27/h1-6H,7-8H2,(H,23,30)(H,26,27)/t19-/m0/s1
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n/an/a 69n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at CRTH2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change pretreated for 20 mins meas...


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50086492
PNG
(1,3-Diphenyl-1,4,5,6,7,8-hexahydro-cycloheptapyraz...)
Show SMILES C1CCc2c(CC1)n(nc2-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C20H20N2/c1-4-10-16(11-5-1)20-18-14-8-3-9-15-19(18)22(21-20)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2
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n/an/a 120n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 1 in platelet-rich plasma measured by the presence of thromboxane A2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086500
PNG
(4-Chloro-benzoic acid N'-(4-methoxy-phenyl)-hydraz...)
Show SMILES COc1ccc(NNC(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C14H13ClN2O2/c1-19-13-8-6-12(7-9-13)16-17-14(18)10-2-4-11(15)5-3-10/h2-9,16H,1H3,(H,17,18)
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n/an/a 130n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086498
PNG
(3-(4-Chloro-phenyl)-1-phenyl-1,4,5,6,7,8-hexahydro...)
Show SMILES Clc1ccc(cc1)-c1nn(c2CCCCCc12)-c1ccccc1
Show InChI InChI=1S/C20H19ClN2/c21-16-13-11-15(12-14-16)20-18-9-5-2-6-10-19(18)23(22-20)17-7-3-1-4-8-17/h1,3-4,7-8,11-14H,2,5-6,9-10H2
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n/an/a 140n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385616
PNG
(CHEMBL2042239)
Show SMILES CN1C(=O)N(Cc2cc(Cl)ccc2F)C(=O)[C@]11C(=O)N(CC(O)=O)c2ccc(Cl)cc12 |r|
Show InChI InChI=1S/C20H14Cl2FN3O5/c1-24-19(31)26(8-10-6-11(21)2-4-14(10)23)18(30)20(24)13-7-12(22)3-5-15(13)25(17(20)29)9-16(27)28/h2-7H,8-9H2,1H3,(H,27,28)/t20-/m0/s1
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n/an/a 150n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at CRTH2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change pretreated for 20 mins meas...


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Homo sapiens (Human))
BDBM50385616
PNG
(CHEMBL2042239)
Show SMILES CN1C(=O)N(Cc2cc(Cl)ccc2F)C(=O)[C@]11C(=O)N(CC(O)=O)c2ccc(Cl)cc12 |r|
Show InChI InChI=1S/C20H14Cl2FN3O5/c1-24-19(31)26(8-10-6-11(21)2-4-14(10)23)18(30)20(24)13-7-12(22)3-5-15(13)25(17(20)29)9-16(27)28/h2-7H,8-9H2,1H3,(H,27,28)/t20-/m0/s1
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n/an/a 150n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086492
PNG
(1,3-Diphenyl-1,4,5,6,7,8-hexahydro-cycloheptapyraz...)
Show SMILES C1CCc2c(CC1)n(nc2-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C20H20N2/c1-4-10-16(11-5-1)20-18-14-8-3-9-15-19(18)22(21-20)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2
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n/an/a 170n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086487
PNG
(Benzoic acid N'-(4-methoxy-phenyl)-hydrazide | CHE...)
Show SMILES COc1ccc(NNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C14H14N2O2/c1-18-13-9-7-12(8-10-13)15-16-14(17)11-5-3-2-4-6-11/h2-10,15H,1H3,(H,16,17)
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n/an/a 180n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086476
PNG
(4-Chloro-benzoic acid N'-phenyl-hydrazide | CHEMBL...)
Show SMILES Clc1ccc(cc1)C(=O)NNc1ccccc1
Show InChI InChI=1S/C13H11ClN2O/c14-11-8-6-10(7-9-11)13(17)16-15-12-4-2-1-3-5-12/h1-9,15H,(H,16,17)
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n/an/a 330n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086481
PNG
(Benzoic acid N'-p-tolyl-hydrazide | CHEMBL157950)
Show SMILES Cc1ccc(NNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C14H14N2O/c1-11-7-9-13(10-8-11)15-16-14(17)12-5-3-2-4-6-12/h2-10,15H,1H3,(H,16,17)
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n/an/a 330n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086488
PNG
(4-Chloro-benzoic acid N'-(4-chloro-phenyl)-hydrazi...)
Show SMILES Clc1ccc(NNC(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C13H10Cl2N2O/c14-10-3-1-9(2-4-10)13(18)17-16-12-7-5-11(15)6-8-12/h1-8,16H,(H,17,18)
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n/an/a 340n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086478
PNG
(3-(4-Chloro-phenyl)-1-(4-methoxy-phenyl)-4,5,6,7-t...)
Show SMILES COc1ccc(cc1)-n1nc(c2CC(O)CCc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C20H19ClN2O2/c1-25-17-9-6-15(7-10-17)23-19-11-8-16(24)12-18(19)20(22-23)13-2-4-14(21)5-3-13/h2-7,9-10,16,24H,8,11-12H2,1H3
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n/an/a 460n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086496
PNG
(4-Methoxy-benzoic acid N'-(4-chloro-phenyl)-hydraz...)
Show SMILES COc1ccc(cc1)C(=O)NNc1ccc(Cl)cc1
Show InChI InChI=1S/C14H13ClN2O2/c1-19-13-8-2-10(3-9-13)14(18)17-16-12-6-4-11(15)5-7-12/h2-9,16H,1H3,(H,17,18)
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n/an/a 470n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50086484
PNG
(1,3-Diphenyl-4,5,6,7-tetrahydro-1H-indazole | CHEM...)
Show SMILES C1CCc2c(C1)c(nn2-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C19H18N2/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)21(20-19)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2
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n/an/a 490n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 1 in platelet-rich plasma measured by the presence of thromboxane A2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086489
PNG
(Benzoic acid N'-(4-chloro-phenyl)-hydrazide | CHEM...)
Show SMILES Clc1ccc(NNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C13H11ClN2O/c14-11-6-8-12(9-7-11)15-16-13(17)10-4-2-1-3-5-10/h1-9,15H,(H,16,17)
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n/an/a 530n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086484
PNG
(1,3-Diphenyl-4,5,6,7-tetrahydro-1H-indazole | CHEM...)
Show SMILES C1CCc2c(C1)c(nn2-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C19H18N2/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)21(20-19)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2
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n/an/a 570n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086485
PNG
(3-(4-Chloro-phenyl)-1-phenyl-4,5,6,7-tetrahydro-1H...)
Show SMILES Clc1ccc(cc1)-c1nn(c2CCCCc12)-c1ccccc1
Show InChI InChI=1S/C19H17ClN2/c20-15-12-10-14(11-13-15)19-17-8-4-5-9-18(17)22(21-19)16-6-2-1-3-7-16/h1-3,6-7,10-13H,4-5,8-9H2
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n/an/a 620n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086480
PNG
(3-(4-Chloro-phenyl)-1-p-tolyl-1,4,5,6,7,8-hexahydr...)
Show SMILES Cc1ccc(cc1)-n1nc(c2CCCCCc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C21H21ClN2/c1-15-7-13-18(14-8-15)24-20-6-4-2-3-5-19(20)21(23-24)16-9-11-17(22)12-10-16/h7-14H,2-6H2,1H3
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n/an/a 640n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50086498
PNG
(3-(4-Chloro-phenyl)-1-phenyl-1,4,5,6,7,8-hexahydro...)
Show SMILES Clc1ccc(cc1)-c1nn(c2CCCCCc12)-c1ccccc1
Show InChI InChI=1S/C20H19ClN2/c21-16-13-11-15(12-14-16)20-18-9-5-2-6-10-19(18)23(22-20)17-7-3-1-4-8-17/h1,3-4,7-8,11-14H,2,5-6,9-10H2
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n/an/a 1.00E+3n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 1 in platelet-rich plasma measured by the presence of thromboxane A2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086494
PNG
(3-(4-Methoxy-phenyl)-1-phenyl-1,4,5,6,7,8-hexahydr...)
Show SMILES COc1ccc(cc1)-c1nn(c2CCCCCc12)-c1ccccc1
Show InChI InChI=1S/C21H22N2O/c1-24-18-14-12-16(13-15-18)21-19-10-6-3-7-11-20(19)23(22-21)17-8-4-2-5-9-17/h2,4-5,8-9,12-15H,3,6-7,10-11H2,1H3
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n/an/a 1.24E+3n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086495
PNG
(3-(4-Chloro-phenyl)-1-(4-methoxy-phenyl)-1,4,5,6,7...)
Show SMILES COc1ccc(cc1)-n1nc(c2CCCCCc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C21H21ClN2O/c1-25-18-13-11-17(12-14-18)24-20-6-4-2-3-5-19(20)21(23-24)15-7-9-16(22)10-8-15/h7-14H,2-6H2,1H3
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n/an/a 1.56E+3n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM21611
PNG
(2-[(3S)-5-chloro-1'-[(5-chloro-2-fluorophenyl)meth...)
Show SMILES OC(=O)CN1C(=O)[C@]2(CN(Cc3cc(Cl)ccc3F)C(=O)C2)c2cc(Cl)ccc12 |r|
Show InChI InChI=1S/C20H15Cl2FN2O4/c21-12-1-3-15(23)11(5-12)8-24-10-20(7-17(24)26)14-6-13(22)2-4-16(14)25(19(20)29)9-18(27)28/h1-6H,7-10H2,(H,27,28)/t20-/m1/s1
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n/an/a 1.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at CRTH2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change pretreated for 20 mins meas...


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086497
PNG
(3-(4-Chloro-phenyl)-5-fluoro-1-(4-methoxy-phenyl)-...)
Show SMILES COc1ccc(cc1)-n1nc(c2CC(F)CCc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C20H18ClFN2O/c1-25-17-9-7-16(8-10-17)24-19-11-6-15(22)12-18(19)20(23-24)13-2-4-14(21)5-3-13/h2-5,7-10,15H,6,11-12H2,1H3
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n/an/a 2.10E+3n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086490
PNG
(CHEMBL346697 | N-[3-(4-Chloro-phenyl)-1-(4-methoxy...)
Show SMILES COc1ccc(cc1)-n1nc(c2CC(CCc12)N(O)C(C)=O)-c1ccc(Cl)cc1
Show InChI InChI=1S/C22H22ClN3O3/c1-14(27)26(28)18-9-12-21-20(13-18)22(15-3-5-16(23)6-4-15)24-25(21)17-7-10-19(29-2)11-8-17/h3-8,10-11,18,28H,9,12-13H2,1-2H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086472
PNG
(3-(4-Chloro-phenyl)-1-phenyl-1,4,5,6-tetrahydro-cy...)
Show SMILES Clc1ccc(cc1)-c1nn(c2CCCc12)-c1ccccc1
Show InChI InChI=1S/C18H15ClN2/c19-14-11-9-13(10-12-14)18-16-7-4-8-17(16)21(20-18)15-5-2-1-3-6-15/h1-3,5-6,9-12H,4,7-8H2
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n/an/a 2.59E+3n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50385626
PNG
(CHEMBL2042378)
Show SMILES CN1C(=O)N(Cc2csc(n2)-c2ccccc2)C(=O)C11C(=O)N(CC(O)=O)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H17ClN4O5S/c1-26-22(33)28(10-15-12-34-19(25-15)13-5-3-2-4-6-13)21(32)23(26)16-9-14(24)7-8-17(16)27(20(23)31)11-18(29)30/h2-9,12H,10-11H2,1H3,(H,29,30)
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n/an/a 3.94E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at CRTH2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change pretreated for 20 mins meas...


ACS Med Chem Lett 2: 644-649 (2011)


Article DOI: 10.1021/ml2001196
BindingDB Entry DOI: 10.7270/Q28916X5
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50086486
PNG
(1,3-Diphenyl-1,4,5,6-tetrahydro-cyclopentapyrazole...)
Show SMILES C1Cc2c(C1)n(nc2-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C18H16N2/c1-3-8-14(9-4-1)18-16-12-7-13-17(16)20(19-18)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
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n/an/a 6.20E+3n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 2 in ECV-304 cells measured by the presence of PGE-2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50086489
PNG
(Benzoic acid N'-(4-chloro-phenyl)-hydrazide | CHEM...)
Show SMILES Clc1ccc(NNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C13H11ClN2O/c14-11-6-8-12(9-7-11)15-16-13(17)10-4-2-1-3-5-10/h1-9,15H,(H,16,17)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 1 in platelet-rich plasma measured by the presence of thromboxane A2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50086483
PNG
(3-(4-Fluoro-phenyl)-1-(4-methanesulfonyl-phenyl)-4...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-n1nc(c2CCCCc12)-c1ccc(F)cc1
Show InChI InChI=1S/C20H19FN2O2S/c1-26(24,25)17-12-10-16(11-13-17)23-19-5-3-2-4-18(19)20(22-23)14-6-8-15(21)9-7-14/h6-13H,2-5H2,1H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



The R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human prostaglandin G/H synthase 1 in platelet-rich plasma measured by the presence of thromboxane A2


Bioorg Med Chem Lett 10: 601-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TH8KWZ
More data for this
Ligand-Target Pair
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