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PubMed code 23688698

Compile data set for download or QSAR
Found 68 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
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50188619
PNG
(1-(2-(p-toluidino)-5-nitrophenylsulfonyl)-3-tert-b...)
Show SMILES Cc1ccc(Nc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)[N+]([O-])=O)cc1
Show InChI InChI=1S/C18H22N4O5S/c1-12-5-7-13(8-6-12)19-15-10-9-14(22(24)25)11-16(15)28(26,27)21-17(23)20-18(2,3)4/h5-11,19H,1-4H3,(H2,20,21,23)
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n/an/a 620n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436779
PNG
(CHEMBL2402427)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(C)cc1)C#N
Show InChI InChI=1S/C20H23N3O4S/c1-3-4-5-12-22-20(24)23-28(25,26)19-13-16(14-21)8-11-18(19)27-17-9-6-15(2)7-10-17/h6-11,13H,3-5,12H2,1-2H3,(H2,22,23,24)
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n/an/a 630n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436780
PNG
(CHEMBL2402426)
Show SMILES Cc1ccc(Oc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)cc1
Show InChI InChI=1S/C19H21N3O4S/c1-13-5-8-15(9-6-13)26-16-10-7-14(12-20)11-17(16)27(24,25)22-18(23)21-19(2,3)4/h5-11H,1-4H3,(H2,21,22,23)
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n/an/a 680n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436782
PNG
(CHEMBL2402424)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1cccc(C)c1)C#N
Show InChI InChI=1S/C20H23N3O4S/c1-3-4-5-11-22-20(24)23-28(25,26)19-13-16(14-21)9-10-18(19)27-17-8-6-7-15(2)12-17/h6-10,12-13H,3-5,11H2,1-2H3,(H2,22,23,24)
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n/an/a 680n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436783
PNG
(CHEMBL2402423)
Show SMILES Cc1cccc(Oc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)c1
Show InChI InChI=1S/C19H21N3O4S/c1-13-6-5-7-15(10-13)26-16-9-8-14(12-20)11-17(16)27(24,25)22-18(23)21-19(2,3)4/h5-11H,1-4H3,(H2,21,22,23)
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n/an/a 690n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50188619
PNG
(1-(2-(p-toluidino)-5-nitrophenylsulfonyl)-3-tert-b...)
Show SMILES Cc1ccc(Nc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)[N+]([O-])=O)cc1
Show InChI InChI=1S/C18H22N4O5S/c1-12-5-7-13(8-6-12)19-15-10-9-14(22(24)25)11-16(15)28(26,27)21-17(23)20-18(2,3)4/h5-11,19H,1-4H3,(H2,20,21,23)
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n/an/a 700n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436780
PNG
(CHEMBL2402426)
Show SMILES Cc1ccc(Oc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)cc1
Show InChI InChI=1S/C19H21N3O4S/c1-13-5-8-15(9-6-13)26-16-10-7-14(12-20)11-17(16)27(24,25)22-18(23)21-19(2,3)4/h5-11H,1-4H3,(H2,21,22,23)
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n/an/a 750n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436771
PNG
(CHEMBL2402435)
Show SMILES Cc1ccc(Nc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)cc1
Show InChI InChI=1S/C19H22N4O3S/c1-13-5-8-15(9-6-13)21-16-10-7-14(12-20)11-17(16)27(25,26)23-18(24)22-19(2,3)4/h5-11,21H,1-4H3,(H2,22,23,24)
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n/an/a 850n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436779
PNG
(CHEMBL2402427)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(C)cc1)C#N
Show InChI InChI=1S/C20H23N3O4S/c1-3-4-5-12-22-20(24)23-28(25,26)19-13-16(14-21)8-11-18(19)27-17-9-6-15(2)7-10-17/h6-11,13H,3-5,12H2,1-2H3,(H2,22,23,24)
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n/an/a 900n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436770
PNG
(CHEMBL2402436)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(C)cc1)C#N
Show InChI InChI=1S/C20H24N4O3S/c1-3-4-5-12-22-20(25)24-28(26,27)19-13-16(14-21)8-11-18(19)23-17-9-6-15(2)7-10-17/h6-11,13,23H,3-5,12H2,1-2H3,(H2,22,24,25)
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n/an/a 1.04E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436771
PNG
(CHEMBL2402435)
Show SMILES Cc1ccc(Nc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)cc1
Show InChI InChI=1S/C19H22N4O3S/c1-13-5-8-15(9-6-13)21-16-10-7-14(12-20)11-17(16)27(25,26)23-18(24)22-19(2,3)4/h5-11,21H,1-4H3,(H2,22,23,24)
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n/an/a 1.04E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436783
PNG
(CHEMBL2402423)
Show SMILES Cc1cccc(Oc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)c1
Show InChI InChI=1S/C19H21N3O4S/c1-13-6-5-7-15(10-13)26-16-9-8-14(12-20)11-17(16)27(24,25)22-18(23)21-19(2,3)4/h5-11H,1-4H3,(H2,21,22,23)
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n/an/a 1.05E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436782
PNG
(CHEMBL2402424)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1cccc(C)c1)C#N
Show InChI InChI=1S/C20H23N3O4S/c1-3-4-5-11-22-20(24)23-28(25,26)19-13-16(14-21)9-10-18(19)27-17-8-6-7-15(2)12-17/h6-10,12-13H,3-5,11H2,1-2H3,(H2,22,23,24)
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n/an/a 1.33E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436781
PNG
(CHEMBL2402425)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(C)cc1)C#N
Show InChI InChI=1S/C18H19N3O4S/c1-12(2)20-18(22)21-26(23,24)17-10-14(11-19)6-9-16(17)25-15-7-4-13(3)5-8-15/h4-10,12H,1-3H3,(H2,20,21,22)
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n/an/a 1.35E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436786
PNG
(CHEMBL2402420)
Show SMILES Cc1ccccc1Oc1ccc(cc1S(=O)(=O)NC(=O)NC(C)(C)C)C#N
Show InChI InChI=1S/C19H21N3O4S/c1-13-7-5-6-8-15(13)26-16-10-9-14(12-20)11-17(16)27(24,25)22-18(23)21-19(2,3)4/h5-11H,1-4H3,(H2,21,22,23)
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n/an/a 1.47E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436774
PNG
(CHEMBL2402432)
Show SMILES Cc1cccc(Nc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)c1
Show InChI InChI=1S/C19H22N4O3S/c1-13-6-5-7-15(10-13)21-16-9-8-14(12-20)11-17(16)27(25,26)23-18(24)22-19(2,3)4/h5-11,21H,1-4H3,(H2,22,23,24)
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n/an/a 1.59E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436784
PNG
(CHEMBL2402422)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1cccc(C)c1)C#N
Show InChI InChI=1S/C18H19N3O4S/c1-12(2)20-18(22)21-26(23,24)17-10-14(11-19)7-8-16(17)25-15-6-4-5-13(3)9-15/h4-10,12H,1-3H3,(H2,20,21,22)
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n/an/a 1.69E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436785
PNG
(CHEMBL2402421)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccccc1C)C#N
Show InChI InChI=1S/C20H23N3O4S/c1-3-4-7-12-22-20(24)23-28(25,26)19-13-16(14-21)10-11-18(19)27-17-9-6-5-8-15(17)2/h5-6,8-11,13H,3-4,7,12H2,1-2H3,(H2,22,23,24)
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n/an/a 1.78E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436770
PNG
(CHEMBL2402436)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(C)cc1)C#N
Show InChI InChI=1S/C20H24N4O3S/c1-3-4-5-12-22-20(25)24-28(26,27)19-13-16(14-21)8-11-18(19)23-17-9-6-15(2)7-10-17/h6-11,13,23H,3-5,12H2,1-2H3,(H2,22,24,25)
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n/an/a 2.06E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436774
PNG
(CHEMBL2402432)
Show SMILES Cc1cccc(Nc2ccc(cc2S(=O)(=O)NC(=O)NC(C)(C)C)C#N)c1
Show InChI InChI=1S/C19H22N4O3S/c1-13-6-5-7-15(10-13)21-16-9-8-14(12-20)11-17(16)27(25,26)23-18(24)22-19(2,3)4/h5-11,21H,1-4H3,(H2,22,23,24)
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n/an/a 2.20E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436785
PNG
(CHEMBL2402421)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccccc1C)C#N
Show InChI InChI=1S/C20H23N3O4S/c1-3-4-7-12-22-20(24)23-28(25,26)19-13-16(14-21)10-11-18(19)27-17-9-6-5-8-15(17)2/h5-6,8-11,13H,3-4,7,12H2,1-2H3,(H2,22,23,24)
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n/an/a 2.24E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436773
PNG
(CHEMBL2402433)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1cccc(C)c1)C#N
Show InChI InChI=1S/C20H24N4O3S/c1-3-4-5-11-22-20(25)24-28(26,27)19-13-16(14-21)9-10-18(19)23-17-8-6-7-15(2)12-17/h6-10,12-13,23H,3-5,11H2,1-2H3,(H2,22,24,25)
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n/an/a 2.33E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436784
PNG
(CHEMBL2402422)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1cccc(C)c1)C#N
Show InChI InChI=1S/C18H19N3O4S/c1-12(2)20-18(22)21-26(23,24)17-10-14(11-19)7-8-16(17)25-15-6-4-5-13(3)9-15/h4-10,12H,1-3H3,(H2,20,21,22)
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n/an/a 2.38E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436777
PNG
(CHEMBL2402429)
Show SMILES Cc1ccccc1Nc1ccc(cc1S(=O)(=O)NC(=O)NC(C)(C)C)C#N
Show InChI InChI=1S/C19H22N4O3S/c1-13-7-5-6-8-15(13)21-16-10-9-14(12-20)11-17(16)27(25,26)23-18(24)22-19(2,3)4/h5-11,21H,1-4H3,(H2,22,23,24)
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n/an/a 2.75E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436773
PNG
(CHEMBL2402433)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1cccc(C)c1)C#N
Show InChI InChI=1S/C20H24N4O3S/c1-3-4-5-11-22-20(25)24-28(26,27)19-13-16(14-21)9-10-18(19)23-17-8-6-7-15(2)12-17/h6-10,12-13,23H,3-5,11H2,1-2H3,(H2,22,24,25)
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n/an/a 2.95E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436781
PNG
(CHEMBL2402425)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(C)cc1)C#N
Show InChI InChI=1S/C18H19N3O4S/c1-12(2)20-18(22)21-26(23,24)17-10-14(11-19)6-9-16(17)25-15-7-4-13(3)5-8-15/h4-10,12H,1-3H3,(H2,20,21,22)
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n/an/a 3.05E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436776
PNG
(CHEMBL2402430)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccccc1C)C#N
Show InChI InChI=1S/C20H24N4O3S/c1-3-4-7-12-22-20(25)24-28(26,27)19-13-16(14-21)10-11-18(19)23-17-9-6-5-8-15(17)2/h5-6,8-11,13,23H,3-4,7,12H2,1-2H3,(H2,22,24,25)
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n/an/a 3.19E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436786
PNG
(CHEMBL2402420)
Show SMILES Cc1ccccc1Oc1ccc(cc1S(=O)(=O)NC(=O)NC(C)(C)C)C#N
Show InChI InChI=1S/C19H21N3O4S/c1-13-7-5-6-8-15(13)26-16-10-9-14(12-20)11-17(16)27(24,25)22-18(23)21-19(2,3)4/h5-11H,1-4H3,(H2,21,22,23)
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n/an/a 3.69E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436768
PNG
(CHEMBL2402438)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(F)cc1)C#N
Show InChI InChI=1S/C18H18FN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 3.89E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436772
PNG
(CHEMBL2402434)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(C)cc1)C#N
Show InChI InChI=1S/C18H20N4O3S/c1-12(2)20-18(23)22-26(24,25)17-10-14(11-19)6-9-16(17)21-15-7-4-13(3)5-8-15/h4-10,12,21H,1-3H3,(H2,20,22,23)
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n/an/a 4.11E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436772
PNG
(CHEMBL2402434)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(C)cc1)C#N
Show InChI InChI=1S/C18H20N4O3S/c1-12(2)20-18(23)22-26(24,25)17-10-14(11-19)6-9-16(17)21-15-7-4-13(3)5-8-15/h4-10,12,21H,1-3H3,(H2,20,22,23)
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n/an/a 4.22E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436768
PNG
(CHEMBL2402438)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(F)cc1)C#N
Show InChI InChI=1S/C18H18FN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 4.35E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436756
PNG
(CHEMBL2402417)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(F)cc1)C#N
Show InChI InChI=1S/C18H19FN4O3S/c1-18(2,3)22-17(24)23-27(25,26)16-10-12(11-20)4-9-15(16)21-14-7-5-13(19)6-8-14/h4-10,21H,1-3H3,(H2,22,23,24)
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n/an/a 4.64E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436777
PNG
(CHEMBL2402429)
Show SMILES Cc1ccccc1Nc1ccc(cc1S(=O)(=O)NC(=O)NC(C)(C)C)C#N
Show InChI InChI=1S/C19H22N4O3S/c1-13-7-5-6-8-15(13)21-16-10-9-14(12-20)11-17(16)27(25,26)23-18(24)22-19(2,3)4/h5-11,21H,1-4H3,(H2,22,23,24)
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n/an/a 4.78E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436756
PNG
(CHEMBL2402417)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(F)cc1)C#N
Show InChI InChI=1S/C18H19FN4O3S/c1-18(2,3)22-17(24)23-27(25,26)16-10-12(11-20)4-9-15(16)21-14-7-5-13(19)6-8-14/h4-10,21H,1-3H3,(H2,22,23,24)
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n/an/a 4.91E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436765
PNG
(CHEMBL2402576)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Cl)cc1)C#N
Show InChI InChI=1S/C18H18ClN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 5.27E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436762
PNG
(CHEMBL2402411)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Br)cc1)C#N
Show InChI InChI=1S/C18H18BrN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 5.31E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436759
PNG
(CHEMBL2402414)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(I)cc1)C#N
Show InChI InChI=1S/C18H18IN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 5.52E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436759
PNG
(CHEMBL2402414)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(I)cc1)C#N
Show InChI InChI=1S/C18H18IN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 5.54E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436765
PNG
(CHEMBL2402576)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Cl)cc1)C#N
Show InChI InChI=1S/C18H18ClN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 5.64E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436762
PNG
(CHEMBL2402411)
Show SMILES CC(C)(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Br)cc1)C#N
Show InChI InChI=1S/C18H18BrN3O4S/c1-18(2,3)21-17(23)22-27(24,25)16-10-12(11-20)4-9-15(16)26-14-7-5-13(19)6-8-14/h4-10H,1-3H3,(H2,21,22,23)
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n/an/a 5.88E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436787
PNG
(CHEMBL2402419)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccccc1C)C#N
Show InChI InChI=1S/C18H19N3O4S/c1-12(2)20-18(22)21-26(23,24)17-10-14(11-19)8-9-16(17)25-15-7-5-4-6-13(15)3/h4-10,12H,1-3H3,(H2,20,21,22)
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n/an/a 6.13E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436755
PNG
(CHEMBL2402418)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(F)cc1)C#N
Show InChI InChI=1S/C19H21FN4O3S/c1-2-3-4-11-22-19(25)24-28(26,27)18-12-14(13-21)5-10-17(18)23-16-8-6-15(20)7-9-16/h5-10,12,23H,2-4,11H2,1H3,(H2,22,24,25)
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n/an/a 6.45E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436755
PNG
(CHEMBL2402418)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(F)cc1)C#N
Show InChI InChI=1S/C19H21FN4O3S/c1-2-3-4-11-22-19(25)24-28(26,27)18-12-14(13-21)5-10-17(18)23-16-8-6-15(20)7-9-16/h5-10,12,23H,2-4,11H2,1H3,(H2,22,24,25)
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n/an/a 6.78E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436778
PNG
(CHEMBL2402428)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccccc1C)C#N
Show InChI InChI=1S/C18H20N4O3S/c1-12(2)20-18(23)22-26(24,25)17-10-14(11-19)8-9-16(17)21-15-7-5-4-6-13(15)3/h4-10,12,21H,1-3H3,(H2,20,22,23)
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n/an/a 7.24E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436757
PNG
(CHEMBL2402416)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(F)cc1)C#N
Show InChI InChI=1S/C17H17FN4O3S/c1-11(2)20-17(23)22-26(24,25)16-9-12(10-19)3-8-15(16)21-14-6-4-13(18)5-7-14/h3-9,11,21H,1-2H3,(H2,20,22,23)
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n/an/a 7.83E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436776
PNG
(CHEMBL2402430)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccccc1C)C#N
Show InChI InChI=1S/C20H24N4O3S/c1-3-4-7-12-22-20(25)24-28(26,27)19-13-16(14-21)10-11-18(19)23-17-9-6-5-8-15(17)2/h5-6,8-11,13,23H,3-4,7,12H2,1-2H3,(H2,22,24,25)
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n/an/a 7.85E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436757
PNG
(CHEMBL2402416)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccc(F)cc1)C#N
Show InChI InChI=1S/C17H17FN4O3S/c1-11(2)20-17(23)22-26(24,25)16-9-12(10-19)3-8-15(16)21-14-6-4-13(18)5-7-14/h3-9,11,21H,1-2H3,(H2,20,22,23)
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n/an/a 8.17E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436766
PNG
(CHEMBL2402575)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Cl)cc1)C#N
Show InChI InChI=1S/C17H16ClN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 8.49E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436761
PNG
(CHEMBL2402412)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Br)cc1)C#N
Show InChI InChI=1S/C19H20BrN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 8.52E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436764
PNG
(CHEMBL2402577)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Cl)cc1)C#N
Show InChI InChI=1S/C19H20ClN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 8.64E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436787
PNG
(CHEMBL2402419)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccccc1C)C#N
Show InChI InChI=1S/C18H19N3O4S/c1-12(2)20-18(22)21-26(23,24)17-10-14(11-19)8-9-16(17)25-15-7-5-4-6-13(15)3/h4-10,12H,1-3H3,(H2,20,21,22)
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n/an/a 8.68E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436764
PNG
(CHEMBL2402577)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Cl)cc1)C#N
Show InChI InChI=1S/C19H20ClN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 8.72E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436775
PNG
(CHEMBL2402431)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1cccc(C)c1)C#N
Show InChI InChI=1S/C18H20N4O3S/c1-12(2)20-18(23)22-26(24,25)17-10-14(11-19)7-8-16(17)21-15-6-4-5-13(3)9-15/h4-10,12,21H,1-3H3,(H2,20,22,23)
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n/an/a 9.11E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436763
PNG
(CHEMBL2402410)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Br)cc1)C#N
Show InChI InChI=1S/C17H16BrN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 9.13E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436769
PNG
(CHEMBL2402437)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(F)cc1)C#N
Show InChI InChI=1S/C17H16FN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 9.30E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436767
PNG
(CHEMBL2402439)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(F)cc1)C#N
Show InChI InChI=1S/C19H20FN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 9.43E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436766
PNG
(CHEMBL2402575)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Cl)cc1)C#N
Show InChI InChI=1S/C17H16ClN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 9.46E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436763
PNG
(CHEMBL2402410)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Br)cc1)C#N
Show InChI InChI=1S/C17H16BrN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 9.47E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436758
PNG
(CHEMBL2402415)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(I)cc1)C#N
Show InChI InChI=1S/C19H20IN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 9.49E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436760
PNG
(CHEMBL2402413)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(I)cc1)C#N
Show InChI InChI=1S/C17H16IN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 9.49E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436775
PNG
(CHEMBL2402431)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1cccc(C)c1)C#N
Show InChI InChI=1S/C18H20N4O3S/c1-12(2)20-18(23)22-26(24,25)17-10-14(11-19)7-8-16(17)21-15-6-4-5-13(3)9-15/h4-10,12,21H,1-3H3,(H2,20,22,23)
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n/an/a 9.50E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436758
PNG
(CHEMBL2402415)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(I)cc1)C#N
Show InChI InChI=1S/C19H20IN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 9.52E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436760
PNG
(CHEMBL2402413)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(I)cc1)C#N
Show InChI InChI=1S/C17H16IN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 9.52E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436767
PNG
(CHEMBL2402439)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(F)cc1)C#N
Show InChI InChI=1S/C19H20FN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 9.53E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436761
PNG
(CHEMBL2402412)
Show SMILES CCCCCNC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(Br)cc1)C#N
Show InChI InChI=1S/C19H20BrN3O4S/c1-2-3-4-11-22-19(24)23-28(25,26)18-12-14(13-21)5-10-17(18)27-16-8-6-15(20)7-9-16/h5-10,12H,2-4,11H2,1H3,(H2,22,23,24)
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n/an/a 9.54E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436769
PNG
(CHEMBL2402437)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Oc1ccc(F)cc1)C#N
Show InChI InChI=1S/C17H16FN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
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n/an/a 9.62E+3n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular cal...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
Thromboxane A2 receptor


(Homo sapiens (Human))		BDBM50436778
PNG
(CHEMBL2402428)
Show SMILES CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccccc1C)C#N
Show InChI InChI=1S/C18H20N4O3S/c1-12(2)20-18(23)22-26(24,25)17-10-14(11-19)8-9-16(17)21-15-7-5-4-6-13(15)3/h4-10,12,21H,1-3H3,(H2,20,22,23)
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n/an/a 1.01E+4n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calc...

Eur J Med Chem 65: 32-40 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.033
BindingDB Entry DOI: 10.7270/Q2W95BMW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%