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PubMed code 21507642

Compile data set for download or QSAR
Found 47 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
P2Y purinoceptor 14


(Mus musculus)		BDBM50343131
PNG
(2-(2-cyanopyrimidin-5-yl)-N-(3-ethylphenyl)-4-o-to...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cnc(nc2)C#N)c1
Show InChI InChI=1S/C28H25N7O/c1-3-19-8-6-9-21(13-19)32-28(36)35-12-11-24-23(17-35)26(22-10-5-4-7-18(22)2)34-27(33-24)20-15-30-25(14-29)31-16-20/h4-10,13,15-16H,3,11-12,17H2,1-2H3,(H,32,36)
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Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343129
PNG
(2-(4-cyanopyridin-3-yl)-N-(3-ethylphenyl)-4-o-toly...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cnccc2C#N)c1
Show InChI InChI=1S/C29H26N6O/c1-3-20-8-6-9-22(15-20)32-29(36)35-14-12-26-25(18-35)27(23-10-5-4-7-19(23)2)34-28(33-26)24-17-31-13-11-21(24)16-30/h4-11,13,15,17H,3,12,14,18H2,1-2H3,(H,32,36)
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Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343132
PNG
(2-(3,5-dimethylisoxazol-4-yl)-N-(3-ethylphenyl)-4-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2c(C)noc2C)c1
Show InChI InChI=1S/C28H29N5O2/c1-5-20-10-8-11-21(15-20)29-28(34)33-14-13-24-23(16-33)26(22-12-7-6-9-17(22)2)31-27(30-24)25-18(3)32-35-19(25)4/h6-12,15H,5,13-14,16H2,1-4H3,(H,29,34)
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Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343120
PNG
(4-(2,6-dimethylphenyl)-N-(3-ethylphenyl)-2-(pyridi...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2c(C)cccc2C)-c2cccnc2)c1 |(10.19,-.57,;8.86,.2,;7.53,-.58,;7.53,-2.13,;6.2,-2.9,;4.86,-2.13,;4.87,-.59,;3.53,.18,;2.2,-.59,;2.2,-2.13,;.87,.18,;.86,1.73,;-.48,2.51,;-1.81,1.73,;-3.15,2.49,;-4.47,1.72,;-4.47,.18,;-3.14,-.59,;-1.81,.18,;-.48,-.59,;-3.14,-2.12,;-4.47,-2.89,;-5.81,-2.12,;-4.47,-4.43,;-3.13,-5.2,;-1.8,-4.42,;-1.81,-2.89,;-.47,-2.11,;-5.8,2.49,;-7.14,1.71,;-8.47,2.48,;-8.47,4.03,;-7.14,4.8,;-5.81,4.04,;6.19,.19,)|
Show InChI InChI=1S/C29H29N5O/c1-4-21-10-6-12-23(16-21)31-29(35)34-15-13-25-24(18-34)27(26-19(2)8-5-9-20(26)3)33-28(32-25)22-11-7-14-30-17-22/h5-12,14,16-17H,4,13,15,18H2,1-3H3,(H,31,35)
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n/an/a 9n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343128
PNG
(2-(benzo[d][1,3]dioxol-5-yl)-N-(3-ethylphenyl)-4-o...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc3OCOc3c2)c1
Show InChI InChI=1S/C30H28N4O3/c1-3-20-8-6-9-22(15-20)31-30(35)34-14-13-25-24(17-34)28(23-10-5-4-7-19(23)2)33-29(32-25)21-11-12-26-27(16-21)37-18-36-26/h4-12,15-16H,3,13-14,17-18H2,1-2H3,(H,31,35)
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n/an/a 10n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343130
PNG
(CHEMBL1771458 | N-(3-ethylphenyl)-2-(pyrimidin-5-y...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cncnc2)c1
Show InChI InChI=1S/C27H26N6O/c1-3-19-8-6-9-21(13-19)30-27(34)33-12-11-24-23(16-33)25(22-10-5-4-7-18(22)2)32-26(31-24)20-14-28-17-29-15-20/h4-10,13-15,17H,3,11-12,16H2,1-2H3,(H,30,34)
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n/an/a 12n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343127
PNG
(CHEMBL1771455 | N-(3-ethylphenyl)-2-(quinolin-3-yl...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cnc3ccccc3c2)c1
Show InChI InChI=1S/C32H29N5O/c1-3-22-10-8-12-25(17-22)34-32(38)37-16-15-29-27(20-37)30(26-13-6-4-9-21(26)2)36-31(35-29)24-18-23-11-5-7-14-28(23)33-19-24/h4-14,17-19H,3,15-16,20H2,1-2H3,(H,34,38)
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n/an/a 13n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343094
PNG
(2-(4-cyanophenyl)-N-(3-ethylphenyl)-4-o-tolyl-7,8-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc(cc2)C#N)c1
Show InChI InChI=1S/C30H27N5O/c1-3-21-8-6-9-24(17-21)32-30(36)35-16-15-27-26(19-35)28(25-10-5-4-7-20(25)2)34-29(33-27)23-13-11-22(18-31)12-14-23/h4-14,17H,3,15-16,19H2,1-2H3,(H,32,36)
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n/an/a 16n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343095
PNG
(CHEMBL1771452 | N-(3-ethylphenyl)-2-(4-fluoropheny...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc(F)cc2)c1
Show InChI InChI=1S/C29H27FN4O/c1-3-20-8-6-9-23(17-20)31-29(35)34-16-15-26-25(18-34)27(24-10-5-4-7-19(24)2)33-28(32-26)21-11-13-22(30)14-12-21/h4-14,17H,3,15-16,18H2,1-2H3,(H,31,35)
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Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343109
PNG
(CHEMBL1771244 | N-(3-(1-fluoroethyl)phenyl)-2-(pyr...)
Show SMILES CC(F)c1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C28H26FN5O/c1-18-7-3-4-11-23(18)26-24-17-34(28(35)31-22-10-5-8-20(15-22)19(2)29)14-12-25(24)32-27(33-26)21-9-6-13-30-16-21/h3-11,13,15-16,19H,12,14,17H2,1-2H3,(H,31,35)
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n/an/a 29n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343125
PNG
(CHEMBL1771453 | N-(3-ethylphenyl)-2-(3-fluoropheny...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccc(F)c2)c1
Show InChI InChI=1S/C29H27FN4O/c1-3-20-9-6-12-23(16-20)31-29(35)34-15-14-26-25(18-34)27(24-13-5-4-8-19(24)2)33-28(32-26)21-10-7-11-22(30)17-21/h4-13,16-17H,3,14-15,18H2,1-2H3,(H,31,35)
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Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343121
PNG
(4-(2-chloro-6-methylphenyl)-N-(3-ethylphenyl)-2-(p...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2c(C)cccc2Cl)-c2cccnc2)c1 |(33.06,-2.47,;31.72,-1.7,;30.39,-2.48,;30.4,-4.02,;29.06,-4.79,;27.73,-4.02,;27.73,-2.49,;26.4,-1.72,;25.07,-2.49,;25.07,-4.03,;23.73,-1.72,;23.73,-.17,;22.39,.61,;21.05,-.17,;19.72,.59,;18.39,-.18,;18.39,-1.72,;19.73,-2.49,;21.05,-1.72,;22.39,-2.49,;19.73,-4.02,;18.4,-4.79,;17.06,-4.02,;18.4,-6.33,;19.73,-7.1,;21.07,-6.32,;21.06,-4.78,;22.39,-4.01,;17.06,.59,;15.73,-.18,;14.39,.59,;14.39,2.13,;15.72,2.9,;17.06,2.14,;29.06,-1.71,)|
Show InChI InChI=1S/C28H26ClN5O/c1-3-19-8-5-10-21(15-19)31-28(35)34-14-12-24-22(17-34)26(25-18(2)7-4-11-23(25)29)33-27(32-24)20-9-6-13-30-16-20/h4-11,13,15-16H,3,12,14,17H2,1-2H3,(H,31,35)
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n/an/a 50n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343122
PNG
(4-(2,6-dichlorophenyl)-N-(3-ethylphenyl)-2-(pyridi...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2c(Cl)cccc2Cl)-c2cccnc2)c1 |(11.19,-15.22,;9.85,-14.45,;8.52,-15.23,;8.53,-16.78,;7.19,-17.55,;5.86,-16.78,;5.86,-15.24,;4.53,-14.47,;3.2,-15.24,;3.2,-16.78,;1.86,-14.47,;1.86,-12.92,;.52,-12.14,;-.82,-12.92,;-2.15,-12.16,;-3.48,-12.93,;-3.48,-14.48,;-2.15,-15.24,;-.82,-14.47,;.52,-15.24,;-2.14,-16.77,;-3.48,-17.54,;-4.81,-16.78,;-3.47,-19.08,;-2.14,-19.85,;-.8,-19.07,;-.81,-17.54,;.52,-16.76,;-4.81,-12.17,;-6.14,-12.94,;-7.48,-12.17,;-7.48,-10.62,;-6.15,-9.85,;-4.81,-10.62,;7.19,-14.47,)|
Show InChI InChI=1S/C27H23Cl2N5O/c1-2-17-6-3-8-19(14-17)31-27(35)34-13-11-23-20(16-34)25(24-21(28)9-4-10-22(24)29)33-26(32-23)18-7-5-12-30-15-18/h3-10,12,14-15H,2,11,13,16H2,1H3,(H,31,35)
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n/an/a 51n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343090
PNG
(CHEMBL1771446 | N-(3-ethylphenyl)-4-o-tolyl-2-p-to...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc(C)cc2)c1
Show InChI InChI=1S/C30H30N4O/c1-4-22-9-7-10-24(18-22)31-30(35)34-17-16-27-26(19-34)28(25-11-6-5-8-21(25)3)33-29(32-27)23-14-12-20(2)13-15-23/h5-15,18H,4,16-17,19H2,1-3H3,(H,31,35)
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n/an/a 62n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343103
PNG
(CHEMBL1771238 | N-(3-ethylphenyl)-2-(pyridin-3-yl)...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C28H27N5O/c1-3-20-9-6-11-22(16-20)30-28(34)33-15-13-25-24(18-33)26(23-12-5-4-8-19(23)2)32-27(31-25)21-10-7-14-29-17-21/h4-12,14,16-17H,3,13,15,18H2,1-2H3,(H,30,34)
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n/an/a 81n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343089
PNG
(CHEMBL1771445 | N-(3-ethylphenyl)-2-phenyl-4-o-tol...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccccc2)c1
Show InChI InChI=1S/C29H28N4O/c1-3-21-11-9-14-23(18-21)30-29(34)33-17-16-26-25(19-33)27(24-15-8-7-10-20(24)2)32-28(31-26)22-12-5-4-6-13-22/h4-15,18H,3,16-17,19H2,1-2H3,(H,30,34)
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n/an/a 87n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343093
PNG
(2-(3-cyanophenyl)-N-(3-ethylphenyl)-4-o-tolyl-7,8-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccc(c2)C#N)c1
Show InChI InChI=1S/C30H27N5O/c1-3-21-9-7-12-24(17-21)32-30(36)35-15-14-27-26(19-35)28(25-13-5-4-8-20(25)2)34-29(33-27)23-11-6-10-22(16-23)18-31/h4-13,16-17H,3,14-15,19H2,1-2H3,(H,32,36)
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n/an/a 140n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343104
PNG
(CHEMBL1771239 | N-(3-propylphenyl)-2-(pyridin-3-yl...)
Show SMILES CCCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C29H29N5O/c1-3-8-21-10-6-12-23(17-21)31-29(35)34-16-14-26-25(19-34)27(24-13-5-4-9-20(24)2)33-28(32-26)22-11-7-15-30-18-22/h4-7,9-13,15,17-18H,3,8,14,16,19H2,1-2H3,(H,31,35)
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n/an/a 150n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343111
PNG
(CHEMBL1771246 | N-(3-chloro-5-ethylphenyl)-2-(pyri...)
Show SMILES CCc1cc(Cl)cc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C28H26ClN5O/c1-3-19-13-21(29)15-22(14-19)31-28(35)34-12-10-25-24(17-34)26(23-9-5-4-7-18(23)2)33-27(32-25)20-8-6-11-30-16-20/h4-9,11,13-16H,3,10,12,17H2,1-2H3,(H,31,35)
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n/an/a 160n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343116
PNG
(4-(2-ethylphenyl)-N-(3-ethylphenyl)-2-(pyridin-3-y...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2CC)-c2cccnc2)c1
Show InChI InChI=1S/C29H29N5O/c1-3-20-9-7-12-23(17-20)31-29(35)34-16-14-26-25(19-34)27(24-13-6-5-10-21(24)4-2)33-28(32-26)22-11-8-15-30-18-22/h5-13,15,17-18H,3-4,14,16,19H2,1-2H3,(H,31,35)
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n/an/a 390n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343100
PNG
(CHEMBL1771235 | N-(3-ethoxyphenyl)-2-(pyridin-3-yl...)
Show SMILES CCOc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C28H27N5O2/c1-3-35-22-11-6-10-21(16-22)30-28(34)33-15-13-25-24(18-33)26(23-12-5-4-8-19(23)2)32-27(31-25)20-9-7-14-29-17-20/h4-12,14,16-17H,3,13,15,18H2,1-2H3,(H,30,34)
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n/an/a 420n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343112
PNG
(4-(2-chlorophenyl)-N-(3-ethylphenyl)-2-(pyridin-3-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2Cl)-c2cccnc2)c1
Show InChI InChI=1S/C27H24ClN5O/c1-2-18-7-5-9-20(15-18)30-27(34)33-14-12-24-22(17-33)25(21-10-3-4-11-23(21)28)32-26(31-24)19-8-6-13-29-16-19/h3-11,13,15-16H,2,12,14,17H2,1H3,(H,30,34)
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n/an/a 440n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343097
PNG
(CHEMBL1771232 | N-(3-chlorophenyl)-2-(pyridin-3-yl...)
Show SMILES Cc1ccccc1-c1nc(nc2CCN(Cc12)C(=O)Nc1cccc(Cl)c1)-c1cccnc1
Show InChI InChI=1S/C26H22ClN5O/c1-17-6-2-3-10-21(17)24-22-16-32(26(33)29-20-9-4-8-19(27)14-20)13-11-23(22)30-25(31-24)18-7-5-12-28-15-18/h2-10,12,14-15H,11,13,16H2,1H3,(H,29,33)
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n/an/a 580n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343110
PNG
(CHEMBL1771245 | N-(3-(1,1-difluoroethyl)phenyl)-2-...)
Show SMILES Cc1ccccc1-c1nc(nc2CCN(Cc12)C(=O)Nc1cccc(c1)C(C)(F)F)-c1cccnc1
Show InChI InChI=1S/C28H25F2N5O/c1-18-7-3-4-11-22(18)25-23-17-35(27(36)32-21-10-5-9-20(15-21)28(2,29)30)14-12-24(23)33-26(34-25)19-8-6-13-31-16-19/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,32,36)
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n/an/a 620n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343101
PNG
(CHEMBL1771236 | N-(3-(methylthio)phenyl)-2-(pyridi...)
Show SMILES CSc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C27H25N5OS/c1-18-7-3-4-11-22(18)25-23-17-32(27(33)29-20-9-5-10-21(15-20)34-2)14-12-24(23)30-26(31-25)19-8-6-13-28-16-19/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,29,33)
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n/an/a 630n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343126
PNG
(CHEMBL1771454 | N-(3-ethylphenyl)-2-(naphthalen-2-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C33H30N4O/c1-3-23-10-8-13-27(19-23)34-33(38)37-18-17-30-29(21-37)31(28-14-7-4-9-22(28)2)36-32(35-30)26-16-15-24-11-5-6-12-25(24)20-26/h4-16,19-20H,3,17-18,21H2,1-2H3,(H,34,38)
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n/an/a 880n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343119
PNG
(CHEMBL1771438 | N-(3-ethylphenyl)-4-(2-(hydroxymet...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2CO)-c2cccnc2)c1
Show InChI InChI=1S/C28H27N5O2/c1-2-19-7-5-10-22(15-19)30-28(35)33-14-12-25-24(17-33)26(23-11-4-3-8-21(23)18-34)32-27(31-25)20-9-6-13-29-16-20/h3-11,13,15-16,34H,2,12,14,17-18H2,1H3,(H,30,35)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343106
PNG
(CHEMBL1771241 | N-(3-cyclopropylphenyl)-2-(pyridin...)
Show SMILES Cc1ccccc1-c1nc(nc2CCN(Cc12)C(=O)Nc1cccc(c1)C1CC1)-c1cccnc1
Show InChI InChI=1S/C29H27N5O/c1-19-6-2-3-10-24(19)27-25-18-34(29(35)31-23-9-4-7-21(16-23)20-11-12-20)15-13-26(25)32-28(33-27)22-8-5-14-30-17-22/h2-10,14,16-17,20H,11-13,15,18H2,1H3,(H,31,35)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343105
PNG
(2-(pyridin-3-yl)-4-o-tolyl-N-(3-vinylphenyl)-7,8-d...)
Show SMILES Cc1ccccc1-c1nc(nc2CCN(Cc12)C(=O)Nc1cccc(C=C)c1)-c1cccnc1
Show InChI InChI=1S/C28H25N5O/c1-3-20-9-6-11-22(16-20)30-28(34)33-15-13-25-24(18-33)26(23-12-5-4-8-19(23)2)32-27(31-25)21-10-7-14-29-17-21/h3-12,14,16-17H,1,13,15,18H2,2H3,(H,30,34)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343091
PNG
(CHEMBL1771447 | N-(3-ethylphenyl)-2-m-tolyl-4-o-to...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccc(C)c2)c1
Show InChI InChI=1S/C30H30N4O/c1-4-22-11-8-13-24(18-22)31-30(35)34-16-15-27-26(19-34)28(25-14-6-5-10-21(25)3)33-29(32-27)23-12-7-9-20(2)17-23/h5-14,17-18H,4,15-16,19H2,1-3H3,(H,31,35)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343124
PNG
(CHEMBL1771444 | N-(3-ethylphenyl)-2-(pyridin-4-yl)...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccncc2)c1
Show InChI InChI=1S/C28H27N5O/c1-3-20-8-6-9-22(17-20)30-28(34)33-16-13-25-24(18-33)26(23-10-5-4-7-19(23)2)32-27(31-25)21-11-14-29-15-12-21/h4-12,14-15,17H,3,13,16,18H2,1-2H3,(H,30,34)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343102
PNG
(2-(pyridin-3-yl)-N-m-tolyl-4-o-tolyl-7,8-dihydropy...)
Show SMILES Cc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C27H25N5O/c1-18-7-5-10-21(15-18)29-27(33)32-14-12-24-23(17-32)25(22-11-4-3-8-19(22)2)31-26(30-24)20-9-6-13-28-16-20/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,29,33)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343123
PNG
(3-(6-(3-ethylphenylcarbamoyl)-4-o-tolyl-5,6,7,8-te...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc[n+]([O-])c2)c1
Show InChI InChI=1S/C28H27N5O2/c1-3-20-9-6-11-22(16-20)29-28(34)32-15-13-25-24(18-32)26(23-12-5-4-8-19(23)2)31-27(30-25)21-10-7-14-33(35)17-21/h4-12,14,16-17H,3,13,15,18H2,1-2H3,(H,29,34)
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n/an/a 2.80E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343117
PNG
(CHEMBL1771436 | N-(3-ethylphenyl)-4-(2-methoxyphen...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2OC)-c2cccnc2)c1
Show InChI InChI=1S/C28H27N5O2/c1-3-19-8-6-10-21(16-19)30-28(34)33-15-13-24-23(18-33)26(22-11-4-5-12-25(22)35-2)32-27(31-24)20-9-7-14-29-17-20/h4-12,14,16-17H,3,13,15,18H2,1-2H3,(H,30,34)
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n/an/a 3.30E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343113
PNG
(CHEMBL1771248 | N-(3-ethylphenyl)-4-(2-fluoropheny...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2F)-c2cccnc2)c1
Show InChI InChI=1S/C27H24FN5O/c1-2-18-7-5-9-20(15-18)30-27(34)33-14-12-24-22(17-33)25(21-10-3-4-11-23(21)28)32-26(31-24)19-8-6-13-29-16-19/h3-11,13,15-16H,2,12,14,17H2,1H3,(H,30,34)
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n/an/a 3.70E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343096
PNG
(CHEMBL1771230 | N-phenyl-2-(pyridin-3-yl)-4-o-toly...)
Show SMILES Cc1ccccc1-c1nc(nc2CCN(Cc12)C(=O)Nc1ccccc1)-c1cccnc1
Show InChI InChI=1S/C26H23N5O/c1-18-8-5-6-12-21(18)24-22-17-31(26(32)28-20-10-3-2-4-11-20)15-13-23(22)29-25(30-24)19-9-7-14-27-16-19/h2-12,14,16H,13,15,17H2,1H3,(H,28,32)
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n/an/a 4.90E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50343132
PNG
(2-(3,5-dimethylisoxazol-4-yl)-N-(3-ethylphenyl)-4-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2c(C)noc2C)c1
Show InChI InChI=1S/C28H29N5O2/c1-5-20-10-8-11-21(15-20)29-28(34)33-14-13-24-23(16-33)26(22-12-7-6-9-17(22)2)31-27(30-24)25-18(3)32-35-19(25)4/h6-12,15H,5,13-14,16H2,1-4H3,(H,29,34)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Displacement of [35S]MK-0499 from human ERG

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50343128
PNG
(2-(benzo[d][1,3]dioxol-5-yl)-N-(3-ethylphenyl)-4-o...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc3OCOc3c2)c1
Show InChI InChI=1S/C30H28N4O3/c1-3-20-8-6-9-22(15-20)31-30(35)34-14-13-25-24(17-34)28(23-10-5-4-7-19(23)2)33-29(32-25)21-11-12-26-27(16-21)37-18-36-26/h4-12,15-16H,3,13-14,17-18H2,1-2H3,(H,31,35)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Displacement of [35S]MK-0499 from human ERG

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50343130
PNG
(CHEMBL1771458 | N-(3-ethylphenyl)-2-(pyrimidin-5-y...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cncnc2)c1
Show InChI InChI=1S/C27H26N6O/c1-3-19-8-6-9-21(13-19)30-27(34)33-12-11-24-23(16-33)25(22-10-5-4-7-18(22)2)32-26(31-24)20-14-28-17-29-15-20/h4-10,13-15,17H,3,11-12,16H2,1-2H3,(H,30,34)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Displacement of [35S]MK-0499 from human ERG

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343099
PNG
(CHEMBL1771234 | N-(3-methoxyphenyl)-2-(pyridin-3-y...)
Show SMILES COc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C27H25N5O2/c1-18-7-3-4-11-22(18)25-23-17-32(27(33)29-20-9-5-10-21(15-20)34-2)14-12-24(23)30-26(31-25)19-8-6-13-28-16-19/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,29,33)
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n/an/a 5.10E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343098
PNG
(CHEMBL1771233 | N-(4-chlorophenyl)-2-(pyridin-3-yl...)
Show SMILES Cc1ccccc1-c1nc(nc2CCN(Cc12)C(=O)Nc1ccc(Cl)cc1)-c1cccnc1
Show InChI InChI=1S/C26H22ClN5O/c1-17-5-2-3-7-21(17)24-22-16-32(26(33)29-20-10-8-19(27)9-11-20)14-12-23(22)30-25(31-24)18-6-4-13-28-15-18/h2-11,13,15H,12,14,16H2,1H3,(H,29,33)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343118
PNG
(CHEMBL1771437 | N-(3-ethylphenyl)-4-(2-hydroxyphen...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2O)-c2cccnc2)c1
Show InChI InChI=1S/C27H25N5O2/c1-2-18-7-5-9-20(15-18)29-27(34)32-14-12-23-22(17-32)25(21-10-3-4-11-24(21)33)31-26(30-23)19-8-6-13-28-16-19/h3-11,13,15-16,33H,2,12,14,17H2,1H3,(H,29,34)
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n/an/a 6.50E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343107
PNG
(CHEMBL1771242 | N-(3-acetylphenyl)-2-(pyridin-3-yl...)
Show SMILES CC(=O)c1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C28H25N5O2/c1-18-7-3-4-11-23(18)26-24-17-33(28(35)30-22-10-5-8-20(15-22)19(2)34)14-12-25(24)31-27(32-26)21-9-6-13-29-16-21/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,30,35)
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n/an/a 6.50E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343115
PNG
(4-(4-chloro-2-methylphenyl)-N-(3-ethylphenyl)-2-(p...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccc(Cl)cc2C)-c2cccnc2)c1
Show InChI InChI=1S/C28H26ClN5O/c1-3-19-6-4-8-22(15-19)31-28(35)34-13-11-25-24(17-34)26(23-10-9-21(29)14-18(23)2)33-27(32-25)20-7-5-12-30-16-20/h4-10,12,14-16H,3,11,13,17H2,1-2H3,(H,31,35)
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n/an/a 7.00E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343092
PNG
(CHEMBL1771449 | N-(3-ethylphenyl)-4-o-tolyl-2-(4-(...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2ccc(cc2)C(F)(F)F)c1
Show InChI InChI=1S/C30H27F3N4O/c1-3-20-8-6-9-23(17-20)34-29(38)37-16-15-26-25(18-37)27(24-10-5-4-7-19(24)2)36-28(35-26)21-11-13-22(14-12-21)30(31,32)33/h4-14,17H,3,15-16,18H2,1-2H3,(H,34,38)
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n/an/a 7.50E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343108
PNG
(CHEMBL1771243 | N-(3-(1-hydroxyethyl)phenyl)-2-(py...)
Show SMILES CC(O)c1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
Show InChI InChI=1S/C28H27N5O2/c1-18-7-3-4-11-23(18)26-24-17-33(28(35)30-22-10-5-8-20(15-22)19(2)34)14-12-25(24)31-27(32-26)21-9-6-13-29-16-21/h3-11,13,15-16,19,34H,12,14,17H2,1-2H3,(H,30,35)
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n/an/a 8.20E+3n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
P2Y purinoceptor 14


(Mus musculus)		BDBM50343114
PNG
(4-(3-chlorophenyl)-N-(3-ethylphenyl)-2-(pyridin-3-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(-c4cccc(Cl)c4)c3C2)-c2cccnc2)c1
Show InChI InChI=1S/C27H24ClN5O/c1-2-18-6-3-10-22(14-18)30-27(34)33-13-11-24-23(17-33)25(19-7-4-9-21(28)15-19)32-26(31-24)20-8-5-12-29-16-20/h3-10,12,14-16H,2,11,13,17H2,1H3,(H,30,34)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%