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PubMed code 17532216

Compile data set for download or QSAR
Found 42 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
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214078
PNG
(5-(4-bromophenyl)-6-methyl-1-phenyl-1H-pyrazolo[3,...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Br)cc1)-c1ccccc1
Show InChI InChI=1S/C18H13BrN4O/c1-12-21-17-16(11-20-23(17)15-5-3-2-4-6-15)18(24)22(12)14-9-7-13(19)8-10-14/h2-11H,1H3
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n/an/a 78n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214076
PNG
(6-methyl-1-phenyl-5-(piperidin-1-yl)-1H-pyrazolo[3...)
Show SMILES Cc1nc2n(ncc2c(=O)n1N1CCCCC1)-c1ccccc1
Show InChI InChI=1S/C17H19N5O/c1-13-19-16-15(12-18-21(16)14-8-4-2-5-9-14)17(23)22(13)20-10-6-3-7-11-20/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3
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n/an/a 91n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214074
PNG
(3-(5-(4-chlorophenyl)-6-methyl-4-oxo-4,5-dihydropy...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C18H14ClN5O3S/c1-11-22-17-16(18(25)23(11)13-7-5-12(19)6-8-13)10-21-24(17)14-3-2-4-15(9-14)28(20,26)27/h2-10H,1H3,(H2,20,26,27)
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n/an/a 127n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214088
PNG
(5-(4-chlorophenyl)-6-methyl-1-m-tolyl-1H-pyrazolo[...)
Show SMILES Cc1cccc(c1)-n1ncc2c1nc(C)n(-c1ccc(Cl)cc1)c2=O
Show InChI InChI=1S/C19H15ClN4O/c1-12-4-3-5-16(10-12)24-18-17(11-21-24)19(25)23(13(2)22-18)15-8-6-14(20)7-9-15/h3-11H,1-2H3
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n/an/a 180n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214079
PNG
(1-(3-chlorophenyl)-5-(4-chlorophenyl)-6-methyl-1H-...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cccc(Cl)c1
Show InChI InChI=1S/C18H12Cl2N4O/c1-11-22-17-16(10-21-24(17)15-4-2-3-13(20)9-15)18(25)23(11)14-7-5-12(19)6-8-14/h2-10H,1H3
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n/an/a 220n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214075
PNG
(5-(4-chlorophenyl)-6-methyl-1-(pyridin-3-yl)-1H-py...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cccnc1
Show InChI InChI=1S/C17H12ClN5O/c1-11-21-16-15(10-20-23(16)14-3-2-8-19-9-14)17(24)22(11)13-6-4-12(18)5-7-13/h2-10H,1H3
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n/an/a 230n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214071
PNG
(5-(azepan-1-yl)-6-methyl-1-phenyl-1H-pyrazolo[3,4-...)
Show SMILES Cc1nc2n(ncc2c(=O)n1N1CCCCCC1)-c1ccccc1
Show InChI InChI=1S/C18H21N5O/c1-14-20-17-16(13-19-22(17)15-9-5-4-6-10-15)18(24)23(14)21-11-7-2-3-8-12-21/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3
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n/an/a 240n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214073
PNG
(5-(4-chlorophenyl)-6-methyl-1-phenyl-1H-pyrazolo[3...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccccc1
Show InChI InChI=1S/C18H13ClN4O/c1-12-21-17-16(11-20-23(17)15-5-3-2-4-6-15)18(24)22(12)14-9-7-13(19)8-10-14/h2-11H,1H3
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n/an/a 242n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214089
PNG
(5-(4-chlorophenyl)-6-methyl-1-o-tolyl-1H-pyrazolo[...)
Show SMILES Cc1ccccc1-n1ncc2c1nc(C)n(-c1ccc(Cl)cc1)c2=O
Show InChI InChI=1S/C19H15ClN4O/c1-12-5-3-4-6-17(12)24-18-16(11-21-24)19(25)23(13(2)22-18)15-9-7-14(20)8-10-15/h3-11H,1-2H3
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n/an/a 350n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214085
PNG
(5-(4-chlorophenyl)-1-cycloheptyl-6-methyl-1H-pyraz...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)C1CCCCCC1
Show InChI InChI=1S/C19H21ClN4O/c1-13-22-18-17(12-21-24(18)16-6-4-2-3-5-7-16)19(25)23(13)15-10-8-14(20)9-11-15/h8-12,16H,2-7H2,1H3
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n/an/a 520n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214077
PNG
(5-cycloheptyl-6-methyl-1-phenyl-1H-pyrazolo[3,4-d]...)
Show SMILES Cc1nc2n(ncc2c(=O)n1C1CCCCCC1)-c1ccccc1
Show InChI InChI=1S/C19H22N4O/c1-14-21-18-17(13-20-23(18)16-11-7-4-8-12-16)19(24)22(14)15-9-5-2-3-6-10-15/h4,7-8,11-13,15H,2-3,5-6,9-10H2,1H3
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n/an/a 760n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214082
PNG
(5-(4-chloro-3-fluorophenyl)-6-methyl-1-phenyl-1H-p...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)c(F)c1)-c1ccccc1
Show InChI InChI=1S/C18H12ClFN4O/c1-11-22-17-14(10-21-24(17)12-5-3-2-4-6-12)18(25)23(11)13-7-8-15(19)16(20)9-13/h2-10H,1H3
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n/an/a 800n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214083
PNG
(1,5-bis(4-chlorophenyl)-6-methyl-1H-pyrazolo[3,4-d...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C18H12Cl2N4O/c1-11-22-17-16(10-21-24(17)15-8-4-13(20)5-9-15)18(25)23(11)14-6-2-12(19)3-7-14/h2-10H,1H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214087
PNG
(4-(5-(4-chlorophenyl)-6-methyl-4-oxo-4,5-dihydropy...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C18H14ClN5O3S/c1-11-22-17-16(18(25)23(11)13-4-2-12(19)3-5-13)10-21-24(17)14-6-8-15(9-7-14)28(20,26)27/h2-10H,1H3,(H2,20,26,27)
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n/an/a 1.41E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214090
PNG
(5-(4-hydroxyphenyl)-6-methyl-1-phenyl-1H-pyrazolo[...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(O)cc1)-c1ccccc1
Show InChI InChI=1S/C18H14N4O2/c1-12-20-17-16(11-19-22(17)14-5-3-2-4-6-14)18(24)21(12)13-7-9-15(23)10-8-13/h2-11,23H,1H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214076
PNG
(6-methyl-1-phenyl-5-(piperidin-1-yl)-1H-pyrazolo[3...)
Show SMILES Cc1nc2n(ncc2c(=O)n1N1CCCCC1)-c1ccccc1
Show InChI InChI=1S/C17H19N5O/c1-13-19-16-15(12-18-21(16)14-8-4-2-5-9-14)17(23)22(13)20-10-6-3-7-11-20/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3
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n/an/a 2.80E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214071
PNG
(5-(azepan-1-yl)-6-methyl-1-phenyl-1H-pyrazolo[3,4-...)
Show SMILES Cc1nc2n(ncc2c(=O)n1N1CCCCCC1)-c1ccccc1
Show InChI InChI=1S/C18H21N5O/c1-14-20-17-16(13-19-22(17)15-9-5-4-6-10-15)18(24)23(14)21-11-7-2-3-8-12-21/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3
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n/an/a 3.60E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214089
PNG
(5-(4-chlorophenyl)-6-methyl-1-o-tolyl-1H-pyrazolo[...)
Show SMILES Cc1ccccc1-n1ncc2c1nc(C)n(-c1ccc(Cl)cc1)c2=O
Show InChI InChI=1S/C19H15ClN4O/c1-12-5-3-4-6-17(12)24-18-16(11-21-24)19(25)23(13(2)22-18)15-9-7-14(20)8-10-15/h3-11H,1-2H3
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n/an/a 9.50E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214073
PNG
(5-(4-chlorophenyl)-6-methyl-1-phenyl-1H-pyrazolo[3...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccccc1
Show InChI InChI=1S/C18H13ClN4O/c1-12-21-17-16(11-20-23(17)15-5-3-2-4-6-15)18(24)22(12)14-9-7-13(19)8-10-14/h2-11H,1H3
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n/an/a 9.60E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214069
PNG
(5-(4-chlorophenyl)-6-methyl-1-(pyrimidin-5-yl)-1H-...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cncnc1
Show InChI InChI=1S/C16H11ClN6O/c1-10-21-15-14(8-20-23(15)13-6-18-9-19-7-13)16(24)22(10)12-4-2-11(17)3-5-12/h2-9H,1H3
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n/an/a 9.80E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214083
PNG
(1,5-bis(4-chlorophenyl)-6-methyl-1H-pyrazolo[3,4-d...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C18H12Cl2N4O/c1-11-22-17-16(10-21-24(17)15-8-4-13(20)5-9-15)18(25)23(11)14-6-2-12(19)3-7-14/h2-10H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214085
PNG
(5-(4-chlorophenyl)-1-cycloheptyl-6-methyl-1H-pyraz...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)C1CCCCCC1
Show InChI InChI=1S/C19H21ClN4O/c1-13-22-18-17(12-21-24(18)16-6-4-2-3-5-7-16)19(25)23(13)15-10-8-14(20)9-11-15/h8-12,16H,2-7H2,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214084
PNG
(6-methyl-1-phenyl-5-(4-(trifluoromethoxy)phenyl)-1...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(OC(F)(F)F)cc1)-c1ccccc1
Show InChI InChI=1S/C19H13F3N4O2/c1-12-24-17-16(11-23-26(17)14-5-3-2-4-6-14)18(27)25(12)13-7-9-15(10-8-13)28-19(20,21)22/h2-11H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214078
PNG
(5-(4-bromophenyl)-6-methyl-1-phenyl-1H-pyrazolo[3,...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Br)cc1)-c1ccccc1
Show InChI InChI=1S/C18H13BrN4O/c1-12-21-17-16(11-20-23(17)15-5-3-2-4-6-15)18(24)22(12)14-9-7-13(19)8-10-14/h2-11H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214087
PNG
(4-(5-(4-chlorophenyl)-6-methyl-4-oxo-4,5-dihydropy...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C18H14ClN5O3S/c1-11-22-17-16(18(25)23(11)13-4-2-12(19)3-5-13)10-21-24(17)14-6-8-15(9-7-14)28(20,26)27/h2-10H,1H3,(H2,20,26,27)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214072
PNG
(5-(4-chlorophenyl)-1-(cyclohexylmethyl)-6-methyl-1...)
Show SMILES Cc1nc2n(CC3CCCCC3)ncc2c(=O)n1-c1ccc(Cl)cc1
Show InChI InChI=1S/C19H21ClN4O/c1-13-22-18-17(11-21-23(18)12-14-5-3-2-4-6-14)19(25)24(13)16-9-7-15(20)8-10-16/h7-11,14H,2-6,12H2,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214081
PNG
(5-(4-chlorophenyl)-6-methyl-1-(pyridin-2-yl)-1H-py...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccccn1
Show InChI InChI=1S/C17H12ClN5O/c1-11-21-16-14(10-20-23(16)15-4-2-3-9-19-15)17(24)22(11)13-7-5-12(18)6-8-13/h2-10H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214080
PNG
(4-(6-methyl-4-oxo-1-phenyl-1H-pyrazolo[3,4-d]pyrim...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1
Show InChI InChI=1S/C18H15N5O3S/c1-12-21-17-16(11-20-23(17)14-5-3-2-4-6-14)18(24)22(12)13-7-9-15(10-8-13)27(19,25)26/h2-11H,1H3,(H2,19,25,26)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214075
PNG
(5-(4-chlorophenyl)-6-methyl-1-(pyridin-3-yl)-1H-py...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cccnc1
Show InChI InChI=1S/C17H12ClN5O/c1-11-21-16-15(10-20-23(16)14-3-2-8-19-9-14)17(24)22(11)13-6-4-12(18)5-7-13/h2-10H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214081
PNG
(5-(4-chlorophenyl)-6-methyl-1-(pyridin-2-yl)-1H-py...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1ccccn1
Show InChI InChI=1S/C17H12ClN5O/c1-11-21-16-14(10-20-23(16)15-4-2-3-9-19-15)17(24)22(11)13-7-5-12(18)6-8-13/h2-10H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214069
PNG
(5-(4-chlorophenyl)-6-methyl-1-(pyrimidin-5-yl)-1H-...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cncnc1
Show InChI InChI=1S/C16H11ClN6O/c1-10-21-15-14(8-20-23(15)13-6-18-9-19-7-13)16(24)22(10)12-4-2-11(17)3-5-12/h2-9H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214088
PNG
(5-(4-chlorophenyl)-6-methyl-1-m-tolyl-1H-pyrazolo[...)
Show SMILES Cc1cccc(c1)-n1ncc2c1nc(C)n(-c1ccc(Cl)cc1)c2=O
Show InChI InChI=1S/C19H15ClN4O/c1-12-4-3-5-16(10-12)24-18-17(11-21-24)19(25)23(13(2)22-18)15-8-6-14(20)7-9-15/h3-11H,1-2H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214074
PNG
(3-(5-(4-chlorophenyl)-6-methyl-4-oxo-4,5-dihydropy...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C18H14ClN5O3S/c1-11-22-17-16(18(25)23(11)13-7-5-12(19)6-8-13)10-21-24(17)14-3-2-4-15(9-14)28(20,26)27/h2-10H,1H3,(H2,20,26,27)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214070
PNG
(6-methyl-1,5-di(pyrazin-2-yl)-1H-pyrazolo[3,4-d]py...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1cnccn1)-c1cnccn1
Show InChI InChI=1S/C14H10N8O/c1-9-20-13-10(6-19-22(13)12-8-16-3-5-18-12)14(23)21(9)11-7-15-2-4-17-11/h2-8H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214070
PNG
(6-methyl-1,5-di(pyrazin-2-yl)-1H-pyrazolo[3,4-d]py...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1cnccn1)-c1cnccn1
Show InChI InChI=1S/C14H10N8O/c1-9-20-13-10(6-19-22(13)12-8-16-3-5-18-12)14(23)21(9)11-7-15-2-4-17-11/h2-8H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214086
PNG
(5-(3-chlorophenyl)-6-methyl-1-phenyl-1H-pyrazolo[3...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1cccc(Cl)c1)-c1ccccc1
Show InChI InChI=1S/C18H13ClN4O/c1-12-21-17-16(11-20-23(17)14-7-3-2-4-8-14)18(24)22(12)15-9-5-6-13(19)10-15/h2-11H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214072
PNG
(5-(4-chlorophenyl)-1-(cyclohexylmethyl)-6-methyl-1...)
Show SMILES Cc1nc2n(CC3CCCCC3)ncc2c(=O)n1-c1ccc(Cl)cc1
Show InChI InChI=1S/C19H21ClN4O/c1-13-22-18-17(11-21-23(18)12-14-5-3-2-4-6-14)19(25)24(13)16-9-7-15(20)8-10-16/h7-11,14H,2-6,12H2,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214080
PNG
(4-(6-methyl-4-oxo-1-phenyl-1H-pyrazolo[3,4-d]pyrim...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1
Show InChI InChI=1S/C18H15N5O3S/c1-12-21-17-16(11-20-23(17)14-5-3-2-4-6-14)18(24)22(12)13-7-9-15(10-8-13)27(19,25)26/h2-11H,1H3,(H2,19,25,26)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214079
PNG
(1-(3-chlorophenyl)-5-(4-chlorophenyl)-6-methyl-1H-...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)cc1)-c1cccc(Cl)c1
Show InChI InChI=1S/C18H12Cl2N4O/c1-11-22-17-16(10-21-24(17)15-4-2-3-13(20)9-15)18(25)23(11)14-7-5-12(19)6-8-14/h2-10H,1H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50214084
PNG
(6-methyl-1-phenyl-5-(4-(trifluoromethoxy)phenyl)-1...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(OC(F)(F)F)cc1)-c1ccccc1
Show InChI InChI=1S/C19H13F3N4O2/c1-12-24-17-16(11-23-26(17)14-5-3-2-4-6-14)18(27)25(12)13-7-9-15(10-8-13)28-19(20,21)22/h2-11H,1H3
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214082
PNG
(5-(4-chloro-3-fluorophenyl)-6-methyl-1-phenyl-1H-p...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(Cl)c(F)c1)-c1ccccc1
Show InChI InChI=1S/C18H12ClFN4O/c1-11-22-17-14(10-21-24(17)12-5-3-2-4-6-12)18(25)23(11)13-7-8-15(19)16(20)9-13/h2-10H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50214090
PNG
(5-(4-hydroxyphenyl)-6-methyl-1-phenyl-1H-pyrazolo[...)
Show SMILES Cc1nc2n(ncc2c(=O)n1-c1ccc(O)cc1)-c1ccccc1
Show InChI InChI=1S/C18H14N4O2/c1-12-20-17-16(11-19-22(17)14-5-3-2-4-6-14)18(24)21(12)13-7-9-15(23)10-8-13/h2-11,23H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 receptor expressed in 132N1 cells assessed as inhibition of glutamate-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 17: 4303-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.028
BindingDB Entry DOI: 10.7270/Q2445M5T
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%