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Compile Data Set for Download or QSAR

Found 103 hits with Last Name = 'kinsora' and Initial = 'jj'   
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 5


(Rattus norvegicus (Rat))
BDBM50084137
PNG
(2-Methyl-6-(phenylethynyl)pyridine | 2-Methyl-6-ph...)
Show SMILES Cc1cccc(n1)C#Cc1ccccc1
Show InChI InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3
PDB
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PubMed
5.70n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]MPEP from mGlu5 receptor in rat brain


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216746
PNG
(3-fluoro-5-(2-methylquinolin-7-yl)benzonitrile | C...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cc(F)cc(c1)C#N
Show InChI InChI=1S/C17H11FN2/c1-11-2-3-13-4-5-14(9-17(13)20-11)15-6-12(10-19)7-16(18)8-15/h2-9H,1H3
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22n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]MPEP from mGlu5 receptor in rat brain


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50210964
PNG
(3-(2-methylquinolin-7-yl)benzonitrile | CHEMBL2447...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cccc(c1)C#N
Show InChI InChI=1S/C17H12N2/c1-12-5-6-14-7-8-16(10-17(14)19-12)15-4-2-3-13(9-15)11-18/h2-10H,1H3
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72n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]MPEP from mGlu5 receptor in rat brain


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50084137
PNG
(2-Methyl-6-(phenylethynyl)pyridine | 2-Methyl-6-ph...)
Show SMILES Cc1cccc(n1)C#Cc1ccccc1
Show InChI InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3
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n/an/a 0.200n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220087
PNG
(2-(3,5-dichlorophenyl)-7-methylpyrido[2,3-d]pyrimi...)
Show SMILES Cc1ccc2cnc(nc2n1)-c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C14H9Cl2N3/c1-8-2-3-9-7-17-13(19-14(9)18-8)10-4-11(15)6-12(16)5-10/h2-7H,1H3
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n/an/a 0.720n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216746
PNG
(3-fluoro-5-(2-methylquinolin-7-yl)benzonitrile | C...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cc(F)cc(c1)C#N
Show InChI InChI=1S/C17H11FN2/c1-11-2-3-13-4-5-14(9-17(13)20-11)15-6-12(10-19)7-16(18)8-15/h2-9H,1H3
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n/an/a 0.800n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220096
PNG
(3-methoxy-5-(7-methylpyrido[2,3-d]pyrimidin-2-yl)b...)
Show SMILES COc1cc(cc(c1)-c1ncc2ccc(C)nc2n1)C#N
Show InChI InChI=1S/C16H12N4O/c1-10-3-4-12-9-18-15(20-16(12)19-10)13-5-11(8-17)6-14(7-13)21-2/h3-7,9H,1-2H3
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n/an/a 1.20n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216762
PNG
(3-chloro-5-(2-methylquinolin-7-yl)benzonitrile | C...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cc(Cl)cc(c1)C#N
Show InChI InChI=1S/C17H11ClN2/c1-11-2-3-13-4-5-14(9-17(13)20-11)15-6-12(10-19)7-16(18)8-15/h2-9H,1H3
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n/an/a 1.40n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216758
PNG
(3-methyl-5-(2-methylquinolin-7-yl)benzonitrile | C...)
Show SMILES Cc1cc(cc(c1)-c1ccc2ccc(C)nc2c1)C#N
Show InChI InChI=1S/C18H14N2/c1-12-7-14(11-19)9-17(8-12)16-6-5-15-4-3-13(2)20-18(15)10-16/h3-10H,1-2H3
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n/an/a 1.60n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216750
PNG
(5-(2-methylquinolin-7-yl)isophthalonitrile | CHEMB...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cc(cc(c1)C#N)C#N
Show InChI InChI=1S/C18H11N3/c1-12-2-3-15-4-5-16(9-18(15)21-12)17-7-13(10-19)6-14(8-17)11-20/h2-9H,1H3
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n/an/a 2n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216749
PNG
(3-(methoxymethyl)-5-(2-methylquinolin-7-yl)benzoni...)
Show SMILES COCc1cc(cc(c1)-c1ccc2ccc(C)nc2c1)C#N
Show InChI InChI=1S/C19H16N2O/c1-13-3-4-16-5-6-17(10-19(16)21-13)18-8-14(11-20)7-15(9-18)12-22-2/h3-10H,12H2,1-2H3
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n/an/a 2n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216761
PNG
(3-methoxy-5-(2-methylquinolin-7-yl)benzonitrile | ...)
Show SMILES COc1cc(cc(c1)-c1ccc2ccc(C)nc2c1)C#N
Show InChI InChI=1S/C18H14N2O/c1-12-3-4-14-5-6-15(10-18(14)20-12)16-7-13(11-19)8-17(9-16)21-2/h3-10H,1-2H3
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n/an/a 2.40n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220088
PNG
(3-methoxy-5-(pyrido[2,3-d]pyrimidin-2-yl)benzonitr...)
Show SMILES COc1cc(cc(c1)-c1ncc2cccnc2n1)C#N
Show InChI InChI=1S/C15H10N4O/c1-20-13-6-10(8-16)5-12(7-13)15-18-9-11-3-2-4-17-14(11)19-15/h2-7,9H,1H3
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n/an/a 4.95n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224920
PNG
(3-methoxy-5-(2-methyl-1,6-naphthyridin-7-yl)benzon...)
Show SMILES COc1cc(cc(c1)-c1cc2nc(C)ccc2cn1)C#N
Show InChI InChI=1S/C17H13N3O/c1-11-3-4-13-10-19-16(8-17(13)20-11)14-5-12(9-18)6-15(7-14)21-2/h3-8,10H,1-2H3
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n/an/a 6.19n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50210964
PNG
(3-(2-methylquinolin-7-yl)benzonitrile | CHEMBL2447...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cccc(c1)C#N
Show InChI InChI=1S/C17H12N2/c1-12-5-6-14-7-8-16(10-17(14)19-12)15-4-2-3-13(9-15)11-18/h2-10H,1H3
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n/an/a 7.70n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216741
PNG
(3-bromo-5-(2-methylquinolin-7-yl)benzonitrile | CH...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cc(Br)cc(c1)C#N
Show InChI InChI=1S/C17H11BrN2/c1-11-2-3-13-4-5-14(9-17(13)20-11)15-6-12(10-19)7-16(18)8-15/h2-9H,1H3
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n/an/a 13n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216770
PNG
(3-ethoxy-5-(2-methylquinolin-7-yl)benzonitrile | C...)
Show SMILES CCOc1cc(cc(c1)-c1ccc2ccc(C)nc2c1)C#N
Show InChI InChI=1S/C19H16N2O/c1-3-22-18-9-14(12-20)8-17(10-18)16-7-6-15-5-4-13(2)21-19(15)11-16/h4-11H,3H2,1-2H3
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n/an/a 17n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216745
PNG
(5-(2-methylquinolin-7-yl)nicotinonitrile | CHEMBL2...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cncc(c1)C#N
Show InChI InChI=1S/C16H11N3/c1-11-2-3-13-4-5-14(7-16(13)19-11)15-6-12(8-17)9-18-10-15/h2-7,9-10H,1H3
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n/an/a 23n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220085
PNG
(2-(3-bromophenyl)-7-methylpyrido[2,3-d]pyrimidine ...)
Show SMILES Cc1ccc2cnc(nc2n1)-c1cccc(Br)c1
Show InChI InChI=1S/C14H10BrN3/c1-9-5-6-11-8-16-13(18-14(11)17-9)10-3-2-4-12(15)7-10/h2-8H,1H3
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n/an/a 38n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220076
PNG
(2-(3-fluoro-5-methylphenyl)-7-methylpyrido[2,3-d]p...)
Show SMILES Cc1cc(F)cc(c1)-c1ncc2ccc(C)nc2n1
Show InChI InChI=1S/C15H12FN3/c1-9-5-12(7-13(16)6-9)14-17-8-11-4-3-10(2)18-15(11)19-14/h3-8H,1-2H3
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n/an/a 39.7n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224924
PNG
(2-(3,4-dimethylphenyl)-1,8-naphthyridine | CHEMBL2...)
Show SMILES Cc1ccc(cc1C)-c1ccc2cccnc2n1
Show InChI InChI=1S/C16H14N2/c1-11-5-6-14(10-12(11)2)15-8-7-13-4-3-9-17-16(13)18-15/h3-10H,1-2H3
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n/an/a 45n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224929
PNG
(2-(3-bromophenyl)-7-methyl-1,8-naphthyridine | CHE...)
Show SMILES Cc1ccc2ccc(nc2n1)-c1cccc(Br)c1
Show InChI InChI=1S/C15H11BrN2/c1-10-5-6-11-7-8-14(18-15(11)17-10)12-3-2-4-13(16)9-12/h2-9H,1H3
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n/an/a 47.9n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224922
PNG
(2-(3,5-dimethoxyphenyl)-7-methyl-1,8-naphthyridine...)
Show SMILES COc1cc(OC)cc(c1)-c1ccc2ccc(C)nc2n1
Show InChI InChI=1S/C17H16N2O2/c1-11-4-5-12-6-7-16(19-17(12)18-11)13-8-14(20-2)10-15(9-13)21-3/h4-10H,1-3H3
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n/an/a 51.7n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220084
PNG
(7-methyl-2-m-tolylpyrido[2,3-d]pyrimidine | CHEMBL...)
Show SMILES Cc1cccc(c1)-c1ncc2ccc(C)nc2n1
Show InChI InChI=1S/C15H13N3/c1-10-4-3-5-12(8-10)14-16-9-13-7-6-11(2)17-15(13)18-14/h3-9H,1-2H3
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n/an/a 53n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224932
PNG
(3-methoxy-5-(1,5-naphthyridin-3-yl)benzonitrile | ...)
Show SMILES COc1cc(cc(c1)-c1cnc2cccnc2c1)C#N
Show InChI InChI=1S/C16H11N3O/c1-20-14-6-11(9-17)5-12(7-14)13-8-16-15(19-10-13)3-2-4-18-16/h2-8,10H,1H3
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n/an/a 55n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224941
PNG
(2-(3,5-dimethoxyphenyl)-1,8-naphthyridine | CHEMBL...)
Show SMILES COc1cc(OC)cc(c1)-c1ccc2cccnc2n1
Show InChI InChI=1S/C16H14N2O2/c1-19-13-8-12(9-14(10-13)20-2)15-6-5-11-4-3-7-17-16(11)18-15/h3-10H,1-2H3
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n/an/a 67n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224940
PNG
(3-methoxy-5-(1,6-naphthyridin-7-yl)benzonitrile | ...)
Show SMILES COc1cc(cc(c1)-c1cc2ncccc2cn1)C#N
Show InChI InChI=1S/C16H11N3O/c1-20-14-6-11(9-17)5-13(7-14)16-8-15-12(10-19-16)3-2-4-18-15/h2-8,10H,1H3
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n/an/a 68n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50080153
PNG
((1-Aminomethyl-cyclohexyl)-acetic acid | 2-(1-(ami...)
Show SMILES NCC1(CC(O)=O)CCCCC1
Show InChI InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)
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n/an/a 70n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha-2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2333-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.05.016
BindingDB Entry DOI: 10.7270/Q2CV4JJZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216752
PNG
(3-(ethylthio)-5-(2-methylquinolin-7-yl)benzonitril...)
Show SMILES CCSc1cc(cc(c1)-c1ccc2ccc(C)nc2c1)C#N
Show InChI InChI=1S/C19H16N2S/c1-3-22-18-9-14(12-20)8-17(10-18)16-7-6-15-5-4-13(2)21-19(15)11-16/h4-11H,3H2,1-2H3
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n/an/a 72n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216766
PNG
(3-(2-methylquinolin-7-yl)-5-(trifluoromethoxy)benz...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cc(OC(F)(F)F)cc(c1)C#N
Show InChI InChI=1S/C18H11F3N2O/c1-11-2-3-13-4-5-14(9-17(13)23-11)15-6-12(10-22)7-16(8-15)24-18(19,20)21/h2-9H,1H3
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n/an/a 75n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216768
PNG
(3-(2-methoxyethoxy)-5-(2-methylquinolin-7-yl)benzo...)
Show SMILES COCCOc1cc(cc(c1)-c1ccc2ccc(C)nc2c1)C#N
Show InChI InChI=1S/C20H18N2O2/c1-14-3-4-16-5-6-17(12-20(16)22-14)18-9-15(13-21)10-19(11-18)24-8-7-23-2/h3-6,9-12H,7-8H2,1-2H3
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n/an/a 82n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50168499
PNG
((1-((1H-tetrazol-5-yl)methyl)cycloheptyl)methanami...)
Show SMILES NCC1(Cc2nnn[nH]2)CCCCCC1
Show InChI InChI=1S/C10H19N5/c11-8-10(5-3-1-2-4-6-10)7-9-12-14-15-13-9/h1-8,11H2,(H,12,13,14,15)
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n/an/a 100n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha-2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2333-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.05.016
BindingDB Entry DOI: 10.7270/Q2CV4JJZ
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50212317
PNG
((1-((1H-tetrazol-5-yl)methyl)cyclohexyl)methanamin...)
Show SMILES NCC1(Cc2nnn[nH]2)CCCCC1
Show InChI InChI=1S/C9H17N5/c10-7-9(4-2-1-3-5-9)6-8-11-13-14-12-8/h1-7,10H2,(H,11,12,13,14)
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n/an/a 108n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha-2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2333-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.05.016
BindingDB Entry DOI: 10.7270/Q2CV4JJZ
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224923
PNG
(3-(1,8-naphthyridin-2-yl)benzonitrile | CHEMBL2353...)
Show SMILES N#Cc1cccc(c1)-c1ccc2cccnc2n1
Show InChI InChI=1S/C15H9N3/c16-10-11-3-1-4-13(9-11)14-7-6-12-5-2-8-17-15(12)18-14/h1-9H
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n/an/a 115n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224936
PNG
(2-(3-chlorophenyl)-7-methyl-1,8-naphthyridine | CH...)
Show SMILES Cc1ccc2ccc(nc2n1)-c1cccc(Cl)c1
Show InChI InChI=1S/C15H11ClN2/c1-10-5-6-11-7-8-14(18-15(11)17-10)12-3-2-4-13(16)9-12/h2-9H,1H3
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n/an/a 177n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220079
PNG
(2-(3,5-dimethoxyphenyl)-7-methylpyrido[2,3-d]pyrim...)
Show SMILES COc1cc(OC)cc(c1)-c1ncc2ccc(C)nc2n1
Show InChI InChI=1S/C16H15N3O2/c1-10-4-5-11-9-17-15(19-16(11)18-10)12-6-13(20-2)8-14(7-12)21-3/h4-9H,1-3H3
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n/an/a 179n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224925
PNG
(2-(3,5-difluorophenyl)-7-methyl-1,8-naphthyridine ...)
Show SMILES Cc1ccc2ccc(nc2n1)-c1cc(F)cc(F)c1
Show InChI InChI=1S/C15H10F2N2/c1-9-2-3-10-4-5-14(19-15(10)18-9)11-6-12(16)8-13(17)7-11/h2-8H,1H3
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n/an/a 181n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224917
PNG
(2-m-tolyl-1,8-naphthyridine | CHEMBL395902)
Show SMILES Cc1cccc(c1)-c1ccc2cccnc2n1
Show InChI InChI=1S/C15H12N2/c1-11-4-2-5-13(10-11)14-8-7-12-6-3-9-16-15(12)17-14/h2-10H,1H3
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n/an/a 225n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220077
PNG
(2-(3,5-dichlorophenyl)pyrido[2,3-d]pyrimidine | CH...)
Show SMILES Clc1cc(Cl)cc(c1)-c1ncc2cccnc2n1
Show InChI InChI=1S/C13H7Cl2N3/c14-10-4-9(5-11(15)6-10)13-17-7-8-2-1-3-16-12(8)18-13/h1-7H
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n/an/a 228n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220094
PNG
(3-(7-methylpyrido[2,3-d]pyrimidin-2-yl)benzonitril...)
Show SMILES Cc1ccc2cnc(nc2n1)-c1cccc(c1)C#N
Show InChI InChI=1S/C15H10N4/c1-10-5-6-13-9-17-14(19-15(13)18-10)12-4-2-3-11(7-12)8-16/h2-7,9H,1H3
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n/an/a 240n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224939
PNG
(2-methyl-7-m-tolyl-1,8-naphthyridine | CHEMBL23562...)
Show SMILES Cc1cccc(c1)-c1ccc2ccc(C)nc2n1
Show InChI InChI=1S/C16H14N2/c1-11-4-3-5-14(10-11)15-9-8-13-7-6-12(2)17-16(13)18-15/h3-10H,1-2H3
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n/an/a 277n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216767
PNG
(3-isopropoxy-5-(2-methylquinolin-7-yl)benzonitrile...)
Show SMILES CC(C)Oc1cc(cc(c1)-c1ccc2ccc(C)nc2c1)C#N
Show InChI InChI=1S/C20H18N2O/c1-13(2)23-19-9-15(12-21)8-18(10-19)17-7-6-16-5-4-14(3)22-20(16)11-17/h4-11,13H,1-3H3
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n/an/a 310n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220082
PNG
(2-(3-fluoro-5-methylphenyl)pyrido[2,3-d]pyrimidine...)
Show SMILES Cc1cc(F)cc(c1)-c1ncc2cccnc2n1
Show InChI InChI=1S/C14H10FN3/c1-9-5-11(7-12(15)6-9)14-17-8-10-3-2-4-16-13(10)18-14/h2-8H,1H3
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Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50220083
PNG
(2-(3-bromophenyl)pyrido[2,3-d]pyrimidine | CHEMBL2...)
Show SMILES Brc1cccc(c1)-c1ncc2cccnc2n1
Show InChI InChI=1S/C13H8BrN3/c14-11-5-1-3-9(7-11)12-16-8-10-4-2-6-15-13(10)17-12/h1-8H
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Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonistic activity at rat mGluR5 expressed in CHO cells assessed as inhibition of quisqualate stimulated calcium mobilization by FLIPR technology


Bioorg Med Chem Lett 17: 5396-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.047
BindingDB Entry DOI: 10.7270/Q2JH3KWK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224926
PNG
(7-(3,5-dimethoxyphenyl)-2-methyl-1,6-naphthyridine...)
Show SMILES COc1cc(OC)cc(c1)-c1cc2nc(C)ccc2cn1
Show InChI InChI=1S/C17H16N2O2/c1-11-4-5-12-10-18-16(9-17(12)19-11)13-6-14(20-2)8-15(7-13)21-3/h4-10H,1-3H3
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Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216737
PNG
(3-hydroxy-5-(2-methylquinolin-7-yl)benzonitrile | ...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cc(O)cc(c1)C#N
Show InChI InChI=1S/C17H12N2O/c1-11-2-3-13-4-5-14(9-17(13)19-11)15-6-12(10-18)7-16(20)8-15/h2-9,20H,1H3
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216769
PNG
(2-(3-(2-methylquinolin-7-yl)phenyl)acetonitrile | ...)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cccc(CC#N)c1
Show InChI InChI=1S/C18H14N2/c1-13-5-6-15-7-8-17(12-18(15)20-13)16-4-2-3-14(11-16)9-10-19/h2-8,11-12H,9H2,1H3
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224921
PNG
(3-(methoxymethoxy)-5-(1,6-naphthyridin-7-yl)benzon...)
Show SMILES COCOc1cc(cc(c1)-c1cc2ncccc2cn1)C#N
Show InChI InChI=1S/C17H13N3O2/c1-21-11-22-15-6-12(9-18)5-14(7-15)17-8-16-13(10-20-17)3-2-4-19-16/h2-8,10H,11H2,1H3
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Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50224931
PNG
(3-(7-methyl-1,8-naphthyridin-2-yl)benzonitrile | C...)
Show SMILES Cc1ccc2ccc(nc2n1)-c1cccc(c1)C#N
Show InChI InChI=1S/C16H11N3/c1-11-5-6-13-7-8-15(19-16(13)18-11)14-4-2-3-12(9-14)10-17/h2-9H,1H3
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Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization


Bioorg Med Chem Lett 17: 6525-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.083
BindingDB Entry DOI: 10.7270/Q2V40TXS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))
BDBM50216747
PNG
(2-methyl-7-(pyridin-3-yl)quinoline | CHEMBL231763)
Show SMILES Cc1ccc2ccc(cc2n1)-c1cccnc1
Show InChI InChI=1S/C15H12N2/c1-11-4-5-12-6-7-13(9-15(12)17-11)14-3-2-8-16-10-14/h2-10H,1H3
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Activity at rat mGlu5 receptor expressed in CHO cells assessed as inhibition of quisqualate-stimulated calcium mobilization by FLIPR assay


Bioorg Med Chem Lett 17: 4415-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.030
BindingDB Entry DOI: 10.7270/Q28G8KDC
More data for this
Ligand-Target Pair
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