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USPatent US8609852

Compile data set for download or QSAR
Found 103 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 5


(Rattus norvegicus (Rat))		BDBM109106
PNG
(US8609852, 13)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)-c1ccccc1C
Show InChI InChI=1S/C17H13N3S/c1-12-5-3-4-6-16(12)17-18-9-14(10-19-17)7-8-15-11-21-13(2)20-15/h3-6,9-11H,1-2H3
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US Patent
 0.600 -52.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109136
PNG
(US8609852, 43)
Show SMILES Cc1nc(cs1)C#Cc1cncc(c1)-c1cccc(Cl)c1
Show InChI InChI=1S/C17H11ClN2S/c1-12-20-17(11-21-12)6-5-13-7-15(10-19-9-13)14-3-2-4-16(18)8-14/h2-4,7-11H,1H3
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US Patent
 0.650 -52.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109101
PNG
(US8609852, 7)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1ccccc1Cl
Show InChI InChI=1S/C17H11ClN2S/c1-12-20-14(11-21-12)8-6-13-7-9-17(19-10-13)15-4-2-3-5-16(15)18/h2-5,7,9-11H,1H3
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 0.700 -52.3n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109157
PNG
(US8609852, 64)
Show SMILES CSc1ccccc1-c1ccc(c[nH+]1)C#Cc1csc(C)n1
Show InChI InChI=1S/C18H14N2S2/c1-13-20-15(12-22-13)9-7-14-8-10-17(19-11-14)16-5-3-4-6-18(16)21-2/h3-6,8,10-12H,1-2H3/p+1
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 0.800 -51.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109121
PNG
(US8609852, 28)
Show SMILES Cc1nc(cs1)C#Cc1ccc(SC(C)(C)C)nc1
Show InChI InChI=1S/C15H16N2S2/c1-11-17-13(10-18-11)7-5-12-6-8-14(16-9-12)19-15(2,3)4/h6,8-10H,1-4H3
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 0.900 -51.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109102
PNG
(US8609852, 8)
Show SMILES COc1ccccc1-c1ccc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C18H14N2OS/c1-13-20-15(12-22-13)9-7-14-8-10-17(19-11-14)16-5-3-4-6-18(16)21-2/h3-6,8,10-12H,1-2H3
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 0.900 -51.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109115
PNG
(US8609852, 117 | US8609852, 34)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(NC(C)(C)C)nc1
Show InChI InChI=1S/C14H16N4S/c1-10-17-12(9-19-10)6-5-11-7-15-13(16-8-11)18-14(2,3)4/h7-9H,1-4H3,(H,15,16,18)/p+1
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 0.900 -51.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109099
PNG
(US8609852, 5)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1ccccc1C
Show InChI InChI=1S/C18H14N2S/c1-13-5-3-4-6-17(13)18-10-8-15(11-19-18)7-9-16-12-21-14(2)20-16/h3-6,8,10-12H,1-2H3
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 1 -51.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109182
PNG
(US8609852, 91)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cncc(Oc2cccnc2)c1
Show InChI InChI=1S/C16H11N3OS/c1-12-19-14(11-21-12)5-4-13-7-16(10-18-8-13)20-15-3-2-6-17-9-15/h2-3,6-11H,1H3/p+1
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 1 -51.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109120
PNG
(US8609852, 27)
Show SMILES Cc1nc(cs1)C#Cc1ccc(OC(C)(C)C)nc1
Show InChI InChI=1S/C15H16N2OS/c1-11-17-13(10-19-11)7-5-12-6-8-14(16-9-12)18-15(2,3)4/h6,8-10H,1-4H3
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 1 -51.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109176
PNG
(US8609852, 85)
Show SMILES Cc1nc(cs1)C#Cc1cncc(c1)-c1cccc(c1)C#N
Show InChI InChI=1S/C18H11N3S/c1-13-21-18(12-22-13)6-5-15-8-17(11-20-10-15)16-4-2-3-14(7-16)9-19/h2-4,7-8,10-12H,1H3
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 1 -51.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109115
PNG
(US8609852, 117 | US8609852, 34)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(NC(C)(C)C)nc1
Show InChI InChI=1S/C14H16N4S/c1-10-17-12(9-19-10)6-5-11-7-15-13(16-8-11)18-14(2,3)4/h7-9H,1-4H3,(H,15,16,18)/p+1
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 1 -51.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109105
PNG
(US8609852, 12)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)-c1cc(F)ccc1C
Show InChI InChI=1S/C18H13FN2S/c1-12-3-6-15(19)9-17(12)18-8-5-14(10-20-18)4-7-16-11-22-13(2)21-16/h3,5-6,8-11H,1-2H3/p+1
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 1.10 -51.1n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109100
PNG
(US8609852, 6)
Show SMILES COc1ccc(F)cc1-c1ccc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C18H13FN2OS/c1-12-21-15(11-23-12)6-3-13-4-7-17(20-10-13)16-9-14(19)5-8-18(16)22-2/h4-5,7-11H,1-2H3
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 1.20 -50.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109113
PNG
(US8609852, 20)
Show SMILES CC1CCCN1c1ccc(c[nH+]1)C#Cc1csc(C)n1
Show InChI InChI=1S/C16H17N3S/c1-12-4-3-9-19(12)16-8-6-14(10-17-16)5-7-15-11-20-13(2)18-15/h6,8,10-12H,3-4,9H2,1-2H3/p+1
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 1.40 -50.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50181753
PNG
(3-[(2-methyl-4-thiazolyl)ethynyl]-5-vinylpyridine ...)
Show SMILES Cc1nc(cs1)C#Cc1cncc(C=C)c1
Show InChI InChI=1S/C13H10N2S/c1-3-11-6-12(8-14-7-11)4-5-13-9-16-10(2)15-13/h3,6-9H,1H2,2H3
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 1.40 -50.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109147
PNG
(US8609852, 54)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cc(C)ccc1F
Show InChI InChI=1S/C18H13FN2S/c1-12-3-7-17(19)16(9-12)18-8-5-14(10-20-18)4-6-15-11-22-13(2)21-15/h3,5,7-11H,1-2H3
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 1.5 -50.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109151
PNG
(US8609852, 58)
Show SMILES CC1CCC(C)N1c1ccc(cn1)C#Cc1csc(C)[nH+]1
Show InChI InChI=1S/C17H19N3S/c1-12-4-5-13(2)20(12)17-9-7-15(10-18-17)6-8-16-11-21-14(3)19-16/h7,9-13H,4-5H2,1-3H3/p+1
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 1.5 -50.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109153
PNG
(US8609852, 60)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)-c1cccc(Cl)c1C
Show InChI InChI=1S/C18H13ClN2S/c1-12-16(4-3-5-17(12)19)18-9-7-14(10-20-18)6-8-15-11-22-13(2)21-15/h3-5,7,9-11H,1-2H3/p+1
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 1.5 -50.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109114
PNG
(US8609852, 21)
Show SMILES CC1CCCN1c1ncc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C15H16N4S/c1-11-4-3-7-19(11)15-16-8-13(9-17-15)5-6-14-10-20-12(2)18-14/h8-11H,3-4,7H2,1-2H3
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 1.5 -50.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109116
PNG
(US8609852, 23)
Show SMILES CC1CCCN(C1)c1ncc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C16H18N4S/c1-12-4-3-7-20(10-12)16-17-8-14(9-18-16)5-6-15-11-21-13(2)19-15/h8-9,11-12H,3-4,7,10H2,1-2H3
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 1.60 -50.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109194
PNG
(US8609852, 103)
Show SMILES CC1CCCN(C1)c1ncc(cn1)C#Cc1csc(C)[nH+]1
Show InChI InChI=1S/C16H18N4S/c1-12-4-3-7-20(10-12)16-17-8-14(9-18-16)5-6-15-11-21-13(2)19-15/h8-9,11-12H,3-4,7,10H2,1-2H3/p+1
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 1.60 -50.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109166
PNG
(US8609852, 73)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)C1CC2CCC1C2 |THB:11:14:17.18:20|
Show InChI InChI=1S/C18H18N2S/c1-12-20-16(11-21-12)6-3-13-4-7-18(19-10-13)17-9-14-2-5-15(17)8-14/h4,7,10-11,14-15,17H,2,5,8-9H2,1H3/p+1
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109096
PNG
(US8609852, 2)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1ccccc1F
Show InChI InChI=1S/C17H11FN2S/c1-12-20-14(11-21-12)8-6-13-7-9-17(19-10-13)15-4-2-3-5-16(15)18/h2-5,7,9-11H,1H3
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109119
PNG
(US8609852, 26)
Show SMILES CC(C)Oc1ccc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C14H14N2OS/c1-10(2)17-14-7-5-12(8-15-14)4-6-13-9-18-11(3)16-13/h5,7-10H,1-3H3
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109137
PNG
(US8609852, 44)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)-c1ccccc1CO
Show InChI InChI=1S/C18H14N2OS/c1-13-20-16(12-22-13)8-6-14-7-9-18(19-10-14)17-5-3-2-4-15(17)11-21/h2-5,7,9-10,12,21H,11H2,1H3/p+1
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109173
PNG
(US8609852, 82)
Show SMILES CN(c1cccnc1)c1cncc(c1)C#Cc1csc(C)[nH+]1
Show InChI InChI=1S/C17H14N4S/c1-13-20-15(12-22-13)6-5-14-8-17(11-19-9-14)21(2)16-4-3-7-18-10-16/h3-4,7-12H,1-2H3/p+1
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109180
PNG
(US8609852, 89)
Show SMILES CCOc1ccccc1-c1ccc(c[nH+]1)C#Cc1csc(C)n1
Show InChI InChI=1S/C19H16N2OS/c1-3-22-19-7-5-4-6-17(19)18-11-9-15(12-20-18)8-10-16-13-23-14(2)21-16/h4-7,9,11-13H,3H2,1-2H3/p+1
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109145
PNG
(US8609852, 52)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cccc(C)c1
Show InChI InChI=1S/C18H14N2S/c1-13-4-3-5-16(10-13)18-9-7-15(11-19-18)6-8-17-12-21-14(2)20-17/h3-5,7,9-12H,1-2H3
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109139
PNG
(US8609852, 46)
Show SMILES Cc1[nH+]c(cs1)C#Cc1ccc([nH+]c1)-c1ccc(F)cc1
Show InChI InChI=1S/C17H11FN2S/c1-12-20-16(11-21-12)8-2-13-3-9-17(19-10-13)14-4-6-15(18)7-5-14/h3-7,9-11H,1H3/p+2
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 2 -49.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109123
PNG
(US8609852, 30)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)C1CCCCC1
Show InChI InChI=1S/C17H18N2S/c1-13-19-16(12-20-13)9-7-14-8-10-17(18-11-14)15-5-3-2-4-6-15/h8,10-12,15H,2-6H2,1H3/p+1
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 2.30 -49.3n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109098
PNG
(US8609852, 4)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1ccccc1C#N
Show InChI InChI=1S/C18H11N3S/c1-13-21-16(12-22-13)8-6-14-7-9-18(20-11-14)17-5-3-2-4-15(17)10-19/h2-5,7,9,11-12H,1H3
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 2.60 -49.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109117
PNG
(US8609852, 24)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)N1CCCCC1
Show InChI InChI=1S/C15H16N4S/c1-12-18-14(11-20-12)6-5-13-9-16-15(17-10-13)19-7-3-2-4-8-19/h9-11H,2-4,7-8H2,1H3
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 2.60 -49.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109108
PNG
(US8609852, 15)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)-c1ccccc1Cl
Show InChI InChI=1S/C16H10ClN3S/c1-11-20-13(10-21-11)7-6-12-8-18-16(19-9-12)14-4-2-3-5-15(14)17/h2-5,8-10H,1H3
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 2.60 -49.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109097
PNG
(US8609852, 3)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cccc(F)c1
Show InChI InChI=1S/C17H11FN2S/c1-12-20-16(11-21-12)7-5-13-6-8-17(19-10-13)14-3-2-4-15(18)9-14/h2-4,6,8-11H,1H3
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 2.70 -48.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109112
PNG
(US8609852, 19)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)N1CCCCC1
Show InChI InChI=1S/C16H17N3S/c1-13-18-15(12-20-13)7-5-14-6-8-16(17-11-14)19-9-3-2-4-10-19/h6,8,11-12H,2-4,9-10H2,1H3/p+1
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 2.80 -48.8n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109169
PNG
(US8609852, 76)
Show SMILES Cc1[nH+]c(cs1)C#Cc1c[nH+]cc(c1)C1CC1
Show InChI InChI=1S/C14H12N2S/c1-10-16-14(9-17-10)5-2-11-6-13(8-15-7-11)12-3-4-12/h6-9,12H,3-4H2,1H3/p+2
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 3 -48.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50123009
PNG
(3-Methyl-5-(2-methyl-thiazol-4-ylethynyl)-pyridine...)
Show SMILES Cc1nc(cs1)C#Cc1cncc(C)c1
Show InChI InChI=1S/C12H10N2S/c1-9-5-11(7-13-6-9)3-4-12-8-15-10(2)14-12/h5-8H,1-2H3
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 3 -48.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109184
PNG
(US8609852, 93)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(nc1)N1CCCCCC1
Show InChI InChI=1S/C16H18N4S/c1-13-19-15(12-21-13)7-6-14-10-17-16(18-11-14)20-8-4-2-3-5-9-20/h10-12H,2-5,8-9H2,1H3/p+1
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 3 -48.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109129
PNG
(US8609852, 36)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1c(C)cccc1C
Show InChI InChI=1S/C19H16N2S/c1-13-5-4-6-14(2)19(13)18-10-8-16(11-20-18)7-9-17-12-22-15(3)21-17/h4-6,8,10-12H,1-3H3
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 3 -48.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109110
PNG
(US8609852, 17)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-n1ccc2cccnc12
Show InChI InChI=1S/C18H12N4S/c1-13-21-16(12-23-13)6-4-14-5-7-17(20-11-14)22-10-8-15-3-2-9-19-18(15)22/h2-3,5,7-12H,1H3
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 3.80 -48.1n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109179
PNG
(US8609852, 88)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)N1CCC(F)CC1
Show InChI InChI=1S/C16H16FN3S/c1-12-19-15(11-21-12)4-2-13-3-5-16(18-10-13)20-8-6-14(17)7-9-20/h3,5,10-11,14H,6-9H2,1H3
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 4 -47.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109148
PNG
(US8609852, 55)
Show SMILES CCc1ccccc1-c1ccc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C19H16N2S/c1-3-16-6-4-5-7-18(16)19-11-9-15(12-20-19)8-10-17-13-22-14(2)21-17/h4-7,9,11-13H,3H2,1-2H3
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 4 -47.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109152
PNG
(US8609852, 59)
Show SMILES CCC(C)(C)Nc1ccc(c[nH+]1)C#Cc1csc(C)n1
Show InChI InChI=1S/C16H19N3S/c1-5-16(3,4)19-15-9-7-13(10-17-15)6-8-14-11-20-12(2)18-14/h7,9-11H,5H2,1-4H3,(H,17,19)/p+1
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 4 -47.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109132
PNG
(US8609852, 39)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)-n1ccc2ccccc12
Show InChI InChI=1S/C19H13N3S/c1-14-21-17(13-23-14)8-6-15-7-9-19(20-12-15)22-11-10-16-4-2-3-5-18(16)22/h2-5,7,9-13H,1H3/p+1
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 4 -47.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109181
PNG
(US8609852, 90)
Show SMILES Cc1nc(cs1)C#Cc1cncc(Cl)c1
Show InChI InChI=1S/C11H7ClN2S/c1-8-14-11(7-15-8)3-2-9-4-10(12)6-13-5-9/h4-7H,1H3
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 4 -47.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109168
PNG
(US8609852, 75)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)C1CCCC1
Show InChI InChI=1S/C16H16N2S/c1-12-18-15(11-19-12)8-6-13-7-9-16(17-10-13)14-4-2-3-5-14/h7,9-11,14H,2-5H2,1H3
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 4 -47.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109156
PNG
(US8609852, 63)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cccc(C)c1C
Show InChI InChI=1S/C19H16N2S/c1-13-5-4-6-18(14(13)2)19-10-8-16(11-20-19)7-9-17-12-22-15(3)21-17/h4-6,8,10-12H,1-3H3
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 4 -47.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109164
PNG
(US8609852, 71)
Show SMILES COCc1ccccc1-c1ccc(c[nH+]1)C#Cc1csc(C)n1
Show InChI InChI=1S/C19H16N2OS/c1-14-21-17(13-23-14)9-7-15-8-10-19(20-11-15)18-6-4-3-5-16(18)12-22-2/h3-6,8,10-11,13H,12H2,1-2H3/p+1
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 4.5 -47.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109125
PNG
(US8609852, 32)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)C1CCCCC1
Show InChI InChI=1S/C16H17N3S/c1-12-19-15(11-20-12)8-7-13-9-17-16(18-10-13)14-5-3-2-4-6-14/h9-11,14H,2-6H2,1H3
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 4.80 -47.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109128
PNG
(US8609852, 35)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cccc2ncccc12
Show InChI InChI=1S/C20H13N3S/c1-14-23-16(13-24-14)9-7-15-8-10-20(22-12-15)17-4-2-6-19-18(17)5-3-11-21-19/h2-6,8,10-13H,1H3
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 5 -47.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109187
PNG
(US8609852, 96)
Show SMILES CC1CCCCN1c1ncc(cn1)C#Cc1csc(C)[nH+]1
Show InChI InChI=1S/C16H18N4S/c1-12-5-3-4-8-20(12)16-17-9-14(10-18-16)6-7-15-11-21-13(2)19-15/h9-12H,3-5,8H2,1-2H3/p+1
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 5 -47.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109163
PNG
(US8609852, 70)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)-c1cccc(c1)C#N
Show InChI InChI=1S/C18H11N3S/c1-13-21-17(12-22-13)7-5-14-6-8-18(20-11-14)16-4-2-3-15(9-16)10-19/h2-4,6,8-9,11-12H,1H3/p+1
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 5 -47.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109134
PNG
(US8609852, 41)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cncc(Nc2cccnc2)c1
Show InChI InChI=1S/C16H12N4S/c1-12-19-15(11-21-12)5-4-13-7-16(10-18-8-13)20-14-3-2-6-17-9-14/h2-3,6-11,20H,1H3/p+1
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 5 -47.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109142
PNG
(US8609852, 49)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1ccc(F)c(C)c1
Show InChI InChI=1S/C18H13FN2S/c1-12-9-15(5-7-17(12)19)18-8-4-14(10-20-18)3-6-16-11-22-13(2)21-16/h4-5,7-11H,1-2H3
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 5.5 -47.1n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109195
PNG
(US8609852, 104)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(nc1)N1CC=CC1 |c:18|
Show InChI InChI=1S/C14H12N4S/c1-11-17-13(10-19-11)5-4-12-8-15-14(16-9-12)18-6-2-3-7-18/h2-3,8-10H,6-7H2,1H3/p+1
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 6 -46.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109172
PNG
(US8609852, 81)
Show SMILES CC1CCN(CC1)c1ccc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C17H19N3S/c1-13-7-9-20(10-8-13)17-6-4-15(11-18-17)3-5-16-12-21-14(2)19-16/h4,6,11-13H,7-10H2,1-2H3
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 6 -46.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109185
PNG
(US8609852, 94)
Show SMILES CCC(C)Nc1ncc(cn1)C#Cc1csc(C)[nH+]1
Show InChI InChI=1S/C14H16N4S/c1-4-10(2)17-14-15-7-12(8-16-14)5-6-13-9-19-11(3)18-13/h7-10H,4H2,1-3H3,(H,15,16,17)/p+1
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 6 -46.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109197
PNG
(US8609852, 106)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(nc1)-c1ccccc1F
Show InChI InChI=1S/C16H10FN3S/c1-11-20-13(10-21-11)7-6-12-8-18-16(19-9-12)14-4-2-3-5-15(14)17/h2-5,8-10H,1H3/p+1
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 6 -46.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109177
PNG
(US8609852, 86)
Show SMILES CCCN(C)c1ccc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C15H17N3S/c1-4-9-18(3)15-8-6-13(10-16-15)5-7-14-11-19-12(2)17-14/h6,8,10-11H,4,9H2,1-3H3
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109160
PNG
(US8609852, 67)
Show SMILES Cc1nc(cs1)C#Cc1cncc(CCc2ccccc2)c1
Show InChI InChI=1S/C19H16N2S/c1-15-21-19(14-22-15)10-9-18-11-17(12-20-13-18)8-7-16-5-3-2-4-6-16/h2-6,11-14H,7-8H2,1H3
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109165
PNG
(US8609852, 72)
Show SMILES Cc1nc(cs1)C#Cc1ccc(NC(C)(C)C)[nH+]c1
Show InChI InChI=1S/C15H17N3S/c1-11-17-13(10-19-11)7-5-12-6-8-14(16-9-12)18-15(2,3)4/h6,8-10H,1-4H3,(H,16,18)/p+1
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109183
PNG
(US8609852, 92)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)N1CCCC(CO)C1
Show InChI InChI=1S/C16H18N4OS/c1-12-19-15(11-22-12)5-4-13-7-17-16(18-8-13)20-6-2-3-14(9-20)10-21/h7-8,11,14,21H,2-3,6,9-10H2,1H3
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109175
PNG
(US8609852, 84)
Show SMILES Cc1nc(cs1)C#Cc1c[nH+]cc(c1)-c1ccccc1CO
Show InChI InChI=1S/C18H14N2OS/c1-13-20-17(12-22-13)7-6-14-8-16(10-19-9-14)18-5-3-2-4-15(18)11-21/h2-5,8-10,12,21H,11H2,1H3/p+1
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109161
PNG
(US8609852, 68)
Show SMILES CC[C@@H](C)Nc1ccc(c[nH+]1)C#Cc1csc(C)n1 |r|
Show InChI InChI=1S/C15H17N3S/c1-4-11(2)17-15-8-6-13(9-16-15)5-7-14-10-19-12(3)18-14/h6,8-11H,4H2,1-3H3,(H,16,17)/p+1/t11-/m1/s1
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109126
PNG
(US8609852, 33)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1ccc(F)cc1F
Show InChI InChI=1S/C17H10F2N2S/c1-11-21-14(10-22-11)5-2-12-3-7-17(20-9-12)15-6-4-13(18)8-16(15)19/h3-4,6-10H,1H3
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109138
PNG
(US8609852, 45)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1ccc(F)c(F)c1
Show InChI InChI=1S/C17H10F2N2S/c1-11-21-14(10-22-11)5-2-12-3-7-17(20-9-12)13-4-6-15(18)16(19)8-13/h3-4,6-10H,1H3
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 7 -46.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109167
PNG
(US8609852, 74)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)N1CC2CCC1C2 |THB:11:14:17.18:20|
Show InChI InChI=1S/C17H17N3S/c1-12-19-15(11-21-12)5-2-13-4-7-17(18-9-13)20-10-14-3-6-16(20)8-14/h4,7,9,11,14,16H,3,6,8,10H2,1H3/p+1
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 7.5 -46.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109107
PNG
(US8609852, 14)
Show SMILES CSc1ccccc1-c1ncc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C17H13N3S2/c1-12-20-14(11-22-12)8-7-13-9-18-17(19-10-13)15-5-3-4-6-16(15)21-2/h3-6,9-11H,1-2H3
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 7.5 -46.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109150
PNG
(US8609852, 57)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)N1CCCCCC1
Show InChI InChI=1S/C17H19N3S/c1-14-19-16(13-21-14)8-6-15-7-9-17(18-12-15)20-10-4-2-3-5-11-20/h7,9,12-13H,2-5,10-11H2,1H3/p+1
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 7.5 -46.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109131
PNG
(US8609852, 38)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cc(C)ccc1C
Show InChI InChI=1S/C19H16N2S/c1-13-4-5-14(2)18(10-13)19-9-7-16(11-20-19)6-8-17-12-22-15(3)21-17/h4-5,7,9-12H,1-3H3
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 8 -46.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109158
PNG
(US8609852, 65)
Show SMILES Cc1[nH+]c(cs1)C#Cc1c[nH+]cc(c1)-c1ccc(CO)cc1
Show InChI InChI=1S/C18H14N2OS/c1-13-20-18(12-22-13)7-4-15-8-17(10-19-9-15)16-5-2-14(11-21)3-6-16/h2-3,5-6,8-10,12,21H,11H2,1H3/p+2
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 8 -46.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109189
PNG
(US8609852, 98)
Show SMILES CCN(CC)c1ncc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C14H16N4S/c1-4-18(5-2)14-15-8-12(9-16-14)6-7-13-10-19-11(3)17-13/h8-10H,4-5H2,1-3H3
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 8 -46.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109146
PNG
(US8609852, 53)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)N1C2CCC1CC2
Show InChI InChI=1S/C17H17N3S/c1-12-19-14(11-21-12)4-2-13-3-9-17(18-10-13)20-15-5-6-16(20)8-7-15/h3,9-11,15-16H,5-8H2,1H3/p+1
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 8 -46.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109109
PNG
(US8609852, 16)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)-c1cccc(C)c1C
Show InChI InChI=1S/C18H15N3S/c1-12-5-4-6-17(13(12)2)18-19-9-15(10-20-18)7-8-16-11-22-14(3)21-16/h4-6,9-11H,1-3H3
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 8.60 -46.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109118
PNG
(US8609852, 25)
Show SMILES CC(C)Oc1ncc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C13H13N3OS/c1-9(2)17-13-14-6-11(7-15-13)4-5-12-8-18-10(3)16-12/h6-9H,1-3H3
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 9 -45.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109159
PNG
(US8609852, 66)
Show SMILES CCC(CC)Nc1ccc(c[nH+]1)C#Cc1csc(C)n1
Show InChI InChI=1S/C16H19N3S/c1-4-14(5-2)19-16-9-7-13(10-17-16)6-8-15-11-20-12(3)18-15/h7,9-11,14H,4-5H2,1-3H3,(H,17,19)/p+1
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 9 -45.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109198
PNG
(US8609852, 107)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)N1CCCCC1CO
Show InChI InChI=1S/C16H18N4OS/c1-12-19-14(11-22-12)6-5-13-8-17-16(18-9-13)20-7-3-2-4-15(20)10-21/h8-9,11,15,21H,2-4,7,10H2,1H3
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 9 -45.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109144
PNG
(US8609852, 51)
Show SMILES COc1cccc(-c2ccc(cn2)C#Cc2csc(C)n2)c1F
Show InChI InChI=1S/C18H13FN2OS/c1-12-21-14(11-23-12)8-6-13-7-9-16(20-10-13)15-4-3-5-17(22-2)18(15)19/h3-5,7,9-11H,1-2H3
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 9 -45.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109133
PNG
(US8609852, 40)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)N1CCSCC1
Show InChI InChI=1S/C15H15N3S2/c1-12-17-14(11-20-12)4-2-13-3-5-15(16-10-13)18-6-8-19-9-7-18/h3,5,10-11H,6-9H2,1H3/p+1
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 9 -45.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109186
PNG
(US8609852, 95)
Show SMILES C[C@H](Oc1ncc(cn1)C#Cc1csc(C)[nH+]1)c1ccccc1 |r|
Show InChI InChI=1S/C18H15N3OS/c1-13(16-6-4-3-5-7-16)22-18-19-10-15(11-20-18)8-9-17-12-23-14(2)21-17/h3-7,10-13H,1-2H3/p+1/t13-/m0/s1
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 9 -45.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109130
PNG
(US8609852, 37)
Show SMILES COc1ccc(cc1-c1ccc(c[nH+]1)C#Cc1csc(C)n1)C#N
Show InChI InChI=1S/C19H13N3OS/c1-13-22-16(12-24-13)6-3-14-4-7-18(21-11-14)17-9-15(10-20)5-8-19(17)23-2/h4-5,7-9,11-12H,1-2H3/p+1
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 10 -45.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109122
PNG
(US8609852, 29)
Show SMILES Cc1nc(cs1)C#Cc1cnc(SC(C)(C)C)nc1
Show InChI InChI=1S/C14H15N3S2/c1-10-17-12(9-18-10)6-5-11-7-15-13(16-8-11)19-14(2,3)4/h7-9H,1-4H3
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 10 -45.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109155
PNG
(US8609852, 62)
Show SMILES CC[C@H](C)Nc1ccc(c[nH+]1)C#Cc1csc(C)n1 |r|
Show InChI InChI=1S/C15H17N3S/c1-4-11(2)17-15-8-6-13(9-16-15)5-7-14-10-19-12(3)18-14/h6,8-11H,4H2,1-3H3,(H,16,17)/p+1/t11-/m0/s1
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 11 -45.4n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109154
PNG
(US8609852, 61)
Show SMILES Cc1[nH+]c(cs1)C#Cc1ccc(nc1)N1CCCC(F)C1
Show InChI InChI=1S/C16H16FN3S/c1-12-19-15(11-21-12)6-4-13-5-7-16(18-9-13)20-8-2-3-14(17)10-20/h5,7,9,11,14H,2-3,8,10H2,1H3/p+1
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 12 -45.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109174
PNG
(US8609852, 83)
Show SMILES CCC(C)Sc1ccc(cn1)C#Cc1csc(C)[nH+]1
Show InChI InChI=1S/C15H16N2S2/c1-4-11(2)19-15-8-6-13(9-16-15)5-7-14-10-18-12(3)17-14/h6,8-11H,4H2,1-3H3/p+1
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 12 -45.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109143
PNG
(US8609852, 50)
Show SMILES CN(c1ccccn1)c1ccc(cn1)C#Cc1csc(C)[nH+]1
Show InChI InChI=1S/C17H14N4S/c1-13-20-15(12-22-13)8-6-14-7-9-17(19-11-14)21(2)16-5-3-4-10-18-16/h3-5,7,9-12H,1-2H3/p+1
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US Patent
 12 -45.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109124
PNG
(US8609852, 31)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)C(C)(C)C
Show InChI InChI=1S/C15H16N2S/c1-11-17-13(10-18-11)7-5-12-6-8-14(16-9-12)15(2,3)4/h6,8-10H,1-4H3
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US Patent
 12.2 -45.2n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109141
PNG
(US8609852, 48)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)-c1cc(ccc1F)C#N
Show InChI InChI=1S/C18H10FN3S/c1-12-22-15(11-23-12)5-2-13-4-7-18(21-10-13)16-8-14(9-20)3-6-17(16)19/h3-4,6-8,10-11H,1H3/p+1
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US Patent
 12.5 -45.1n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109170
PNG
(US8609852, 77)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C18H11F3N2S/c1-12-23-16(11-24-12)7-5-13-6-8-17(22-10-13)14-3-2-4-15(9-14)18(19,20)21/h2-4,6,8-11H,1H3
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US Patent
 13 -45.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109188
PNG
(US8609852, 97)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(nc1)N1CCCC1
Show InChI InChI=1S/C14H14N4S/c1-11-17-13(10-19-11)5-4-12-8-15-14(16-9-12)18-6-2-3-7-18/h8-10H,2-3,6-7H2,1H3/p+1
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US Patent
 13 -45.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109149
PNG
(US8609852, 56)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cccc(CO)c1
Show InChI InChI=1S/C18H14N2OS/c1-13-20-17(12-22-13)7-5-14-6-8-18(19-10-14)16-4-2-3-15(9-16)11-21/h2-4,6,8-10,12,21H,11H2,1H3
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US Patent
 13 -45.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109162
PNG
(US8609852, 69)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)N1CCCC1
Show InChI InChI=1S/C15H15N3S/c1-12-17-14(11-19-12)6-4-13-5-7-15(16-10-13)18-8-2-3-9-18/h5,7,10-11H,2-3,8-9H2,1H3/p+1
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US Patent
 14 -44.8n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109127
PNG
(US8609852, 34)
Show SMILES Cc1nc(cs1)C#Cc1ccc([nH+]c1)-c1cc(C)cc(c1)C#N
Show InChI InChI=1S/C19H13N3S/c1-13-7-16(10-20)9-17(8-13)19-6-4-15(11-21-19)3-5-18-12-23-14(2)22-18/h4,6-9,11-12H,1-2H3/p+1
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US Patent
 15 -44.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109171
PNG
(US8609852, 79)
Show SMILES Cc1[nH+]c(cs1)C#Cc1ccc(Oc2ccccc2)nc1
Show InChI InChI=1S/C17H12N2OS/c1-13-19-15(12-21-13)9-7-14-8-10-17(18-11-14)20-16-5-3-2-4-6-16/h2-6,8,10-12H,1H3/p+1
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US Patent
 16 -44.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109135
PNG
(US8609852, 42)
Show SMILES Cc1nc(cs1)C#Cc1ccc(NC2CCC2)[nH+]c1
Show InChI InChI=1S/C15H15N3S/c1-11-17-14(10-19-11)7-5-12-6-8-15(16-9-12)18-13-3-2-4-13/h6,8-10,13H,2-4H2,1H3,(H,16,18)/p+1
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 17 -44.3n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109140
PNG
(US8609852, 47)
Show SMILES COc1ccc(C)cc1-c1ccc(cn1)C#Cc1csc(C)n1
Show InChI InChI=1S/C19H16N2OS/c1-13-4-9-19(22-3)17(10-13)18-8-6-15(11-20-18)5-7-16-12-23-14(2)21-16/h4,6,8-12H,1-3H3
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US Patent
 19 -44.1n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109111
PNG
(US8609852, 18)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-n1ccc2ccncc12
Show InChI InChI=1S/C18H12N4S/c1-13-21-16(12-23-13)4-2-14-3-5-18(20-10-14)22-9-7-15-6-8-19-11-17(15)22/h3,5-12H,1H3
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US Patent
 19.3 -44.0n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109095
PNG
(US8609852, 1)
Show SMILES Cc1nc(cs1)C#Cc1ccc(nc1)-c1cc(F)cc(c1)C#N
Show InChI InChI=1S/C18H10FN3S/c1-12-22-17(11-23-12)4-2-13-3-5-18(21-10-13)15-6-14(9-20)7-16(19)8-15/h3,5-8,10-11H,1H3
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US Patent
 20 -43.9n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109191
PNG
(US8609852, 100)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(nc1)N1CCSCC1
Show InChI InChI=1S/C14H14N4S2/c1-11-17-13(10-20-11)3-2-12-8-15-14(16-9-12)18-4-6-19-7-5-18/h8-10H,4-7H2,1H3/p+1
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 23 -43.6n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109192
PNG
(US8609852, 101)
Show SMILES Cc1nc(cs1)C#Cc1cnc(OC2CCN(CC2)C(=O)OC(C)(C)C)nc1
Show InChI InChI=1S/C20H24N4O3S/c1-14-23-16(13-28-14)6-5-15-11-21-18(22-12-15)26-17-7-9-24(10-8-17)19(25)27-20(2,3)4/h11-13,17H,7-10H2,1-4H3
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US Patent
 24 -43.5n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109193
PNG
(US8609852, 102)
Show SMILES Cc1[nH+]c(cs1)C#Cc1cnc(NC2CCCC2)nc1
Show InChI InChI=1S/C15H16N4S/c1-11-18-14(10-20-11)7-6-12-8-16-15(17-9-12)19-13-4-2-3-5-13/h8-10,13H,2-5H2,1H3,(H,16,17,19)/p+1
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 26 -43.3n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM109190
PNG
(US8609852, 99)
Show SMILES Cc1nc(cs1)C#Cc1cnc(nc1)-[n+]1ccc2cc[nH]cc12
Show InChI InChI=1S/C17H11N5S/c1-12-21-15(11-23-12)3-2-13-8-19-17(20-9-13)22-7-5-14-4-6-18-10-16(14)22/h4-11H,1H3/p+1
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US Patent
 33 -42.7n/an/an/an/an/an/a25



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Binding assays were performed as described in Schaffhauser H, Richards J G, Cartmell J, Chaboz S, Kemp J A, Klingelschmidt A, Messer J, Stadler H, Wo...

US Patent US8609852 (2013)


BindingDB Entry DOI: 10.7270/Q27M06K3
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%