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Compile Data Set for Download or QSAR

Found 130 hits Enz. Inhib. hit(s) with all data for entry = 537   
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 2


(Homo sapiens (Human))
BDBM277097
PNG
((S) or (R)-4-(2,4- difluorophenyl)-8- methyl-7-{[1...)
Show SMILES CC(C)n1nccc1CN1CCc2c(nc(cc2-c2ccc(F)cc2F)C(N)=O)C1C
Show InChI InChI=1S/C23H25F2N5O/c1-13(2)30-16(6-8-27-30)12-29-9-7-18-19(17-5-4-15(24)10-20(17)25)11-21(23(26)31)28-22(18)14(29)3/h4-6,8,10-11,13-14H,7,9,12H2,1-3H3,(H2,26,31)
PDB

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US Patent
n/an/a 5.30E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277085
PNG
(US10072003, Example 1-5A | US10072003, Example 1-5...)
Show SMILES CC1(C)CC(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)CCO1
Show InChI InChI=1S/C23H27ClFN3O2/c1-23(2)11-14(6-8-30-23)12-28-7-5-17-18(16-4-3-15(24)9-19(16)25)10-20(22(26)29)27-21(17)13-28/h3-4,9-10,14H,5-8,11-13H2,1-2H3,(H2,26,29)
PDB

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US Patent
n/an/a 5.60E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277201
PNG
(4-(2-chloro-4-fluorophenyl)-7- [(2-methoxypyridin-...)
Show SMILES COc1cc(CN2CCc3c(C2)nc(cc3-c2ccc(F)cc2Cl)C(N)=O)ccn1
Show InChI InChI=1S/C22H20ClFN4O2/c1-30-21-8-13(4-6-26-21)11-28-7-5-16-17(15-3-2-14(24)9-18(15)23)10-19(22(25)29)27-20(16)12-28/h2-4,6,8-10H,5,7,11-12H2,1H3,(H2,25,29)
PDB

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US Patent
n/an/a 5.70E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277130
PNG
(4-(2,4-difluorophenyl)-7-{[6- (trifluoromethyl)pyr...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3cc(ncn3)C(F)(F)F)Cc2n1)-c1ccc(F)cc1F
Show InChI InChI=1S/C21H16F5N5O/c22-11-1-2-13(16(23)5-11)15-7-17(20(27)32)30-18-9-31(4-3-14(15)18)8-12-6-19(21(24,25)26)29-10-28-12/h1-2,5-7,10H,3-4,8-9H2,(H2,27,32)
PDB

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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277097
PNG
((S) or (R)-4-(2,4- difluorophenyl)-8- methyl-7-{[1...)
Show SMILES CC(C)n1nccc1CN1CCc2c(nc(cc2-c2ccc(F)cc2F)C(N)=O)C1C
Show InChI InChI=1S/C23H25F2N5O/c1-13(2)30-16(6-8-27-30)12-29-9-7-18-19(17-5-4-15(24)10-20(17)25)11-21(23(26)31)28-22(18)14(29)3/h4-6,8,10-11,13-14H,7,9,12H2,1-3H3,(H2,26,31)
PDB

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n/an/a 5.80E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277189
PNG
(4-(4-chloro-2,6-difluorophenyl)-7-{[2- (trifluorom...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3ccnc(n3)C(F)(F)F)Cc2n1)-c1c(F)cc(Cl)cc1F |(-8,-3.08,;-6.67,-3.85,;-6.67,-5.39,;-5.33,-3.08,;-5.33,-1.54,;-4,-.77,;-2.67,-1.54,;-1.33,-.77,;,-1.54,;,-3.08,;1.33,-3.85,;2.67,-3.08,;2.67,-1.54,;4,-.77,;5.33,-1.54,;5.33,-3.08,;4,-3.85,;6.67,-3.85,;8,-3.08,;6.67,-5.39,;8,-4.62,;-1.33,-3.85,;-2.67,-3.08,;-4,-3.85,;-4,.77,;-5.33,1.54,;-6.67,.77,;-5.33,3.08,;-4,3.85,;-4,5.39,;-2.67,3.08,;-2.67,1.54,;-1.33,.77,)|
Show InChI InChI=1S/C21H15ClF5N5O/c22-10-5-14(23)18(15(24)6-10)13-7-16(19(28)33)31-17-9-32(4-2-12(13)17)8-11-1-3-29-20(30-11)21(25,26)27/h1,3,5-7H,2,4,8-9H2,(H2,28,33)
PDB

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n/an/a 6.50E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277199
PNG
(4-(2-fluoro-4-methoxyphenyl)-7- [(2-methoxypyridin...)
Show SMILES COc1ccc(c(F)c1)-c1cc(nc2CN(Cc3ccnc(OC)c3)CCc12)C(N)=O
Show InChI InChI=1S/C23H23FN4O3/c1-30-15-3-4-16(19(24)10-15)18-11-20(23(25)29)27-21-13-28(8-6-17(18)21)12-14-5-7-26-22(9-14)31-2/h3-5,7,9-11H,6,8,12-13H2,1-2H3,(H2,25,29)
PDB

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n/an/a 6.60E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277183
PNG
(4-(4-chloro-2-fluorophenyl)-7-{[2- (trifluoromethy...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3ccnc(n3)C(F)(F)F)Cc2n1)-c1ccc(Cl)cc1F
Show InChI InChI=1S/C21H16ClF4N5O/c22-11-1-2-13(16(23)7-11)15-8-17(19(27)32)30-18-10-31(6-4-14(15)18)9-12-3-5-28-20(29-12)21(24,25)26/h1-3,5,7-8H,4,6,9-10H2,(H2,27,32)
PDB

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US Patent
n/an/a 7.20E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277100
PNG
(7-[(1-tert-butyl-1H-1,2,3- triazol-5-yl)methyl]-4-...)
Show SMILES CC(C)(C)n1nncc1CN1CCc2c(C1)nc(cc2-c1c(F)cc(Cl)cc1F)C(N)=O |(-1.57,.85,;-3.06,.45,;-3.46,-1.04,;-1.97,-.64,;-4.15,1.54,;-5.61,1.06,;-6.52,2.31,;-5.61,3.56,;-4.15,3.08,;-2.82,3.85,;-1.48,3.08,;-1.48,1.54,;-.15,.77,;1.18,1.54,;1.18,3.08,;-.15,3.85,;2.52,3.85,;3.85,3.08,;3.85,1.54,;2.52,.77,;2.52,-.77,;3.85,-1.54,;5.19,-.77,;3.85,-3.08,;2.52,-3.85,;2.52,-5.39,;1.18,-3.08,;1.18,-1.54,;-.15,-.77,;5.19,3.85,;6.52,3.08,;5.19,5.39,)|
Show InChI InChI=1S/C22H23ClF2N6O/c1-22(2,3)31-13(9-27-29-31)10-30-5-4-14-15(8-18(21(26)32)28-19(14)11-30)20-16(24)6-12(23)7-17(20)25/h6-9H,4-5,10-11H2,1-3H3,(H2,26,32)
PDB

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US Patent
n/an/a 7.40E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277178
PNG
(4-(4-chloro-2-fluorophenyl)-7-[(2- methoxypyrimidi...)
Show SMILES COc1ncc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)cn1
Show InChI InChI=1S/C21H19ClFN5O2/c1-30-21-25-8-12(9-26-21)10-28-5-4-15-16(14-3-2-13(22)6-17(14)23)7-18(20(24)29)27-19(15)11-28/h2-3,6-9H,4-5,10-11H2,1H3,(H2,24,29)
PDB

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n/an/a 7.40E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277085
PNG
(US10072003, Example 1-5A | US10072003, Example 1-5...)
Show SMILES CC1(C)CC(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)CCO1
Show InChI InChI=1S/C23H27ClFN3O2/c1-23(2)11-14(6-8-30-23)12-28-7-5-17-18(16-4-3-15(24)9-19(16)25)10-20(22(26)29)27-21(17)13-28/h3-4,9-10,14H,5-8,11-13H2,1-2H3,(H2,26,29)
PDB

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US Patent
n/an/a 7.50E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277114
PNG
(4-(2,4-difluorophenyl)-7-[(4-methyl-1,2,5- oxadiaz...)
Show SMILES Cc1nonc1CN1CCc2c(C1)nc(cc2-c1ccc(F)cc1F)C(N)=O
Show InChI InChI=1S/C19H17F2N5O2/c1-10-17(25-28-24-10)8-26-5-4-13-14(12-3-2-11(20)6-15(12)21)7-16(19(22)27)23-18(13)9-26/h2-3,6-7H,4-5,8-9H2,1H3,(H2,22,27)
PDB

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US Patent
n/an/a 7.60E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277190
PNG
(4-(4-fluorophenyl)-7-{[6- (trifluoromethyl)pyrimid...)
Show SMILES NC(=O)c1cc(-c2ccc(F)cc2)c2CCN(Cc3cc(ncn3)C(F)(F)F)Cc2n1
Show InChI InChI=1S/C21H17F4N5O/c22-13-3-1-12(2-4-13)16-8-17(20(26)31)29-18-10-30(6-5-15(16)18)9-14-7-19(21(23,24)25)28-11-27-14/h1-4,7-8,11H,5-6,9-10H2,(H2,26,31)
PDB

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US Patent
n/an/a 7.60E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277198
PNG
(US10072003, Example 13-1)
Show SMILES COc1cc(CN2CCc3c(C2)nc(cc3-c2ccc(F)cc2F)C(N)=O)ccn1
Show InChI InChI=1S/C22H20F2N4O2/c1-30-21-8-13(4-6-26-21)11-28-7-5-16-17(15-3-2-14(23)9-18(15)24)10-19(22(25)29)27-20(16)12-28/h2-4,6,8-10H,5,7,11-12H2,1H3,(H2,25,29)
PDB

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US Patent
n/an/a 7.80E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277175
PNG
(4-(4-chloro-2-fluorophenyl)-7-{[3-(1- methylethyl)...)
Show SMILES CC(C)c1noc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)n1
Show InChI InChI=1S/C21H21ClFN5O2/c1-11(2)21-26-19(30-27-21)10-28-6-5-14-15(13-4-3-12(22)7-16(13)23)8-17(20(24)29)25-18(14)9-28/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H2,24,29)
PDB

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n/an/a 8.00E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277090
PNG
(4-(2,4-difluorophenyl)-7- {[1-(1-methylethyl)-1H- ...)
Show SMILES CC(C)n1nccc1CN1CCc2c(C1)nc(cc2-c1ccc(F)cc1F)C(N)=O
Show InChI InChI=1S/C22H23F2N5O/c1-13(2)29-15(5-7-26-29)11-28-8-6-17-18(16-4-3-14(23)9-19(16)24)10-20(22(25)30)27-21(17)12-28/h3-5,7,9-10,13H,6,8,11-12H2,1-2H3,(H2,25,30)
PDB

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n/an/a 8.20E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277119
PNG
(7-{[2-(difluoromethoxy)pyridin-4- yl]methyl}-4-[1-...)
Show SMILES NC(=O)c1cc(-c2cnn(c2)C(F)F)c2CCN(Cc3ccnc(OC(F)F)c3)Cc2n1
Show InChI InChI=1S/C20H18F4N6O2/c21-19(22)30-9-12(7-27-30)14-6-15(18(25)31)28-16-10-29(4-2-13(14)16)8-11-1-3-26-17(5-11)32-20(23)24/h1,3,5-7,9,19-20H,2,4,8,10H2,(H2,25,31)
PDB

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n/an/a 8.50E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277089
PNG
(4-(4-chloro-2- fluorophenyl)-7-[(1- methyl-1H-pyra...)
Show SMILES Cn1nccc1CN1CCc2c(C1)nc(cc2-c1ccc(Cl)cc1F)C(N)=O
Show InChI InChI=1S/C20H19ClFN5O/c1-26-13(4-6-24-26)10-27-7-5-15-16(14-3-2-12(21)8-17(14)22)9-18(20(23)28)25-19(15)11-27/h2-4,6,8-9H,5,7,10-11H2,1H3,(H2,23,28)
PDB

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US Patent
n/an/a 8.70E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277104
PNG
((S) or (R)-4-(4-chloro-2- fluorophenyl)-7-[(6,6- d...)
Show SMILES CC1(C)CCC(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)CO1
Show InChI InChI=1S/C23H27ClFN3O2/c1-23(2)7-5-14(13-30-23)11-28-8-6-17-18(16-4-3-15(24)9-19(16)25)10-20(22(26)29)27-21(17)12-28/h3-4,9-10,14H,5-8,11-13H2,1-2H3,(H2,26,29)
PDB

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US Patent
n/an/a 9.30E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277137
PNG
(US10072003, Example 3-2A | US10072003, Example 3-2...)
Show SMILES COc1cc(ccn1)C(N1CCc2c(C1)nc(cc2-c1cnn(C)c1)C(N)=O)C(F)(F)F
Show InChI InChI=1S/C21H21F3N6O2/c1-29-10-13(9-27-29)15-8-16(20(25)31)28-17-11-30(6-4-14(15)17)19(21(22,23)24)12-3-5-26-18(7-12)32-2/h3,5,7-10,19H,4,6,11H2,1-2H3,(H2,25,31)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277171
PNG
(4-(4-chloro-2-fluorophenyl)-7-[(5-methyl- 1,2,4-ox...)
Show SMILES Cc1nc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)no1
Show InChI InChI=1S/C19H17ClFN5O2/c1-10-23-18(25-28-10)9-26-5-4-13-14(12-3-2-11(20)6-15(12)21)7-16(19(22)27)24-17(13)8-26/h2-3,6-7H,4-5,8-9H2,1H3,(H2,22,27)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277094
PNG
(4-(2-fluoro-4- methylphenyl)-7-{[1-(1- methylethyl...)
Show SMILES CC(C)n1nccc1CN1CCc2c(C1)nc(cc2-c1ccc(C)cc1F)C(N)=O
Show InChI InChI=1S/C23H26FN5O/c1-14(2)29-16(6-8-26-29)12-28-9-7-18-19(17-5-4-15(3)10-20(17)24)11-21(23(25)30)27-22(18)13-28/h4-6,8,10-11,14H,7,9,12-13H2,1-3H3,(H2,25,30)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277166
PNG
(US10072003, Example 8-2A | US10072003, Example 8-2...)
Show SMILES NC(=O)c1cc(c2CCN(Cc2n1)C(CO)c1ccccc1)-c1ccc(F)cc1F
Show InChI InChI=1S/C23H21F2N3O2/c24-15-6-7-16(19(25)10-15)18-11-20(23(26)30)27-21-12-28(9-8-17(18)21)22(13-29)14-4-2-1-3-5-14/h1-7,10-11,22,29H,8-9,12-13H2,(H2,26,30)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277192
PNG
(4-(4-chloro-2-fluorophenyl)-7-{[6- (trifluoromethy...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3cc(ncn3)C(F)(F)F)Cc2n1)-c1ccc(Cl)cc1F
Show InChI InChI=1S/C21H16ClF4N5O/c22-11-1-2-13(16(23)5-11)15-7-17(20(27)32)30-18-9-31(4-3-14(15)18)8-12-6-19(21(24,25)26)29-10-28-12/h1-2,5-7,10H,3-4,8-9H2,(H2,27,32)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277118
PNG
(4-(2-chloro-4-fluorophenyl)-7-{[2- (difluoromethox...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3ccnc(OC(F)F)c3)Cc2n1)-c1ccc(F)cc1Cl
Show InChI InChI=1S/C22H18ClF3N4O2/c23-17-8-13(24)1-2-14(17)16-9-18(21(27)31)29-19-11-30(6-4-15(16)19)10-12-3-5-28-20(7-12)32-22(25)26/h1-3,5,7-9,22H,4,6,10-11H2,(H2,27,31)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277116
PNG
(7-[(2-cyclopropylpyridin-4-yl)methyl]-4-[1- (diflu...)
Show SMILES NC(=O)c1cc(-c2cnn(c2)C(F)F)c2CCN(Cc3ccnc(c3)C3CC3)Cc2n1
Show InChI InChI=1S/C22H22F2N6O/c23-22(24)30-11-15(9-27-30)17-8-19(21(25)31)28-20-12-29(6-4-16(17)20)10-13-3-5-26-18(7-13)14-1-2-14/h3,5,7-9,11,14,22H,1-2,4,6,10,12H2,(H2,25,31)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277127
PNG
(4-(4-chloro-2,6-difluorophenyl)-7-{[1- (difluorome...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3ccnn3C(F)F)Cc2n1)-c1c(F)cc(Cl)cc1F |(6.52,3.08,;5.19,3.85,;5.19,5.39,;3.85,3.08,;3.85,1.54,;2.52,.77,;1.18,1.54,;-.15,.77,;-1.48,1.54,;-1.48,3.08,;-2.82,3.85,;-4.15,3.08,;-5.61,3.56,;-6.52,2.31,;-5.61,1.06,;-4.15,1.54,;-3.06,.45,;-3.46,-1.04,;-1.57,.85,;-.15,3.85,;1.18,3.08,;2.52,3.85,;2.52,-.77,;1.18,-1.54,;-.15,-.77,;1.18,-3.08,;2.52,-3.85,;2.52,-5.39,;3.85,-3.08,;3.85,-1.54,;5.19,-.77,)|
Show InChI InChI=1S/C20H16ClF4N5O/c21-10-5-14(22)18(15(23)6-10)13-7-16(19(26)31)28-17-9-29(4-2-12(13)17)8-11-1-3-27-30(11)20(24)25/h1,3,5-7,20H,2,4,8-9H2,(H2,26,31)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277137
PNG
(US10072003, Example 3-2A | US10072003, Example 3-2...)
Show SMILES COc1cc(ccn1)C(N1CCc2c(C1)nc(cc2-c1cnn(C)c1)C(N)=O)C(F)(F)F
Show InChI InChI=1S/C21H21F3N6O2/c1-29-10-13(9-27-29)15-8-16(20(25)31)28-17-11-30(6-4-14(15)17)19(21(22,23)24)12-3-5-26-18(7-12)32-2/h3,5,7-10,19H,4,6,11H2,1-2H3,(H2,25,31)
PDB

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n/an/a 1.14E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277166
PNG
(US10072003, Example 8-2A | US10072003, Example 8-2...)
Show SMILES NC(=O)c1cc(c2CCN(Cc2n1)C(CO)c1ccccc1)-c1ccc(F)cc1F
Show InChI InChI=1S/C23H21F2N3O2/c24-15-6-7-16(19(25)10-15)18-11-20(23(26)30)27-21-12-28(9-8-17(18)21)22(13-29)14-4-2-1-3-5-14/h1-7,10-11,22,29H,8-9,12-13H2,(H2,26,30)
PDB

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n/an/a 1.15E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277176
PNG
(4-(4-chloro-2-fluorophenyl)-7-[(4- methoxypyrimidi...)
Show SMILES COc1ccnc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)n1
Show InChI InChI=1S/C21H19ClFN5O2/c1-30-20-4-6-25-19(27-20)11-28-7-5-14-15(13-3-2-12(22)8-16(13)23)9-17(21(24)29)26-18(14)10-28/h2-4,6,8-9H,5,7,10-11H2,1H3,(H2,24,29)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277155
PNG
(US10072003, Example 6-1)
Show SMILES NC(=O)c1cc(-c2ccc(Cl)cn2)c2CCN(Cc3ccnc(c3)C(F)(F)F)Cc2n1
Show InChI InChI=1S/C21H17ClF3N5O/c22-13-1-2-16(28-9-13)15-8-17(20(26)31)29-18-11-30(6-4-14(15)18)10-12-3-5-27-19(7-12)21(23,24)25/h1-3,5,7-9H,4,6,10-11H2,(H2,26,31)
PDB

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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277188
PNG
(4-(2-fluorophenyl)-7-{[2- (trifluoromethyl)pyrimid...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3ccnc(n3)C(F)(F)F)Cc2n1)-c1ccccc1F
Show InChI InChI=1S/C21H17F4N5O/c22-16-4-2-1-3-13(16)15-9-17(19(26)31)29-18-11-30(8-6-14(15)18)10-12-5-7-27-20(28-12)21(23,24)25/h1-5,7,9H,6,8,10-11H2,(H2,26,31)
PDB

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n/an/a 1.18E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277179
PNG
(4-(4-chloro-2-fluorophenyl)-7-(pyridin-3- ylmethyl...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3cccnc3)Cc2n1)-c1ccc(Cl)cc1F
Show InChI InChI=1S/C21H18ClFN4O/c22-14-3-4-15(18(23)8-14)17-9-19(21(24)28)26-20-12-27(7-5-16(17)20)11-13-2-1-6-25-10-13/h1-4,6,8-10H,5,7,11-12H2,(H2,24,28)
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n/an/a 1.20E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277101
PNG
((S) or (R)-4-(4-chloro-2- fluorophenyl)-7-(((S) or...)
Show SMILES CC1N(CC2CCOC(C)(C)C2)CCc2c1nc(cc2-c1ccc(F)cc1F)C(N)=O
Show InChI InChI=1S/C24H29F2N3O2/c1-14-22-18(6-8-29(14)13-15-7-9-31-24(2,3)12-15)19(11-21(28-22)23(27)30)17-5-4-16(25)10-20(17)26/h4-5,10-11,14-15H,6-9,12-13H2,1-3H3,(H2,27,30)
PDB

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n/an/a 1.23E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277164
PNG
(US10072003, Example 8-1A | US10072003, Example 8-1...)
Show SMILES NC(=O)c1cc(c2CCN(CC(O)c3ccccc3)Cc2n1)-c1ccc(F)cc1F
Show InChI InChI=1S/C23H21F2N3O2/c24-15-6-7-16(19(25)10-15)18-11-20(23(26)30)27-21-12-28(9-8-17(18)21)13-22(29)14-4-2-1-3-5-14/h1-7,10-11,22,29H,8-9,12-13H2,(H2,26,30)
PDB

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n/an/a 1.27E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277174
PNG
(4-(4-chloro-2-fluorophenyl)-7-[(3-methyl- 1,2,4-ox...)
Show SMILES Cc1noc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)n1
Show InChI InChI=1S/C19H17ClFN5O2/c1-10-23-18(28-25-10)9-26-5-4-13-14(12-3-2-11(20)6-15(12)21)7-16(19(22)27)24-17(13)8-26/h2-3,6-7H,4-5,8-9H2,1H3,(H2,22,27)
PDB

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n/an/a 1.27E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277164
PNG
(US10072003, Example 8-1A | US10072003, Example 8-1...)
Show SMILES NC(=O)c1cc(c2CCN(CC(O)c3ccccc3)Cc2n1)-c1ccc(F)cc1F
Show InChI InChI=1S/C23H21F2N3O2/c24-15-6-7-16(19(25)10-15)18-11-20(23(26)30)27-21-12-28(9-8-17(18)21)13-22(29)14-4-2-1-3-5-14/h1-7,10-11,22,29H,8-9,12-13H2,(H2,26,30)
PDB

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n/an/a 1.27E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277147
PNG
((S) or (R)-4-(3- methylpiperidin-1-yl)-7- ((2- (tr...)
Show SMILES CC1CCCN(C1)c1cc(nc2CN(Cc3ccnc(c3)C(F)(F)F)CCc12)C(N)=O
Show InChI InChI=1S/C22H26F3N5O/c1-14-3-2-7-30(11-14)19-10-17(21(26)31)28-18-13-29(8-5-16(18)19)12-15-4-6-27-20(9-15)22(23,24)25/h4,6,9-10,14H,2-3,5,7-8,11-13H2,1H3,(H2,26,31)
PDB

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n/an/a 1.29E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277194
PNG
(4-(6-azaspiro[2.5]oct-6-yl)-7-{[2- (trifluoromethy...)
Show SMILES NC(=O)c1cc(N2CCC3(CC3)CC2)c2CCN(Cc3ccnc(n3)C(F)(F)F)Cc2n1
Show InChI InChI=1S/C22H25F3N6O/c23-22(24,25)20-27-7-1-14(28-20)12-30-8-2-15-17(13-30)29-16(19(26)32)11-18(15)31-9-5-21(3-4-21)6-10-31/h1,7,11H,2-6,8-10,12-13H2,(H2,26,32)
PDB

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n/an/a 1.31E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277133
PNG
(4-(2,4-difluorophenyl)-7-[(4- methylisoxazol-3-yl)...)
Show SMILES Cc1conc1CN1CCc2c(C1)nc(cc2-c1ccc(F)cc1F)C(N)=O
Show InChI InChI=1S/C20H18F2N4O2/c1-11-10-28-25-18(11)8-26-5-4-14-15(13-3-2-12(21)6-16(13)22)7-17(20(23)27)24-19(14)9-26/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,23,27)
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n/an/a 1.31E+4n/an/an/an/an/an/a



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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277102
PNG
((S) or (R)-8-methyl-7- {[1-(1-methylethyl)-1H- pyr...)
Show SMILES CC(C)n1nccc1CN1CCc2c(cc(nc2C1C)C(N)=O)N1CCCCC1
Show InChI InChI=1S/C22H32N6O/c1-15(2)28-17(7-9-24-28)14-27-12-8-18-20(26-10-5-4-6-11-26)13-19(22(23)29)25-21(18)16(27)3/h7,9,13,15-16H,4-6,8,10-12,14H2,1-3H3,(H2,23,29)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277186
PNG
(7-{[2-(trifluoromethyl)pyrimidin-4- yl]methyl}-4-(...)
Show SMILES NC(=O)c1cc(c2CCN(Cc3ccnc(n3)C(F)(F)F)Cc2n1)-c1c(F)cc(F)cc1F |(-8,-3.08,;-6.67,-3.85,;-6.67,-5.39,;-5.33,-3.08,;-5.33,-1.54,;-4,-.77,;-2.67,-1.54,;-1.33,-.77,;,-1.54,;,-3.08,;1.33,-3.85,;2.67,-3.08,;2.67,-1.54,;4,-.77,;5.33,-1.54,;5.33,-3.08,;4,-3.85,;6.67,-3.85,;8,-3.08,;6.67,-5.39,;8,-4.62,;-1.33,-3.85,;-2.67,-3.08,;-4,-3.85,;-4,.77,;-5.33,1.54,;-6.67,.77,;-5.33,3.08,;-4,3.85,;-4,5.39,;-2.67,3.08,;-2.67,1.54,;-1.33,.77,)|
Show InChI InChI=1S/C21H15F6N5O/c22-10-5-14(23)18(15(24)6-10)13-7-16(19(28)33)31-17-9-32(4-2-12(13)17)8-11-1-3-29-20(30-11)21(25,26)27/h1,3,5-7H,2,4,8-9H2,(H2,28,33)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277088
PNG
(4-(2,4-difluorophenyl)-7- [(1,3-dimethyl-1H- pyraz...)
Show SMILES Cc1cc(CN2CCc3c(C2)nc(cc3-c2ccc(F)cc2F)C(N)=O)n(C)n1
Show InChI InChI=1S/C21H21F2N5O/c1-12-7-14(27(2)26-12)10-28-6-5-16-17(15-4-3-13(22)8-18(15)23)9-19(21(24)29)25-20(16)11-28/h3-4,7-9H,5-6,10-11H2,1-2H3,(H2,24,29)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277099
PNG
(4-(4-chloro-2- fluorophenyl)-7-[(1- methyl-1H-imid...)
Show SMILES Cn1cncc1CN1CCc2c(C1)nc(cc2-c1ccc(Cl)cc1F)C(N)=O
Show InChI InChI=1S/C20H19ClFN5O/c1-26-11-24-8-13(26)9-27-5-4-15-16(14-3-2-12(21)6-17(14)22)7-18(20(23)28)25-19(15)10-27/h2-3,6-8,11H,4-5,9-10H2,1H3,(H2,23,28)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277172
PNG
(4-(4-chloro-2-fluorophenyl)-7-[(2- methoxypyrimidi...)
Show SMILES COc1nccc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)n1
Show InChI InChI=1S/C21H19ClFN5O2/c1-30-21-25-6-4-13(26-21)10-28-7-5-15-16(14-3-2-12(22)8-17(14)23)9-18(20(24)29)27-19(15)11-28/h2-4,6,8-9H,5,7,10-11H2,1H3,(H2,24,29)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277087
PNG
(4-(2,4-difluorophenyl)-7- [(1-methyl-1H-pyrazol-5-...)
Show SMILES Cn1nccc1CN1CCc2c(C1)nc(cc2-c1ccc(F)cc1F)C(N)=O
Show InChI InChI=1S/C20H19F2N5O/c1-26-13(4-6-24-26)10-27-7-5-15-16(14-3-2-12(21)8-17(14)22)9-18(20(23)28)25-19(15)11-27/h2-4,6,8-9H,5,7,10-11H2,1H3,(H2,23,28)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277180
PNG
(4-(4-chloro-2-fluorophenyl)-7-[(1-methyl- 1H-pyraz...)
Show SMILES Cn1cc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)cn1
Show InChI InChI=1S/C20H19ClFN5O/c1-26-9-12(8-24-26)10-27-5-4-15-16(14-3-2-13(21)6-17(14)22)7-18(20(23)28)25-19(15)11-27/h2-3,6-9H,4-5,10-11H2,1H3,(H2,23,28)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277106
PNG
(US10072003, Example 1-23A | US10072003, Example 1-...)
Show SMILES CC1(C)CC(CN2CCc3c(cc(nc3C2(C)C)C(N)=O)-c2ccc(F)cc2F)CCO1
Show InChI InChI=1S/C25H31F2N3O2/c1-24(2)13-15(8-10-32-24)14-30-9-7-18-19(17-6-5-16(26)11-20(17)27)12-21(23(28)31)29-22(18)25(30,3)4/h5-6,11-12,15H,7-10,13-14H2,1-4H3,(H2,28,31)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277200
PNG
(4-(4-chloro-2-fluorophenyl)-7- [(2-methoxypyridin-...)
Show SMILES COc1cc(CN2CCc3c(C2)nc(cc3-c2ccc(Cl)cc2F)C(N)=O)ccn1
Show InChI InChI=1S/C22H20ClFN4O2/c1-30-21-8-13(4-6-26-21)11-28-7-5-16-17(15-3-2-14(23)9-18(15)24)10-19(22(25)29)27-20(16)12-28/h2-4,6,8-10H,5,7,11-12H2,1H3,(H2,25,29)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM277149
PNG
((S) or (R)-4-(3- fluoropiperidin-1-yl)-7-((2- (tri...)
Show SMILES NC(=O)c1cc(N2CCCC(F)C2)c2CCN(Cc3ccnc(c3)C(F)(F)F)Cc2n1
Show InChI InChI=1S/C21H23F4N5O/c22-14-2-1-6-30(11-14)18-9-16(20(26)31)28-17-12-29(7-4-15(17)18)10-13-3-5-27-19(8-13)21(23,24)25/h3,5,8-9,14H,1-2,4,6-7,10-12H2,(H2,26,31)
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US Patent


Assay Description
The utility of the compounds of the invention as antagonists of metabotropic glutamate receptor activity, in particular mGluR2 activity, may be demon...


US Patent US10072003 (2018)


BindingDB Entry DOI: 10.7270/Q23R0VXK
More data for this
Ligand-Target Pair
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