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PubMed code 10386938

Compile data set for download or QSAR
Found 16 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 2


(Rattus norvegicus)
BDBM50078228
PNG
(2-(2,6-Dichloro-phenyl)-7-ethyl-5-(2-methoxy-pheny...)
Show SMILES CCC1=C(C(N2C=C(SC2=N1)c1c(Cl)cccc1Cl)c1ccccc1OC)C(=O)OCCN(C)C
Show InChI InChI=1S/C26H27Cl2N3O3S/c1-5-19-23(25(32)34-14-13-30(2)3)24(16-9-6-7-12-20(16)33-4)31-15-21(35-26(31)29-19)22-17(27)10-8-11-18(22)28/h6-12,15,24H,5,13-14H2,1-4H3
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1.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078235
PNG
(2-(2,4-Dichloro-phenyl)-5-(2-methoxy-phenyl)-7-met...)
Show SMILES COc1ccccc1C1N2C=C(SC2=NC(C)=C1C(=O)OCCN(C)C)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C25H25Cl2N3O3S/c1-15-22(24(31)33-12-11-29(2)3)23(18-7-5-6-8-20(18)32-4)30-14-21(34-25(30)28-15)17-10-9-16(26)13-19(17)27/h5-10,13-14,23H,11-12H2,1-4H3
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1.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078226
PNG
(2-(2,6-Dichloro-phenyl)-5-(2-methoxy-phenyl)-7-met...)
Show SMILES COc1ccccc1C1N2C=C(SC2=NC(C)=C1C(=O)OCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C25H25Cl2N3O3S/c1-15-21(24(31)33-13-12-29(2)3)23(16-8-5-6-11-19(16)32-4)30-14-20(34-25(30)28-15)22-17(26)9-7-10-18(22)27/h5-11,14,23H,12-13H2,1-4H3
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1.50E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078237
PNG
(5-(2-Chloro-phenyl)-2-(2,6-dichloro-phenyl)-7-meth...)
Show SMILES CN(C)CCOC(=O)C1=C(C)N=C2SC(=CN2C1c1ccccc1Cl)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C24H22Cl3N3O2S/c1-14-20(23(31)32-12-11-29(2)3)22(15-7-4-5-8-16(15)25)30-13-19(33-24(30)28-14)21-17(26)9-6-10-18(21)27/h4-10,13,22H,11-12H2,1-3H3
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2.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078231
PNG
(2-(2,6-Dichloro-phenyl)-5-(2-isopropoxy-phenyl)-7-...)
Show SMILES CC(C)Oc1ccccc1C1N2C=C(SC2=NC(C)=C1C(=O)OCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C27H29Cl2N3O3S/c1-16(2)35-21-12-7-6-9-18(21)25-23(26(33)34-14-13-31(4)5)17(3)30-27-32(25)15-22(36-27)24-19(28)10-8-11-20(24)29/h6-12,15-16,25H,13-14H2,1-5H3
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2.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078229
PNG
(2-(2,6-Dichloro-phenyl)-5-(3-methoxy-phenyl)-7-met...)
Show SMILES COc1cccc(c1)C1N2C=C(SC2=NC(C)=C1C(=O)OCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C25H25Cl2N3O3S/c1-15-21(24(31)33-12-11-29(2)3)23(16-7-5-8-17(13-16)32-4)30-14-20(34-25(30)28-15)22-18(26)9-6-10-19(22)27/h5-10,13-14,23H,11-12H2,1-4H3
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2.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078236
PNG
(2-(2,6-Dichloro-phenyl)-5-(2-methoxy-phenyl)-7-met...)
Show SMILES COc1ccccc1C1N2C=C(SC2=NC(C)=C1C(=O)OCCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C26H27Cl2N3O3S/c1-16-22(25(32)34-14-8-13-30(2)3)24(17-9-5-6-12-20(17)33-4)31-15-21(35-26(31)29-16)23-18(27)10-7-11-19(23)28/h5-7,9-12,15,24H,8,13-14H2,1-4H3
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2.40E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078230
PNG
(2-(2,6-Dichloro-phenyl)-5-(2-ethoxy-phenyl)-7-meth...)
Show SMILES CCOc1ccccc1C1N2C=C(SC2=NC(C)=C1C(=O)OCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C26H27Cl2N3O3S/c1-5-33-20-12-7-6-9-17(20)24-22(25(32)34-14-13-30(3)4)16(2)29-26-31(24)15-21(35-26)23-18(27)10-8-11-19(23)28/h6-12,15,24H,5,13-14H2,1-4H3
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3.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078239
PNG
(2-(2,6-Dichloro-phenyl)-5-(2-fluoro-phenyl)-7-meth...)
Show SMILES CN(C)CCOC(=O)C1=C(C)N=C2SC(=CN2C1c1ccccc1F)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C24H22Cl2FN3O2S/c1-14-20(23(31)32-12-11-29(2)3)22(15-7-4-5-10-18(15)27)30-13-19(33-24(30)28-14)21-16(25)8-6-9-17(21)26/h4-10,13,22H,11-12H2,1-3H3
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3.20E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078234
PNG
(2-(4-Chloro-phenyl)-5-(2-methoxy-phenyl)-7-methyl-...)
Show SMILES COc1ccccc1C1N2C=C(SC2=NC(C)=C1C(=O)OCCN(C)C)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H26ClN3O3S/c1-16-22(24(30)32-14-13-28(2)3)23(19-7-5-6-8-20(19)31-4)29-15-21(33-25(29)27-16)17-9-11-18(26)12-10-17/h5-12,15,23H,13-14H2,1-4H3
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4.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078238
PNG
(2-(2,6-Dichloro-phenyl)-5-(2-methoxy-phenyl)-7-met...)
Show SMILES CCOC(=O)C1=C(C)N=C2SC(=CN2C1c1ccccc1OC)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C23H20Cl2N2O3S/c1-4-30-22(28)19-13(2)26-23-27(21(19)14-8-5-6-11-17(14)29-3)12-18(31-23)20-15(24)9-7-10-16(20)25/h5-12,21H,4H2,1-3H3
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4.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078232
PNG
(2-(2,6-Dichloro-phenyl)-7-isopropyl-5-(2-methoxy-p...)
Show SMILES COc1ccccc1C1N2C=C(SC2=NC(C(C)C)=C1C(=O)OCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C27H29Cl2N3O3S/c1-16(2)24-23(26(33)35-14-13-31(3)4)25(17-9-6-7-12-20(17)34-5)32-15-21(36-27(32)30-24)22-18(28)10-8-11-19(22)29/h6-12,15-16,25H,13-14H2,1-5H3
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4.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078227
PNG
(1-[2-(2,6-dichloro-phenyl)-7-methyl-5H-thiazolo[3,...)
Show SMILES COc1ccc(cc1)C1N2C=C(SC2=NC(C)=C1C(=O)OCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C25H25Cl2N3O3S/c1-15-21(24(31)33-13-12-29(2)3)23(16-8-10-17(32-4)11-9-16)30-14-20(34-25(30)28-15)22-18(26)6-5-7-19(22)27/h5-11,14,23H,12-13H2,1-4H3
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7.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078225
PNG
(2-(2,6-Dichloro-phenyl)-7-methyl-5-o-tolyl-5H-thia...)
Show SMILES CN(C)CCOC(=O)C1=C(C)N=C2SC(=CN2C1c1ccccc1C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C25H25Cl2N3O2S/c1-15-8-5-6-9-17(15)23-21(24(31)32-13-12-29(3)4)16(2)28-25-30(23)14-20(33-25)22-18(26)10-7-11-19(22)27/h5-11,14,23H,12-13H2,1-4H3
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8.00E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078224
PNG
(7-Benzoyl-2-(2,6-dichloro-phenyl)-5-(2-methoxy-phe...)
Show SMILES COc1ccccc1C1N2C=C(SC2=NC(C(=O)c2ccccc2)=C1C(=O)OCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C31H27Cl2N3O4S/c1-35(2)16-17-40-30(38)26-27(29(37)19-10-5-4-6-11-19)34-31-36(28(26)20-12-7-8-15-23(20)39-3)18-24(41-31)25-21(32)13-9-14-22(25)33/h4-15,18,28H,16-17H2,1-3H3
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>1.00E+4n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Rattus norvegicus)
BDBM50078233
PNG
(2-(2,6-Dichloro-phenyl)-5-(2-methoxy-phenyl)-7-met...)
Show SMILES COc1ccccc1C1N2C=C(SC2=NC(C)=C1C(=O)NCCN(C)C)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C25H26Cl2N4O2S/c1-15-21(24(32)28-12-13-30(2)3)23(16-8-5-6-11-19(16)33-4)31-14-20(34-25(31)29-15)22-17(26)9-7-10-18(22)27/h5-11,14,23H,12-13H2,1-4H3,(H,28,32)
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>1.00E+4n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of 1S,3R-ACPD (10 microM) -stimulated GTP gamma 35S binding on rat Metabotropic glutamate receptor 2 transfected in CHO cells


Bioorg Med Chem Lett 9: 1573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00227-9
BindingDB Entry DOI: 10.7270/Q2XS5TKC
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%