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PubMed code 23727046

Compile data set for download or QSAR
Found 84 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436506
PNG
(CHEMBL2397347)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cccnc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-3-2-4-24-19(20)13-23)5-6-26(15)21(27)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-4,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436506
PNG
(CHEMBL2397347)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cccnc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-3-2-4-24-19(20)13-23)5-6-26(15)21(27)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-4,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436527
PNG
(CHEMBL2397349)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-4-2-3-5-22-19)6-7-24(15)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436527
PNG
(CHEMBL2397349)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-4-2-3-5-22-19)6-7-24(15)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436492
PNG
(CHEMBL2397366)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CC2CCCC(C2)C1)c1ccccn1 |r|
Show InChI InChI=1S/C20H29N3O/c1-15-14-22(19-7-2-3-8-21-19)9-10-23(15)20(24)18-12-16-5-4-6-17(11-16)13-18/h2-3,7-8,15-18H,4-6,9-14H2,1H3/t15-,16?,17?,18?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436489
PNG
(CHEMBL2397351)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(6-7-24(15)19-4-2-3-5-22-19)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436489
PNG
(CHEMBL2397351)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(6-7-24(15)19-4-2-3-5-22-19)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436492
PNG
(CHEMBL2397366)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CC2CCCC(C2)C1)c1ccccn1 |r|
Show InChI InChI=1S/C20H29N3O/c1-15-14-22(19-7-2-3-8-21-19)9-10-23(15)20(24)18-12-16-5-4-6-17(11-16)13-18/h2-3,7-8,15-18H,4-6,9-14H2,1H3/t15-,16?,17?,18?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436493
PNG
(CHEMBL2397341)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cccc(F)n1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H28FN3O/c1-14-13-24(19-4-2-3-18(22)23-19)5-6-25(14)20(26)21-10-15-7-16(11-21)9-17(8-15)12-21/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,21?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436493
PNG
(CHEMBL2397341)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cccc(F)n1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H28FN3O/c1-14-13-24(19-4-2-3-18(22)23-19)5-6-25(14)20(26)21-10-15-7-16(11-21)9-17(8-15)12-21/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,21?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436500
PNG
(CHEMBL2397378)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccccc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C23H29N3O/c1-16-15-25(21-5-3-2-4-20(21)14-24)6-7-26(16)22(27)23-11-17-8-18(12-23)10-19(9-17)13-23/h2-5,16-19H,6-13,15H2,1H3/t16-,17?,18?,19?,23?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436500
PNG
(CHEMBL2397378)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccccc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C23H29N3O/c1-16-15-25(21-5-3-2-4-20(21)14-24)6-7-26(16)22(27)23-11-17-8-18(12-23)10-19(9-17)13-23/h2-5,16-19H,6-13,15H2,1H3/t16-,17?,18?,19?,23?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436490
PNG
(CHEMBL2397344)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ncccc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-19(13-23)3-2-4-24-20)5-6-26(15)21(27)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-4,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436490
PNG
(CHEMBL2397344)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ncccc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-19(13-23)3-2-4-24-20)5-6-26(15)21(27)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-4,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436501
PNG
(CHEMBL2397346)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccncc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-2-3-24-13-19(20)12-23)4-5-26(15)21(27)22-9-16-6-17(10-22)8-18(7-16)11-22/h2-3,13,15-18H,4-11,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436501
PNG
(CHEMBL2397346)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccncc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-2-3-24-13-19(20)12-23)4-5-26(15)21(27)22-9-16-6-17(10-22)8-18(7-16)11-22/h2-3,13,15-18H,4-11,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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n/an/a 398n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436497
PNG
(CHEMBL2397342)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(F)cn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H28FN3O/c1-14-13-24(19-3-2-18(22)12-23-19)4-5-25(14)20(26)21-9-15-6-16(10-21)8-17(7-15)11-21/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,21?/m1/s1
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n/an/a 414n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436497
PNG
(CHEMBL2397342)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(F)cn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H28FN3O/c1-14-13-24(19-3-2-18(22)12-23-19)4-5-25(14)20(26)21-9-15-6-16(10-21)8-17(7-15)11-21/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,21?/m1/s1
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n/an/a 417n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436502
PNG
(CHEMBL2397368)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cccnc1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-3-2-4-22-13-19)5-6-24(15)20(25)21-10-16-7-17(11-21)9-18(8-16)12-21/h2-4,13,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a 596n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436502
PNG
(CHEMBL2397368)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cccnc1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-3-2-4-22-13-19)5-6-24(15)20(25)21-10-16-7-17(11-21)9-18(8-16)12-21/h2-4,13,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a 603n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50339075
PNG
(Adamantan-1-yl-(4-pyridin-2-yl-piperazin-1-yl)-met...)
Show SMILES O=C(N1CCN(CC1)c1nccs1)C12CC3CC(CC(C3)C1)C2 |TLB:16:17:14.15.20:21,THB:16:15:21:22.17.18,18:17:14:20.19.21,18:19:14:22.16.17|
Show InChI InChI=1S/C18H25N3OS/c22-16(18-10-13-7-14(11-18)9-15(8-13)12-18)20-2-4-21(5-3-20)17-19-1-6-23-17/h1,6,13-15H,2-5,7-12H2
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n/an/a 630n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50339075
PNG
(Adamantan-1-yl-(4-pyridin-2-yl-piperazin-1-yl)-met...)
Show SMILES O=C(N1CCN(CC1)c1nccs1)C12CC3CC(CC(C3)C1)C2 |TLB:16:17:14.15.20:21,THB:16:15:21:22.17.18,18:17:14:20.19.21,18:19:14:22.16.17|
Show InChI InChI=1S/C18H25N3OS/c22-16(18-10-13-7-14(11-18)9-15(8-13)12-18)20-2-4-21(5-3-20)17-19-1-6-23-17/h1,6,13-15H,2-5,7-12H2
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n/an/a 631n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436498
PNG
(CHEMBL2397372)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ncccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(19-21-3-2-4-22-19)5-6-24(14)18(25)20-10-15-7-16(11-20)9-17(8-15)12-20/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a 708n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436504
PNG
(CHEMBL2397343)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ncccc1F |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H28FN3O/c1-14-13-24(19-18(22)3-2-4-23-19)5-6-25(14)20(26)21-10-15-7-16(11-21)9-17(8-15)12-21/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,21?/m1/s1
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n/an/a 708n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436504
PNG
(CHEMBL2397343)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ncccc1F |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H28FN3O/c1-14-13-24(19-18(22)3-2-4-23-19)5-6-25(14)20(26)21-10-15-7-16(11-21)9-17(8-15)12-21/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,21?/m1/s1
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n/an/a 712n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436498
PNG
(CHEMBL2397372)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ncccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(19-21-3-2-4-22-19)5-6-24(14)18(25)20-10-15-7-16(11-20)9-17(8-15)12-20/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a 714n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436491
PNG
(CHEMBL2397350)
Show SMILES C[C@H]1CN(CCN1c1ccccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(6-7-24(15)19-4-2-3-5-22-19)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m0/s1
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n/an/a 977n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436491
PNG
(CHEMBL2397350)
Show SMILES C[C@H]1CN(CCN1c1ccccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(6-7-24(15)19-4-2-3-5-22-19)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m0/s1
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n/an/a 988n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436495
PNG
(CHEMBL2397374)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cnccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(18-12-21-2-3-22-18)4-5-24(14)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a 1.18E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436495
PNG
(CHEMBL2397374)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cnccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(18-12-21-2-3-22-18)4-5-24(14)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a 1.19E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436499
PNG
(CHEMBL2397376)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccncn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C20H28N4O/c1-14-12-23(18-2-3-21-13-22-18)4-5-24(14)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,13-17H,4-12H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a 1.32E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436499
PNG
(CHEMBL2397376)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccncn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C20H28N4O/c1-14-12-23(18-2-3-21-13-22-18)4-5-24(14)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,13-17H,4-12H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a 1.33E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436505
PNG
(CHEMBL2397345)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cnccc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-13-24-3-2-19(20)12-23)4-5-26(15)21(27)22-9-16-6-17(10-22)8-18(7-16)11-22/h2-3,13,15-18H,4-11,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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n/an/a 1.38E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436505
PNG
(CHEMBL2397345)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cnccc1C#N |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C22H28N4O/c1-15-14-25(20-13-24-3-2-19(20)12-23)4-5-26(15)21(27)22-9-16-6-17(10-22)8-18(7-16)11-22/h2-3,13,15-18H,4-11,14H2,1H3/t15-,16?,17?,18?,22?/m1/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436526
PNG
(CHEMBL2397348)
Show SMILES C[C@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-4-2-3-5-22-19)6-7-24(15)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m0/s1
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n/an/a 2.40E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436526
PNG
(CHEMBL2397348)
Show SMILES C[C@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-4-2-3-5-22-19)6-7-24(15)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m0/s1
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n/an/a 2.42E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436494
PNG
(CHEMBL2397379)
Show SMILES C[C@@H]1CN(CCN1c1ccccc1C#N)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:15:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,15:17:20:24.23.22|
Show InChI InChI=1S/C23H29N3O/c1-16-15-25(6-7-26(16)21-5-3-2-4-20(21)14-24)22(27)23-11-17-8-18(12-23)10-19(9-17)13-23/h2-5,16-19H,6-13,15H2,1H3/t16-,17?,18?,19?,23?/m1/s1
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n/an/a 2.46E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436494
PNG
(CHEMBL2397379)
Show SMILES C[C@@H]1CN(CCN1c1ccccc1C#N)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:15:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,15:17:20:24.23.22|
Show InChI InChI=1S/C23H29N3O/c1-16-15-25(6-7-26(16)21-5-3-2-4-20(21)14-24)22(27)23-11-17-8-18(12-23)10-19(9-17)13-23/h2-5,16-19H,6-13,15H2,1H3/t16-,17?,18?,19?,23?/m1/s1
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n/an/a 2.46E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436496
PNG
(CHEMBL2397364)
Show SMILES C[C@@H]1CN(CCN1C(=O)[C@H]1CC[C@@H](CC1)C(C)(C)C)c1ccccn1 |r,wU:9.9,wD:1.0,12.16,(48.62,-41.8,;48.62,-43.34,;49.95,-44.12,;49.95,-45.66,;48.62,-46.42,;47.29,-45.66,;47.29,-44.11,;45.95,-43.35,;45.93,-41.81,;44.62,-44.13,;44.64,-45.67,;43.3,-46.44,;41.96,-45.68,;41.96,-44.14,;43.28,-43.37,;40.63,-46.46,;39.29,-45.69,;40.64,-48,;39.29,-47.22,;51.27,-46.43,;51.27,-47.97,;52.6,-48.75,;53.94,-47.98,;53.93,-46.43,;52.6,-45.66,)|
Show InChI InChI=1S/C21H33N3O/c1-16-15-23(19-7-5-6-12-22-19)13-14-24(16)20(25)17-8-10-18(11-9-17)21(2,3)4/h5-7,12,16-18H,8-11,13-15H2,1-4H3/t16-,17-,18-/m1/s1
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n/an/a 3.61E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436496
PNG
(CHEMBL2397364)
Show SMILES C[C@@H]1CN(CCN1C(=O)[C@H]1CC[C@@H](CC1)C(C)(C)C)c1ccccn1 |r,wU:9.9,wD:1.0,12.16,(48.62,-41.8,;48.62,-43.34,;49.95,-44.12,;49.95,-45.66,;48.62,-46.42,;47.29,-45.66,;47.29,-44.11,;45.95,-43.35,;45.93,-41.81,;44.62,-44.13,;44.64,-45.67,;43.3,-46.44,;41.96,-45.68,;41.96,-44.14,;43.28,-43.37,;40.63,-46.46,;39.29,-45.69,;40.64,-48,;39.29,-47.22,;51.27,-46.43,;51.27,-47.97,;52.6,-48.75,;53.94,-47.98,;53.93,-46.43,;52.6,-45.66,)|
Show InChI InChI=1S/C21H33N3O/c1-16-15-23(19-7-5-6-12-22-19)13-14-24(16)20(25)17-8-10-18(11-9-17)21(2,3)4/h5-7,12,16-18H,8-11,13-15H2,1-4H3/t16-,17-,18-/m1/s1
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n/an/a 3.63E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436503
PNG
(CHEMBL2397360)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CCCCCCC1)c1ccccn1 |r|
Show InChI InChI=1S/C19H29N3O/c1-16-15-21(18-11-7-8-12-20-18)13-14-22(16)19(23)17-9-5-3-2-4-6-10-17/h7-8,11-12,16-17H,2-6,9-10,13-15H2,1H3/t16-/m1/s1
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n/an/a 6.61E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436503
PNG
(CHEMBL2397360)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CCCCCCC1)c1ccccn1 |r|
Show InChI InChI=1S/C19H29N3O/c1-16-15-21(18-11-7-8-12-20-18)13-14-22(16)19(23)17-9-5-3-2-4-6-10-17/h7-8,11-12,16-17H,2-6,9-10,13-15H2,1H3/t16-/m1/s1
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n/an/a 6.63E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436525
PNG
(CHEMBL2397356)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CCCCC1)c1ccccn1 |r|
Show InChI InChI=1S/C17H25N3O/c1-14-13-19(16-9-5-6-10-18-16)11-12-20(14)17(21)15-7-3-2-4-8-15/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3/t14-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436516
PNG
(CHEMBL2397373)
Show SMILES C[C@@H]1CN(CCN1c1ncccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(5-6-24(14)19-21-3-2-4-22-19)18(25)20-10-15-7-16(11-20)9-17(8-15)12-20/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436521
PNG
(CHEMBL2397362)
Show SMILES C[C@H]1CC[C@@H](CC1)C(=O)N1CCN(C[C@H]1C)c1ccccn1 |r,wU:4.7,wD:14.16,1.0,(2.85,-47.1,;4.18,-46.33,;5.52,-47.09,;6.86,-46.31,;6.84,-44.77,;5.5,-44.01,;4.18,-44.79,;8.17,-43.99,;8.16,-42.45,;9.51,-44.74,;9.51,-46.3,;10.84,-47.06,;12.17,-46.3,;12.17,-44.76,;10.84,-43.98,;10.85,-42.44,;13.5,-47.07,;13.49,-48.61,;14.82,-49.38,;16.16,-48.61,;16.16,-47.07,;14.83,-46.3,)|
Show InChI InChI=1S/C18H27N3O/c1-14-6-8-16(9-7-14)18(22)21-12-11-20(13-15(21)2)17-5-3-4-10-19-17/h3-5,10,14-16H,6-9,11-13H2,1-2H3/t14-,15-,16-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436523
PNG
(CHEMBL2397359)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CCCCCC1 |r|
Show InChI InChI=1S/C18H27N3O/c1-15-14-20(18(22)16-8-4-2-3-5-9-16)12-13-21(15)17-10-6-7-11-19-17/h6-7,10-11,15-16H,2-5,8-9,12-14H2,1H3/t15-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436514
PNG
(CHEMBL2397377)
Show SMILES C[C@@H]1CN(CCN1c1ccncn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C20H28N4O/c1-14-12-23(4-5-24(14)18-2-3-21-13-22-18)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,13-17H,4-12H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436518
PNG
(CHEMBL2397369)
Show SMILES C[C@@H]1CN(CCN1c1cccnc1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(5-6-24(15)19-3-2-4-22-13-19)20(25)21-10-16-7-17(11-21)9-18(8-16)12-21/h2-4,13,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436517
PNG
(CHEMBL2397370)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccncc1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-2-4-22-5-3-19)6-7-24(15)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436522
PNG
(CHEMBL2397361)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CCCCCCC1 |r|
Show InChI InChI=1S/C19H29N3O/c1-16-15-21(13-14-22(16)18-11-7-8-12-20-18)19(23)17-9-5-3-2-4-6-10-17/h7-8,11-12,16-17H,2-6,9-10,13-15H2,1H3/t16-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436520
PNG
(CHEMBL2397365)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)[C@H]1CC[C@@H](CC1)C(C)(C)C |r,wU:15.16,1.0,wD:18.23,(15.17,-53.24,;13.83,-54.01,;12.51,-53.23,;11.18,-53.99,;11.18,-55.55,;12.51,-56.31,;13.83,-55.55,;15.16,-56.32,;15.16,-57.86,;16.49,-58.63,;17.83,-57.86,;17.82,-56.31,;16.49,-55.55,;9.84,-53.23,;9.82,-51.69,;8.51,-54.01,;8.53,-55.55,;7.19,-56.33,;5.85,-55.57,;5.85,-54.03,;7.17,-53.25,;4.52,-56.34,;3.18,-55.58,;4.53,-57.88,;3.18,-57.1,)|
Show InChI InChI=1S/C21H33N3O/c1-16-15-23(13-14-24(16)19-7-5-6-12-22-19)20(25)17-8-10-18(11-9-17)21(2,3)4/h5-7,12,16-18H,8-11,13-15H2,1-4H3/t16-,17-,18-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436518
PNG
(CHEMBL2397369)
Show SMILES C[C@@H]1CN(CCN1c1cccnc1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(5-6-24(15)19-3-2-4-22-13-19)20(25)21-10-16-7-17(11-21)9-18(8-16)12-21/h2-4,13,15-18H,5-12,14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436515
PNG
(CHEMBL2397375)
Show SMILES C[C@@H]1CN(CCN1c1cnccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(4-5-24(14)18-12-21-2-3-22-18)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436517
PNG
(CHEMBL2397370)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1ccncc1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(19-2-4-22-5-3-19)6-7-24(15)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436514
PNG
(CHEMBL2397377)
Show SMILES C[C@@H]1CN(CCN1c1ccncn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C20H28N4O/c1-14-12-23(4-5-24(14)18-2-3-21-13-22-18)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,13-17H,4-12H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436525
PNG
(CHEMBL2397356)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CCCCC1)c1ccccn1 |r|
Show InChI InChI=1S/C17H25N3O/c1-14-13-19(16-9-5-6-10-18-16)11-12-20(14)17(21)15-7-3-2-4-8-15/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3/t14-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436524
PNG
(CHEMBL2397358)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CCCCCC1)c1ccccn1 |r|
Show InChI InChI=1S/C18H27N3O/c1-15-14-20(17-10-6-7-11-19-17)12-13-21(15)18(22)16-8-4-2-3-5-9-16/h6-7,10-11,15-16H,2-5,8-9,12-14H2,1H3/t15-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436529
PNG
(CHEMBL2397340)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12C3C4C5C3C1C5C24)c1ccccn1 |r,wD:1.0,(12.27,-3.85,;12.27,-5.4,;13.61,-6.18,;13.61,-7.73,;12.27,-8.5,;10.92,-7.73,;10.92,-6.18,;9.58,-5.41,;9.58,-3.85,;8.26,-6.19,;7.32,-6.95,;5.78,-6.95,;5.78,-8.49,;7.32,-8.49,;8.26,-7.73,;6.72,-7.73,;6.72,-6.19,;14.96,-8.5,;14.96,-10.05,;16.3,-10.83,;17.64,-10.05,;17.64,-8.5,;16.3,-7.73,)|
Show InChI InChI=1S/C19H21N3O/c1-9-8-21(10-4-2-3-5-20-10)6-7-22(9)18(23)19-15-12-11-13(15)17(19)14(11)16(12)19/h2-5,9,11-17H,6-8H2,1H3/t9-,11?,12?,13?,14?,15?,16?,17?,19?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436521
PNG
(CHEMBL2397362)
Show SMILES C[C@H]1CC[C@@H](CC1)C(=O)N1CCN(C[C@H]1C)c1ccccn1 |r,wU:4.7,wD:14.16,1.0,(2.85,-47.1,;4.18,-46.33,;5.52,-47.09,;6.86,-46.31,;6.84,-44.77,;5.5,-44.01,;4.18,-44.79,;8.17,-43.99,;8.16,-42.45,;9.51,-44.74,;9.51,-46.3,;10.84,-47.06,;12.17,-46.3,;12.17,-44.76,;10.84,-43.98,;10.85,-42.44,;13.5,-47.07,;13.49,-48.61,;14.82,-49.38,;16.16,-48.61,;16.16,-47.07,;14.83,-46.3,)|
Show InChI InChI=1S/C18H27N3O/c1-14-6-8-16(9-7-14)18(22)21-12-11-20(13-15(21)2)17-5-3-4-10-19-17/h3-5,10,14-16H,6-9,11-13H2,1-2H3/t14-,15-,16-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436520
PNG
(CHEMBL2397365)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)[C@H]1CC[C@@H](CC1)C(C)(C)C |r,wU:15.16,1.0,wD:18.23,(15.17,-53.24,;13.83,-54.01,;12.51,-53.23,;11.18,-53.99,;11.18,-55.55,;12.51,-56.31,;13.83,-55.55,;15.16,-56.32,;15.16,-57.86,;16.49,-58.63,;17.83,-57.86,;17.82,-56.31,;16.49,-55.55,;9.84,-53.23,;9.82,-51.69,;8.51,-54.01,;8.53,-55.55,;7.19,-56.33,;5.85,-55.57,;5.85,-54.03,;7.17,-53.25,;4.52,-56.34,;3.18,-55.58,;4.53,-57.88,;3.18,-57.1,)|
Show InChI InChI=1S/C21H33N3O/c1-16-15-23(13-14-24(16)19-7-5-6-12-22-19)20(25)17-8-10-18(11-9-17)21(2,3)4/h5-7,12,16-18H,8-11,13-15H2,1-4H3/t16-,17-,18-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436523
PNG
(CHEMBL2397359)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CCCCCC1 |r|
Show InChI InChI=1S/C18H27N3O/c1-15-14-20(18(22)16-8-4-2-3-5-9-16)12-13-21(15)17-10-6-7-11-19-17/h6-7,10-11,15-16H,2-5,8-9,12-14H2,1H3/t15-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436524
PNG
(CHEMBL2397358)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CCCCCC1)c1ccccn1 |r|
Show InChI InChI=1S/C18H27N3O/c1-15-14-20(17-10-6-7-11-19-17)12-13-21(15)18(22)16-8-4-2-3-5-9-16/h6-7,10-11,15-16H,2-5,8-9,12-14H2,1H3/t15-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436529
PNG
(CHEMBL2397340)
Show SMILES C[C@@H]1CN(CCN1C(=O)C12C3C4C5C3C1C5C24)c1ccccn1 |r,wD:1.0,(12.27,-3.85,;12.27,-5.4,;13.61,-6.18,;13.61,-7.73,;12.27,-8.5,;10.92,-7.73,;10.92,-6.18,;9.58,-5.41,;9.58,-3.85,;8.26,-6.19,;7.32,-6.95,;5.78,-6.95,;5.78,-8.49,;7.32,-8.49,;8.26,-7.73,;6.72,-7.73,;6.72,-6.19,;14.96,-8.5,;14.96,-10.05,;16.3,-10.83,;17.64,-10.05,;17.64,-8.5,;16.3,-7.73,)|
Show InChI InChI=1S/C19H21N3O/c1-9-8-21(10-4-2-3-5-20-10)6-7-22(9)18(23)19-15-12-11-13(15)17(19)14(11)16(12)19/h2-5,9,11-17H,6-8H2,1H3/t9-,11?,12?,13?,14?,15?,16?,17?,19?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436519
PNG
(CHEMBL2397367)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CC2CCCC(C2)C1 |r|
Show InChI InChI=1S/C20H29N3O/c1-15-14-22(9-10-23(15)19-7-2-3-8-21-19)20(24)18-12-16-5-4-6-17(11-16)13-18/h2-3,7-8,15-18H,4-6,9-14H2,1H3/t15-,16?,17?,18?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436522
PNG
(CHEMBL2397361)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CCCCCCC1 |r|
Show InChI InChI=1S/C19H29N3O/c1-16-15-21(13-14-22(16)18-11-7-8-12-20-18)19(23)17-9-5-3-2-4-6-10-17/h7-8,11-12,16-17H,2-6,9-10,13-15H2,1H3/t16-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436515
PNG
(CHEMBL2397375)
Show SMILES C[C@@H]1CN(CCN1c1cnccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(4-5-24(14)18-12-21-2-3-22-18)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436519
PNG
(CHEMBL2397367)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CC2CCCC(C2)C1 |r|
Show InChI InChI=1S/C20H29N3O/c1-15-14-22(9-10-23(15)19-7-2-3-8-21-19)20(24)18-12-16-5-4-6-17(11-16)13-18/h2-3,7-8,15-18H,4-6,9-14H2,1H3/t15-,16?,17?,18?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436516
PNG
(CHEMBL2397373)
Show SMILES C[C@@H]1CN(CCN1c1ncccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C20H28N4O/c1-14-13-23(5-6-24(14)19-21-3-2-4-22-19)18(25)20-10-15-7-16(11-20)9-17(8-15)12-20/h2-4,14-17H,5-13H2,1H3/t14-,15?,16?,17?,20?/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436510
PNG
(CHEMBL2397355)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C(C)(C)C |r|
Show InChI InChI=1S/C15H23N3O/c1-12-11-17(14(19)15(2,3)4)9-10-18(12)13-7-5-6-8-16-13/h5-8,12H,9-11H2,1-4H3/t12-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436509
PNG
(CHEMBL2397357)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CCCCC1 |r|
Show InChI InChI=1S/C17H25N3O/c1-14-13-19(17(21)15-7-3-2-4-8-15)11-12-20(14)16-9-5-6-10-18-16/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3/t14-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436513
PNG
(CHEMBL2397352)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CC1)c1ccccn1 |r|
Show InChI InChI=1S/C14H19N3O/c1-11-10-16(13-4-2-3-7-15-13)8-9-17(11)14(18)12-5-6-12/h2-4,7,11-12H,5-6,8-10H2,1H3/t11-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436512
PNG
(CHEMBL2397353)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CC1 |r|
Show InChI InChI=1S/C14H19N3O/c1-11-10-16(14(18)12-5-6-12)8-9-17(11)13-4-2-3-7-15-13/h2-4,7,11-12H,5-6,8-10H2,1H3/t11-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436511
PNG
(CHEMBL2397354)
Show SMILES C[C@@H]1CN(CCN1C(=O)C(C)(C)C)c1ccccn1 |r|
Show InChI InChI=1S/C15H23N3O/c1-12-11-17(13-7-5-6-8-16-13)9-10-18(12)14(19)15(2,3)4/h5-8,12H,9-11H2,1-4H3/t12-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436528
PNG
(CHEMBL2397339)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C12C3C4C5C3C1C5C24 |r,wU:1.0,(31.17,-6.4,;29.84,-7.17,;28.49,-6.39,;27.15,-7.17,;27.15,-8.71,;28.49,-9.49,;29.84,-8.71,;31.18,-9.49,;31.18,-11.04,;32.52,-11.82,;33.86,-11.04,;33.86,-9.49,;32.52,-8.71,;25.81,-6.39,;25.81,-4.84,;24.48,-7.18,;23.54,-7.93,;22,-7.93,;22,-9.47,;23.54,-9.47,;24.48,-8.72,;22.94,-8.72,;22.94,-7.18,)|
Show InChI InChI=1S/C19H21N3O/c1-9-8-21(6-7-22(9)10-4-2-3-5-20-10)18(23)19-15-12-11-13(15)17(19)14(11)16(12)19/h2-5,9,11-17H,6-8H2,1H3/t9-,11?,12?,13?,14?,15?,16?,17?,19?/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436508
PNG
(CHEMBL2397363)
Show SMILES C[C@H]1CC[C@@H](CC1)C(=O)N1CCN([C@H](C)C1)c1ccccn1 |r,wU:4.7,13.14,wD:1.0,(22.11,-46.55,;23.45,-45.78,;24.79,-46.54,;26.12,-45.76,;26.1,-44.23,;24.76,-43.46,;23.44,-44.24,;27.43,-43.44,;27.42,-41.9,;28.77,-44.2,;28.77,-45.76,;30.1,-46.52,;31.43,-45.76,;31.43,-44.22,;32.76,-43.45,;30.1,-43.44,;32.76,-46.53,;32.75,-48.07,;34.08,-48.84,;35.42,-48.07,;35.42,-46.52,;34.09,-45.76,)|
Show InChI InChI=1S/C18H27N3O/c1-14-6-8-16(9-7-14)18(22)20-11-12-21(15(2)13-20)17-5-3-4-10-19-17/h3-5,10,14-16H,6-9,11-13H2,1-2H3/t14-,15-,16-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436507
PNG
(CHEMBL2397371)
Show SMILES C[C@@H]1CN(CCN1c1ccncc1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(6-7-24(15)19-2-4-22-5-3-19)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436508
PNG
(CHEMBL2397363)
Show SMILES C[C@H]1CC[C@@H](CC1)C(=O)N1CCN([C@H](C)C1)c1ccccn1 |r,wU:4.7,13.14,wD:1.0,(22.11,-46.55,;23.45,-45.78,;24.79,-46.54,;26.12,-45.76,;26.1,-44.23,;24.76,-43.46,;23.44,-44.24,;27.43,-43.44,;27.42,-41.9,;28.77,-44.2,;28.77,-45.76,;30.1,-46.52,;31.43,-45.76,;31.43,-44.22,;32.76,-43.45,;30.1,-43.44,;32.76,-46.53,;32.75,-48.07,;34.08,-48.84,;35.42,-48.07,;35.42,-46.52,;34.09,-45.76,)|
Show InChI InChI=1S/C18H27N3O/c1-14-6-8-16(9-7-14)18(22)20-11-12-21(15(2)13-20)17-5-3-4-10-19-17/h3-5,10,14-16H,6-9,11-13H2,1-2H3/t14-,15-,16-/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436513
PNG
(CHEMBL2397352)
Show SMILES C[C@@H]1CN(CCN1C(=O)C1CC1)c1ccccn1 |r|
Show InChI InChI=1S/C14H19N3O/c1-11-10-16(13-4-2-3-7-15-13)8-9-17(11)14(18)12-5-6-12/h2-4,7,11-12H,5-6,8-10H2,1H3/t11-/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436507
PNG
(CHEMBL2397371)
Show SMILES C[C@@H]1CN(CCN1c1ccncc1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20|
Show InChI InChI=1S/C21H29N3O/c1-15-14-23(6-7-24(15)19-2-4-22-5-3-19)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,15-18H,6-14H2,1H3/t15-,16?,17?,18?,21?/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436528
PNG
(CHEMBL2397339)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C12C3C4C5C3C1C5C24 |r,wU:1.0,(31.17,-6.4,;29.84,-7.17,;28.49,-6.39,;27.15,-7.17,;27.15,-8.71,;28.49,-9.49,;29.84,-8.71,;31.18,-9.49,;31.18,-11.04,;32.52,-11.82,;33.86,-11.04,;33.86,-9.49,;32.52,-8.71,;25.81,-6.39,;25.81,-4.84,;24.48,-7.18,;23.54,-7.93,;22,-7.93,;22,-9.47,;23.54,-9.47,;24.48,-8.72,;22.94,-8.72,;22.94,-7.18,)|
Show InChI InChI=1S/C19H21N3O/c1-9-8-21(6-7-22(9)10-4-2-3-5-20-10)18(23)19-15-12-11-13(15)17(19)14(11)16(12)19/h2-5,9,11-17H,6-8H2,1H3/t9-,11?,12?,13?,14?,15?,16?,17?,19?/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436511
PNG
(CHEMBL2397354)
Show SMILES C[C@@H]1CN(CCN1C(=O)C(C)(C)C)c1ccccn1 |r|
Show InChI InChI=1S/C15H23N3O/c1-12-11-17(13-7-5-6-8-16-13)9-10-18(12)14(19)15(2,3)4/h5-8,12H,9-11H2,1-4H3/t12-/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436509
PNG
(CHEMBL2397357)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CCCCC1 |r|
Show InChI InChI=1S/C17H25N3O/c1-14-13-19(17(21)15-7-3-2-4-8-15)11-12-20(14)16-9-5-6-10-18-16/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3/t14-/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436510
PNG
(CHEMBL2397355)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C(C)(C)C |r|
Show InChI InChI=1S/C15H23N3O/c1-12-11-17(14(19)15(2,3)4)9-10-18(12)13-7-5-6-8-16-13/h5-8,12H,9-11H2,1-4H3/t12-/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))		BDBM50436512
PNG
(CHEMBL2397353)
Show SMILES C[C@@H]1CN(CCN1c1ccccn1)C(=O)C1CC1 |r|
Show InChI InChI=1S/C14H19N3O/c1-11-10-16(14(18)12-5-6-12)8-9-17(11)13-4-2-3-7-15-13/h2-4,7,11-12H,5-6,8-10H2,1H3/t11-/m1/s1
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n/an/a>3.16E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization

Bioorg Med Chem Lett 23: 3713-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.020
BindingDB Entry DOI: 10.7270/Q2Z60QGB
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%