Found 39 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610101
(CHEMBL5269255)Show SMILES COc1cc(F)cc2c(N3CCN(CC3)c3ccccc3OC3CC3)c(nnc12)C#N | PDB
UniProtKB/SwissProt
GoogleScholar
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| PC cid
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UniChem
| | n/a | n/a | n/a | n/a | 310 | n/a | n/a | n/a | n/a |
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Ligand-Target Pair | |
Metabotropic glutamate receptor 1
(Homo sapiens (Human)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
UniProtKB/SwissProt
antibodypedia
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| PC cid
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UniChem
| | n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Homo sapiens (Human)) | BDBM50283491
(CHEMBL1585091)Show SMILES COC(=O)c1ccc(cc1)-n1c(C)cc(C(=O)CSc2ccc(NC(C)=O)cc2)c1C Show InChI InChI=1S/C24H24N2O4S/c1-15-13-22(16(2)26(15)20-9-5-18(6-10-20)24(29)30-4)23(28)14-31-21-11-7-19(8-12-21)25-17(3)27/h5-13H,14H2,1-4H3,(H,25,27) | PDB
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| |
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Ligand-Target Pair | |
Metabotropic glutamate receptor 8
(Homo sapiens (Human)) | BDBM50283487
(CHEMBL4162576)Show InChI InChI=1S/C17H11Cl2N3O2/c18-11-4-7-16(21-10-11)24-15-6-5-12(9-13(15)19)22-17(23)14-3-1-2-8-20-14/h1-10H,(H,22,23) | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
UniProtKB/SwissProt
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| PC cid
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| | n/a | n/a | n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a |
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610099
(CHEMBL5279292)Show SMILES COc1ccccc1N1CCN(CC1)c1c(nnc2c(OC)cc(F)cc12)C#N | PDB
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| | n/a | n/a | n/a | n/a | 820 | n/a | n/a | n/a | n/a |
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610100
(CHEMBL5288109)Show SMILES COc1cc(F)cc2c(N3CCN(CC3)c3ccccc3OC(C)C)c(nnc12)C#N | PDB
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| | n/a | n/a | n/a | n/a | 260 | n/a | n/a | n/a | n/a |
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610110
(CHEMBL5288733)Show SMILES COc1cc(F)cc2c(N3CCN4C(C3)C(=O)Nc3ccccc43)c(nnc12)C#N | PDB
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| | n/a | n/a | n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a |
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Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50610104
(CHEMBL5282643)Show SMILES [H][C@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 4
(Homo sapiens (Human)) | BDBM50116515
(CHEMBL3609729)Show InChI InChI=1S/C12H12N6S/c1-7-3-4-13-11(16-7)18-12-17-10(8(2)19-12)9-5-14-15-6-9/h3-6H,1-2H3,(H,14,15)(H,13,16,17,18) | PDB
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Ligand-Target Pair | 
3D Structure (crystal) |
Metabotropic glutamate receptor 8
(Homo sapiens (Human)) | BDBM50283491
(CHEMBL1585091)Show SMILES COC(=O)c1ccc(cc1)-n1c(C)cc(C(=O)CSc2ccc(NC(C)=O)cc2)c1C Show InChI InChI=1S/C24H24N2O4S/c1-15-13-22(16(2)26(15)20-9-5-18(6-10-20)24(29)30-4)23(28)14-31-21-11-7-19(8-12-21)25-17(3)27/h5-13H,14H2,1-4H3,(H,25,27) | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 3
(Homo sapiens (Human)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610105
(CHEMBL5290711)Show SMILES [H][C@]12COc3ccccc3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 2
(Homo sapiens (Human)) | BDBM50610104
(CHEMBL5282643)Show SMILES [H][C@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 4
(Homo sapiens (Human)) | BDBM50283491
(CHEMBL1585091)Show SMILES COC(=O)c1ccc(cc1)-n1c(C)cc(C(=O)CSc2ccc(NC(C)=O)cc2)c1C Show InChI InChI=1S/C24H24N2O4S/c1-15-13-22(16(2)26(15)20-9-5-18(6-10-20)24(29)30-4)23(28)14-31-21-11-7-19(8-12-21)25-17(3)27/h5-13H,14H2,1-4H3,(H,25,27) | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 4
(Homo sapiens (Human)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 8
(Homo sapiens (Human)) | BDBM50116515
(CHEMBL3609729)Show InChI InChI=1S/C12H12N6S/c1-7-3-4-13-11(16-7)18-12-17-10(8(2)19-12)9-5-14-15-6-9/h3-6H,1-2H3,(H,14,15)(H,13,16,17,18) | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 2
(Homo sapiens (Human)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610106
(CHEMBL5271313)Show SMILES [H][C@@]12COc3ccccc3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Homo sapiens (Human)) | BDBM50283487
(CHEMBL4162576)Show InChI InChI=1S/C17H11Cl2N3O2/c18-11-4-7-16(21-10-11)24-15-6-5-12(9-13(15)19)22-17(23)14-3-1-2-8-20-14/h1-10H,(H,22,23) | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610109
(CHEMBL5273386)Show SMILES COc1cc(F)cc2c(N3CCN4C(CNc5ccccc45)C3)c(nnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 8
(Homo sapiens (Human)) | BDBM50610104
(CHEMBL5282643)Show SMILES [H][C@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Homo sapiens (Human)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 8
(Homo sapiens (Human)) | BDBM50283472
(CHEMBL4160748)Show SMILES COc1ccc(-c2c(C)nn3c(cc(C)nc23)C(F)(F)F)c(F)c1F |(9.45,-43.77,;10.47,-42.62,;9.99,-41.15,;8.48,-40.84,;7.99,-39.38,;9.02,-38.23,;8.54,-36.77,;9.43,-35.53,;10.97,-35.52,;8.53,-34.29,;7.07,-34.77,;5.74,-34,;4.41,-34.77,;4.41,-36.31,;3.08,-37.09,;5.74,-37.08,;7.08,-36.3,;5.74,-32.46,;7.08,-31.68,;4.41,-31.68,;5.73,-30.92,;10.52,-38.54,;11.55,-37.39,;11.01,-40,;12.52,-40.31,)| Show InChI InChI=1S/C16H12F5N3O/c1-7-6-11(16(19,20)21)24-15(22-7)12(8(2)23-24)9-4-5-10(25-3)14(18)13(9)17/h4-6H,1-3H3 | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 1
(Homo sapiens (Human)) | BDBM50610104
(CHEMBL5282643)Show SMILES [H][C@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Homo sapiens (Human)) | BDBM50116515
(CHEMBL3609729)Show InChI InChI=1S/C12H12N6S/c1-7-3-4-13-11(16-7)18-12-17-10(8(2)19-12)9-5-14-15-6-9/h3-6H,1-2H3,(H,14,15)(H,13,16,17,18) | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Homo sapiens (Human)) | BDBM50283472
(CHEMBL4160748)Show SMILES COc1ccc(-c2c(C)nn3c(cc(C)nc23)C(F)(F)F)c(F)c1F |(9.45,-43.77,;10.47,-42.62,;9.99,-41.15,;8.48,-40.84,;7.99,-39.38,;9.02,-38.23,;8.54,-36.77,;9.43,-35.53,;10.97,-35.52,;8.53,-34.29,;7.07,-34.77,;5.74,-34,;4.41,-34.77,;4.41,-36.31,;3.08,-37.09,;5.74,-37.08,;7.08,-36.3,;5.74,-32.46,;7.08,-31.68,;4.41,-31.68,;5.73,-30.92,;10.52,-38.54,;11.55,-37.39,;11.01,-40,;12.52,-40.31,)| Show InChI InChI=1S/C16H12F5N3O/c1-7-6-11(16(19,20)21)24-15(22-7)12(8(2)23-24)9-4-5-10(25-3)14(18)13(9)17/h4-6H,1-3H3 | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610098
(CHEMBL5285846)Show SMILES COc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(nnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610102
(CHEMBL5286074)Show SMILES COc1cc(F)cc2c(N3CCN4C(COc5cccc(F)c45)C3)c(nnc12)C#N | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610103
(CHEMBL5281472)Show SMILES [H][C@@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610107
(CHEMBL5268103)Show SMILES [H][C@]12COc3ccccc3N1CCN(C2)c1c(nnc2c(OC)cc(cc12)C(F)(F)F)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610108
(CHEMBL5285820)Show SMILES [H][C@@]12COc3ccccc3N1CCN(C2)c1c(nnc2c(OC)cc(cc12)C(F)(F)F)C#N |r| | PDB
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Ligand-Target Pair | |
Metabotropic glutamate receptor 3
(Homo sapiens (Human)) | BDBM50610104
(CHEMBL5282643)Show SMILES [H][C@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Metabotropic glutamate receptor 4
(Homo sapiens (Human)) | BDBM50283487
(CHEMBL4162576)Show InChI InChI=1S/C17H11Cl2N3O2/c18-11-4-7-16(21-10-11)24-15-6-5-12(9-13(15)19)22-17(23)14-3-1-2-8-20-14/h1-10H,(H,22,23) | PDB
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Metabotropic glutamate receptor 8
(Homo sapiens (Human)) | BDBM50547305
(CHEMBL4761695)Show SMILES [2H]C([2H])([2H])Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N | PDB
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Metabotropic glutamate receptor 7
(Rattus norvegicus (Rat)) | BDBM50610104
(CHEMBL5282643)Show SMILES [H][C@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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Metabotropic glutamate receptor 4
(Homo sapiens (Human)) | BDBM50283472
(CHEMBL4160748)Show SMILES COc1ccc(-c2c(C)nn3c(cc(C)nc23)C(F)(F)F)c(F)c1F |(9.45,-43.77,;10.47,-42.62,;9.99,-41.15,;8.48,-40.84,;7.99,-39.38,;9.02,-38.23,;8.54,-36.77,;9.43,-35.53,;10.97,-35.52,;8.53,-34.29,;7.07,-34.77,;5.74,-34,;4.41,-34.77,;4.41,-36.31,;3.08,-37.09,;5.74,-37.08,;7.08,-36.3,;5.74,-32.46,;7.08,-31.68,;4.41,-31.68,;5.73,-30.92,;10.52,-38.54,;11.55,-37.39,;11.01,-40,;12.52,-40.31,)| Show InChI InChI=1S/C16H12F5N3O/c1-7-6-11(16(19,20)21)24-15(22-7)12(8(2)23-24)9-4-5-10(25-3)14(18)13(9)17/h4-6H,1-3H3 | PDB
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Metabotropic glutamate receptor 4
(Homo sapiens (Human)) | BDBM50610104
(CHEMBL5282643)Show SMILES [H][C@]12COc3cccc(F)c3N1CCN(C2)c1c(nnc2c(OC)cc(F)cc12)C#N |r| | PDB
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