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Compile Data Set for Download or QSAR

Found 597 hits with Last Name = 'choi' and Initial = 'ej'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292146
PNG
(US10100057, Example 1 | US11046702, Example 1 | US...)
Show SMILES Fc1ccccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H14FN3O/c20-18-9-5-4-8-17(18)14-10-21-19-22-15(12-23(19)11-14)13-24-16-6-2-1-3-7-16/h1-12H,13H2
PDB
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292147
PNG
(US10100057, Example 2 | US11046702, Example 2 | US...)
Show SMILES C(Oc1ccccc1)c1cn2cc(cnc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N3O/c1-3-7-15(8-4-1)16-11-20-19-21-17(13-22(19)12-16)14-23-18-9-5-2-6-10-18/h1-13H,14H2
PDB
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292148
PNG
(US10100057, Example 3 | US11046702, Example 3 | US...)
Show SMILES Fc1ccc(c(F)c1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H13F2N3O/c20-14-6-7-17(18(21)8-14)13-9-22-19-23-15(11-24(19)10-13)12-25-16-4-2-1-3-5-16/h1-11H,12H2
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n/an/an/an/a<100n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292149
PNG
(US10100057, Example 4 | US11046702, Example 4 | US...)
Show SMILES COc1ccccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H17N3O2/c1-24-19-10-6-5-9-18(19)15-11-21-20-22-16(13-23(20)12-15)14-25-17-7-3-2-4-8-17/h2-13H,14H2,1H3
PDB
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292150
PNG
(US10100057, Example 5 | US11046702, Example 5 | US...)
Show SMILES Cc1ccccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H17N3O/c1-15-7-5-6-10-19(15)16-11-21-20-22-17(13-23(20)12-16)14-24-18-8-3-2-4-9-18/h2-13H,14H2,1H3
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n/an/an/an/a<100n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292151
PNG
(US10100057, Example 6 | US11046702, Example 6 | US...)
Show SMILES Cc1cc(F)ccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H16FN3O/c1-14-9-16(21)7-8-19(14)15-10-22-20-23-17(12-24(20)11-15)13-25-18-5-3-2-4-6-18/h2-12H,13H2,1H3
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n/an/an/an/a<100n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292152
PNG
(US10100057, Example 7 | US11046702, Example 7 | US...)
Show SMILES Fc1cccc(c1F)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H13F2N3O/c20-17-8-4-7-16(18(17)21)13-9-22-19-23-14(11-24(19)10-13)12-25-15-5-2-1-3-6-15/h1-11H,12H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292153
PNG
(US10100057, Example 59 | US10100057, Example 8 | U...)
Show SMILES Fc1ccc(cc1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H14FN3O/c20-16-8-6-14(7-9-16)15-10-21-19-22-17(12-23(19)11-15)13-24-18-4-2-1-3-5-18/h1-12H,13H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292154
PNG
(US10100057, Example 9 | US11046702, Example 9 | US...)
Show SMILES Nc1cccc(c1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H16N4O/c20-16-6-4-5-14(9-16)15-10-21-19-22-17(12-23(19)11-15)13-24-18-7-2-1-3-8-18/h1-12H,13,20H2
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292155
PNG
(US10100057, Example 10 | US11046702, Example 10 | ...)
Show SMILES Nc1ccccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H16N4O/c20-18-9-5-4-8-17(18)14-10-21-19-22-15(12-23(19)11-14)13-24-16-6-2-1-3-7-16/h1-12H,13,20H2
PDB
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292156
PNG
(US10100057, Example 11 | US11046702, Example 11 | ...)
Show SMILES Cc1ccc(N)cc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H18N4O/c1-14-7-8-16(21)9-19(14)15-10-22-20-23-17(12-24(20)11-15)13-25-18-5-3-2-4-6-18/h2-12H,13,21H2,1H3
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292157
PNG
(US10100057, Example 12 | US11046702, Example 12 | ...)
Show SMILES Nc1cc(ccc1F)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H15FN4O/c20-17-7-6-13(8-18(17)21)14-9-22-19-23-15(11-24(19)10-14)12-25-16-4-2-1-3-5-16/h1-11H,12,21H2
PDB
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292158
PNG
(US10100057, Example 13 | US11046702, Example 13 | ...)
Show SMILES Fc1ccc(cc1Cl)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H13ClFN3O/c20-17-8-13(6-7-18(17)21)14-9-22-19-23-15(11-24(19)10-14)12-25-16-4-2-1-3-5-16/h1-11H,12H2
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292159
PNG
(US10100057, Example 14 | US11046702, Example 14 | ...)
Show SMILES CN(C)c1ccccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C21H20N4O/c1-24(2)20-11-7-6-10-19(20)16-12-22-21-23-17(14-25(21)13-16)15-26-18-8-4-3-5-9-18/h3-14H,15H2,1-2H3
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292160
PNG
(US10100057, Example 15 | US11046702, Example 15 | ...)
Show SMILES Fc1ccc(c(Cl)c1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H13ClFN3O/c20-18-8-14(21)6-7-17(18)13-9-22-19-23-15(11-24(19)10-13)12-25-16-4-2-1-3-5-16/h1-11H,12H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292161
PNG
(US10100057, Example 16 | US11046702, Example 16 | ...)
Show SMILES Oc1ccccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H15N3O2/c23-18-9-5-4-8-17(18)14-10-20-19-21-15(12-22(19)11-14)13-24-16-6-2-1-3-7-16/h1-12,23H,13H2
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292162
PNG
(US10100057, Example 17 | US11046702, Example 17 | ...)
Show SMILES Oc1cccc(c1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H15N3O2/c23-17-6-4-5-14(9-17)15-10-20-19-21-16(12-22(19)11-15)13-24-18-7-2-1-3-8-18/h1-12,23H,13H2
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292163
PNG
(US10100057, Example 18 | US11046702, Example 18 | ...)
Show SMILES Fc1ccc(-c2cnc3nc(COc4ccccc4)cn3c2)c(c1)C(F)(F)F
Show InChI InChI=1S/C20H13F4N3O/c21-14-6-7-17(18(8-14)20(22,23)24)13-9-25-19-26-15(11-27(19)10-13)12-28-16-4-2-1-3-5-16/h1-11H,12H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292164
PNG
(US10100057, Example 19 | US11046702, Example 19 | ...)
Show SMILES Fc1ccc(cc1F)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H13F2N3O/c20-17-7-6-13(8-18(17)21)14-9-22-19-23-15(11-24(19)10-14)12-25-16-4-2-1-3-5-16/h1-11H,12H2
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292165
PNG
(US10100057, Example 20 | US11046702, Example 20 | ...)
Show SMILES COc1cc(F)ccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H16FN3O2/c1-25-19-9-15(21)7-8-18(19)14-10-22-20-23-16(12-24(20)11-14)13-26-17-5-3-2-4-6-17/h2-12H,13H2,1H3
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292166
PNG
(US10100057, Example 21 | US11046702, Example 21 | ...)
Show SMILES COc1cc(ccc1F)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H16FN3O2/c1-25-19-9-14(7-8-18(19)21)15-10-22-20-23-16(12-24(20)11-15)13-26-17-5-3-2-4-6-17/h2-12H,13H2,1H3
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292167
PNG
(US10100057, Example 22 | US11046702, Example 22 | ...)
Show SMILES COc1cc(Cl)ccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H16ClN3O2/c1-25-19-9-15(21)7-8-18(19)14-10-22-20-23-16(12-24(20)11-14)13-26-17-5-3-2-4-6-17/h2-12H,13H2,1H3
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292168
PNG
(US10100057, Example 23 | US11046702, Example 23 | ...)
Show SMILES COc1cc(ccc1-c1cnc2nc(COc3ccccc3)cn2c1)C#N
Show InChI InChI=1S/C21H16N4O2/c1-26-20-9-15(10-22)7-8-19(20)16-11-23-21-24-17(13-25(21)12-16)14-27-18-5-3-2-4-6-18/h2-9,11-13H,14H2,1H3
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292169
PNG
(US10100057, Example 24 | US11046702, Example 24 | ...)
Show SMILES Fc1ccc(c2OCOc12)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H14FN3O3/c21-17-7-6-16(18-19(17)27-12-26-18)13-8-22-20-23-14(10-24(20)9-13)11-25-15-4-2-1-3-5-15/h1-10H,11-12H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292170
PNG
(US10100057, Example 25 | US11046702, Example 25 | ...)
Show SMILES OCc1cc(F)ccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H16FN3O2/c21-16-6-7-19(14(8-16)12-25)15-9-22-20-23-17(11-24(20)10-15)13-26-18-4-2-1-3-5-18/h1-11,25H,12-13H2
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n/an/an/an/a<100n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292171
PNG
(US10100057, Example 26 | US11046702, Example 26 | ...)
Show SMILES CSc1cc(F)ccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H16FN3OS/c1-26-19-9-15(21)7-8-18(19)14-10-22-20-23-16(12-24(20)11-14)13-25-17-5-3-2-4-6-17/h2-12H,13H2,1H3
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292172
PNG
(US10100057, Example 27 | US11046702, Example 27 | ...)
Show SMILES Nc1cc(F)ccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H15FN4O/c20-14-6-7-17(18(21)8-14)13-9-22-19-23-15(11-24(19)10-13)12-25-16-4-2-1-3-5-16/h1-11H,12,21H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292173
PNG
(US10100057, Example 28 | US11046702, Example 28 | ...)
Show SMILES COc1cc(c(F)cc1F)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C20H15F2N3O2/c1-26-19-7-16(17(21)8-18(19)22)13-9-23-20-24-14(11-25(20)10-13)12-27-15-5-3-2-4-6-15/h2-11H,12H2,1H3
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292174
PNG
(US10100057, Example 29 | US11046702, Example 29 | ...)
Show SMILES Fc1ncccc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C18H13FN4O/c19-17-16(7-4-8-20-17)13-9-21-18-22-14(11-23(18)10-13)12-24-15-5-2-1-3-6-15/h1-11H,12H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292175
PNG
(US10100057, Example 30 | US11046702, Example 30 | ...)
Show SMILES COc1ccc(cn1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H16N4O2/c1-24-18-8-7-14(9-20-18)15-10-21-19-22-16(12-23(19)11-15)13-25-17-5-3-2-4-6-17/h2-12H,13H2,1H3
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292176
PNG
(US10100057, Example 31 | US11046702, Example 31 | ...)
Show SMILES Fc1ccc(cn1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C18H13FN4O/c19-17-7-6-13(8-20-17)14-9-21-18-22-15(11-23(18)10-14)12-24-16-4-2-1-3-5-16/h1-11H,12H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292177
PNG
(US10100057, Example 32 | US11046702, Example 32 | ...)
Show SMILES Cc1ccncc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H16N4O/c1-14-7-8-20-10-18(14)15-9-21-19-22-16(12-23(19)11-15)13-24-17-5-3-2-4-6-17/h2-12H,13H2,1H3
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292178
PNG
(US10100057, Example 33 | US11046702, Example 33 | ...)
Show SMILES Fc1ccc(c(F)n1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C18H12F2N4O/c19-16-7-6-15(17(20)23-16)12-8-21-18-22-13(10-24(18)9-12)11-25-14-4-2-1-3-5-14/h1-10H,11H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292179
PNG
(US10100057, Example 34 | US11046702, Example 34 | ...)
Show SMILES Clc1ccc(cn1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C18H13ClN4O/c19-17-7-6-13(8-20-17)14-9-21-18-22-15(11-23(18)10-14)12-24-16-4-2-1-3-5-16/h1-11H,12H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292183
PNG
(US10100057, Example 38 | US11046702, Example 38 | ...)
Show SMILES Cc1cc(F)ncc1-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H15FN4O/c1-13-7-18(20)21-9-17(13)14-8-22-19-23-15(11-24(19)10-14)12-25-16-5-3-2-4-6-16/h2-11H,12H2,1H3
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292184
PNG
(US10100057, Example 39 | US11046702, Example 39 | ...)
Show SMILES Cc1cc(cnc1F)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C19H15FN4O/c1-13-7-14(8-21-18(13)20)15-9-22-19-23-16(11-24(19)10-15)12-25-17-5-3-2-4-6-17/h2-11H,12H2,1H3
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292185
PNG
(US10100057, Example 40 | US11046702, Example 40 | ...)
Show SMILES Fc1ccc(nc1)-c1cnc2nc(COc3ccccc3)cn2c1
Show InChI InChI=1S/C18H13FN4O/c19-14-6-7-17(20-9-14)13-8-21-18-22-15(11-23(18)10-13)12-24-16-4-2-1-3-5-16/h1-11H,12H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292186
PNG
(US10100057, Example 41 | US11046702, Example 41 | ...)
Show SMILES Fc1cccc(OCc2cn3cc(cnc3n2)-c2ccc(F)cc2F)c1
Show InChI InChI=1S/C19H12F3N3O/c20-13-2-1-3-16(6-13)26-11-15-10-25-9-12(8-23-19(25)24-15)17-5-4-14(21)7-18(17)22/h1-10H,11H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292187
PNG
(US10100057, Example 42 | US11046702, Example 42 | ...)
Show SMILES COc1cc(F)ccc1-c1cnc2nc(COc3cccc(F)c3)cn2c1
Show InChI InChI=1S/C20H15F2N3O2/c1-26-19-8-15(22)5-6-18(19)13-9-23-20-24-16(11-25(20)10-13)12-27-17-4-2-3-14(21)7-17/h2-11H,12H2,1H3
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n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292188
PNG
(US10100057, Example 43 | US11046702, Example 43 | ...)
Show SMILES Oc1cc(ccc1F)-c1cnc2nc(COc3cccc(F)c3)cn2c1
Show InChI InChI=1S/C19H13F2N3O2/c20-14-2-1-3-16(7-14)26-11-15-10-24-9-13(8-22-19(24)23-15)12-4-5-17(21)18(25)6-12/h1-10,25H,11H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292189
PNG
(US10100057, Example 44 | US11046702, Example 44 | ...)
Show SMILES Nc1ccccc1-c1cnc2nc(COc3cccc(F)c3)cn2c1
Show InChI InChI=1S/C19H15FN4O/c20-14-4-3-5-16(8-14)25-12-15-11-24-10-13(9-22-19(24)23-15)17-6-1-2-7-18(17)21/h1-11H,12,21H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292190
PNG
(US10100057, Example 45 | US11046702, Example 45 | ...)
Show SMILES Fc1cccc(OCc2cn3cc(cnc3n2)-c2ccncc2Cl)c1
Show InChI InChI=1S/C18H12ClFN4O/c19-17-8-21-5-4-16(17)12-7-22-18-23-14(10-24(18)9-12)11-25-15-3-1-2-13(20)6-15/h1-10H,11H2
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292191
PNG
(US10100057, Example 46 | US11046702, Example 46 | ...)
Show SMILES Cc1ccncc1-c1cnc2nc(COc3cccc(F)c3)cn2c1
Show InChI InChI=1S/C19H15FN4O/c1-13-5-6-21-9-18(13)14-8-22-19-23-16(11-24(19)10-14)12-25-17-4-2-3-15(20)7-17/h2-11H,12H2,1H3
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SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292192
PNG
(US10100057, Example 47 | US11046702, Example 47 | ...)
Show SMILES Fc1ccc(OCc2cn3cc(cnc3n2)-c2ccc(F)cc2F)cc1
Show InChI InChI=1S/C19H12F3N3O/c20-13-1-4-16(5-2-13)26-11-15-10-25-9-12(8-23-19(25)24-15)17-6-3-14(21)7-18(17)22/h1-10H,11H2
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n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292193
PNG
(US10100057, Example 48 | US11046702, Example 48 | ...)
Show SMILES Cc1cc(F)ccc1-c1cnc2nc(COc3ccc(F)cc3)cn2c1
Show InChI InChI=1S/C20H15F2N3O/c1-13-8-16(22)4-7-19(13)14-9-23-20-24-17(11-25(20)10-14)12-26-18-5-2-15(21)3-6-18/h2-11H,12H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292194
PNG
(US10100057, Example 49 | US11046702, Example 49 | ...)
Show SMILES Fc1ccc(OCc2cn3cc(cnc3n2)-c2ccncc2Cl)cc1
Show InChI InChI=1S/C18H12ClFN4O/c19-17-8-21-6-5-16(17)12-7-22-18-23-14(10-24(18)9-12)11-25-15-3-1-13(20)2-4-15/h1-10H,11H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292195
PNG
(US10100057, Example 50 | US11046702, Example 50 | ...)
Show SMILES Cc1cccc(C)c1-c1cnc2nc(COc3ccc(F)cc3)cn2c1
Show InChI InChI=1S/C21H18FN3O/c1-14-4-3-5-15(2)20(14)16-10-23-21-24-18(12-25(21)11-16)13-26-19-8-6-17(22)7-9-19/h3-12H,13H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 750n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292196
PNG
(US10100057, Example 51 | US11046702, Example 51 | ...)
Show SMILES Fc1ccc(OCc2cn3cc(cnc3n2)-c2ccc(F)nc2)cc1
Show InChI InChI=1S/C18H12F2N4O/c19-14-2-4-16(5-3-14)25-11-15-10-24-9-13(8-22-18(24)23-15)12-1-6-17(20)21-7-12/h1-10H,11H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292197
PNG
(US10100057, Example 52 | US11046702, Example 52 | ...)
Show SMILES Oc1ccc(OCc2cn3cc(cnc3n2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C19H14FN3O2/c20-15-3-1-13(2-4-15)14-9-21-19-22-16(11-23(19)10-14)12-25-18-7-5-17(24)6-8-18/h1-11,24H,12H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM292198
PNG
(US10100057, Example 53 | US11046702, Example 53 | ...)
Show SMILES Fc1ccc(OCc2cn3cc(cnc3n2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C19H13F2N3O/c20-15-3-1-13(2-4-15)14-9-22-19-23-17(11-24(19)10-14)12-25-18-7-5-16(21)6-8-18/h1-11H,12H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 300n/an/an/a25



SK BIOPHARMACEUTICALS CO., LTD.

US Patent


Assay Description
Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...


US Patent US10100057 (2018)


BindingDB Entry DOI: 10.7270/Q2028TKW
More data for this
Ligand-Target Pair
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