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Compile Data Set for Download or QSAR

Found 74 hits of ic50 for UniProtKB: P28223   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544628
PNG
(CHEMBL4638006)
Show SMILES COc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C22H26FNO3/c1-26-20-5-3-4-19(22(20)27-2)21(25)17-11-14-24(15-12-17)13-10-16-6-8-18(23)9-7-16/h3-9,17H,10-15H2,1-2H3
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n/an/a 5.40n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544628
PNG
(CHEMBL4638006)
Show SMILES COc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C22H26FNO3/c1-26-20-5-3-4-19(22(20)27-2)21(25)17-11-14-24(15-12-17)13-10-16-6-8-18(23)9-7-16/h3-9,17H,10-15H2,1-2H3
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n/an/a 5.5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544628
PNG
(CHEMBL4638006)
Show SMILES COc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C22H26FNO3/c1-26-20-5-3-4-19(22(20)27-2)21(25)17-11-14-24(15-12-17)13-10-16-6-8-18(23)9-7-16/h3-9,17H,10-15H2,1-2H3
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n/an/a 6.20n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544628
PNG
(CHEMBL4638006)
Show SMILES COc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C22H26FNO3/c1-26-20-5-3-4-19(22(20)27-2)21(25)17-11-14-24(15-12-17)13-10-16-6-8-18(23)9-7-16/h3-9,17H,10-15H2,1-2H3
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n/an/a 6.20n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50267632
PNG
(4-(3-Hydroxy-2-methoxy-benzoyl)-1-(2-p-fluoropheny...)
Show SMILES COc1c(O)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C21H24FNO3/c1-26-21-18(3-2-4-19(21)24)20(25)16-10-13-23(14-11-16)12-9-15-5-7-17(22)8-6-15/h2-8,16,24H,9-14H2,1H3
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n/an/a 9.10n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50267632
PNG
(4-(3-Hydroxy-2-methoxy-benzoyl)-1-(2-p-fluoropheny...)
Show SMILES COc1c(O)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C21H24FNO3/c1-26-21-18(3-2-4-19(21)24)20(25)16-10-13-23(14-11-16)12-9-15-5-7-17(22)8-6-15/h2-8,16,24H,9-14H2,1H3
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n/an/a 9.20n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544627
PNG
(CHEMBL4636980)
Show SMILES COCCOc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C24H30FNO4/c1-28-16-17-30-22-5-3-4-21(24(22)29-2)23(27)19-11-14-26(15-12-19)13-10-18-6-8-20(25)9-7-18/h3-9,19H,10-17H2,1-2H3
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n/an/a 16n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544627
PNG
(CHEMBL4636980)
Show SMILES COCCOc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C24H30FNO4/c1-28-16-17-30-22-5-3-4-21(24(22)29-2)23(27)19-11-14-26(15-12-19)13-10-18-6-8-20(25)9-7-18/h3-9,19H,10-17H2,1-2H3
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n/an/a 16n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50267632
PNG
(4-(3-Hydroxy-2-methoxy-benzoyl)-1-(2-p-fluoropheny...)
Show SMILES COc1c(O)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C21H24FNO3/c1-26-21-18(3-2-4-19(21)24)20(25)16-10-13-23(14-11-16)12-9-15-5-7-17(22)8-6-15/h2-8,16,24H,9-14H2,1H3
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n/an/a 22n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50267632
PNG
(4-(3-Hydroxy-2-methoxy-benzoyl)-1-(2-p-fluoropheny...)
Show SMILES COc1c(O)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C21H24FNO3/c1-26-21-18(3-2-4-19(21)24)20(25)16-10-13-23(14-11-16)12-9-15-5-7-17(22)8-6-15/h2-8,16,24H,9-14H2,1H3
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n/an/a 22n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50267632
PNG
(4-(3-Hydroxy-2-methoxy-benzoyl)-1-(2-p-fluoropheny...)
Show SMILES COc1c(O)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C21H24FNO3/c1-26-21-18(3-2-4-19(21)24)20(25)16-10-13-23(14-11-16)12-9-15-5-7-17(22)8-6-15/h2-8,16,24H,9-14H2,1H3
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n/an/a 23n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50267632
PNG
(4-(3-Hydroxy-2-methoxy-benzoyl)-1-(2-p-fluoropheny...)
Show SMILES COc1c(O)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C21H24FNO3/c1-26-21-18(3-2-4-19(21)24)20(25)16-10-13-23(14-11-16)12-9-15-5-7-17(22)8-6-15/h2-8,16,24H,9-14H2,1H3
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n/an/a 23n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544627
PNG
(CHEMBL4636980)
Show SMILES COCCOc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C24H30FNO4/c1-28-16-17-30-22-5-3-4-21(24(22)29-2)23(27)19-11-14-26(15-12-19)13-10-18-6-8-20(25)9-7-18/h3-9,19H,10-17H2,1-2H3
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n/an/a 23n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544627
PNG
(CHEMBL4636980)
Show SMILES COCCOc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C24H30FNO4/c1-28-16-17-30-22-5-3-4-21(24(22)29-2)23(27)19-11-14-26(15-12-19)13-10-18-6-8-20(25)9-7-18/h3-9,19H,10-17H2,1-2H3
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n/an/a 23n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544628
PNG
(CHEMBL4638006)
Show SMILES COc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C22H26FNO3/c1-26-20-5-3-4-19(22(20)27-2)21(25)17-11-14-24(15-12-17)13-10-16-6-8-18(23)9-7-16/h3-9,17H,10-15H2,1-2H3
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n/an/a 24n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544628
PNG
(CHEMBL4638006)
Show SMILES COc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C22H26FNO3/c1-26-20-5-3-4-19(22(20)27-2)21(25)17-11-14-24(15-12-17)13-10-16-6-8-18(23)9-7-16/h3-9,17H,10-15H2,1-2H3
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n/an/a 24n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544627
PNG
(CHEMBL4636980)
Show SMILES COCCOc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C24H30FNO4/c1-28-16-17-30-22-5-3-4-21(24(22)29-2)23(27)19-11-14-26(15-12-19)13-10-18-6-8-20(25)9-7-18/h3-9,19H,10-17H2,1-2H3
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n/an/a 29n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544627
PNG
(CHEMBL4636980)
Show SMILES COCCOc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
Show InChI InChI=1S/C24H30FNO4/c1-28-16-17-30-22-5-3-4-21(24(22)29-2)23(27)19-11-14-26(15-12-19)13-10-18-6-8-20(25)9-7-18/h3-9,19H,10-17H2,1-2H3
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n/an/a 29n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544630
PNG
(CHEMBL4641860)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C62H85ClFN5O13/c1-71-61-55(60(70)52-16-22-67(23-17-52)21-15-48-7-11-53(64)12-8-48)3-2-4-57(61)82-46-44-80-42-40-78-38-36-76-34-32-74-30-28-72-27-29-73-31-33-75-35-37-77-39-41-79-43-45-81-54-13-9-50(10-14-54)51-18-24-68(25-19-51)56-20-26-69-58(47-49-5-6-49)65-66-62(69)59(56)63/h2-4,7-14,20,26,49,51-52H,5-6,15-19,21-25,27-47H2,1H3
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n/an/a 138n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544630
PNG
(CHEMBL4641860)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C62H85ClFN5O13/c1-71-61-55(60(70)52-16-22-67(23-17-52)21-15-48-7-11-53(64)12-8-48)3-2-4-57(61)82-46-44-80-42-40-78-38-36-76-34-32-74-30-28-72-27-29-73-31-33-75-35-37-77-39-41-79-43-45-81-54-13-9-50(10-14-54)51-18-24-68(25-19-51)56-20-26-69-58(47-49-5-6-49)65-66-62(69)59(56)63/h2-4,7-14,20,26,49,51-52H,5-6,15-19,21-25,27-47H2,1H3
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n/an/a 140n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544631
PNG
(CHEMBL4645193)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C58H77ClFN5O11/c1-67-57-51(56(66)48-16-22-63(23-17-48)21-15-44-7-11-49(60)12-8-44)3-2-4-53(57)76-42-40-74-38-36-72-34-32-70-30-28-68-27-29-69-31-33-71-35-37-73-39-41-75-50-13-9-46(10-14-50)47-18-24-64(25-19-47)52-20-26-65-54(43-45-5-6-45)61-62-58(65)55(52)59/h2-4,7-14,20,26,45,47-48H,5-6,15-19,21-25,27-43H2,1H3
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n/an/a 269n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544631
PNG
(CHEMBL4645193)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C58H77ClFN5O11/c1-67-57-51(56(66)48-16-22-63(23-17-48)21-15-44-7-11-49(60)12-8-44)3-2-4-53(57)76-42-40-74-38-36-72-34-32-70-30-28-68-27-29-69-31-33-71-35-37-73-39-41-75-50-13-9-46(10-14-50)47-18-24-64(25-19-47)52-20-26-65-54(43-45-5-6-45)61-62-58(65)55(52)59/h2-4,7-14,20,26,45,47-48H,5-6,15-19,21-25,27-43H2,1H3
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n/an/a 270n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544630
PNG
(CHEMBL4641860)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C62H85ClFN5O13/c1-71-61-55(60(70)52-16-22-67(23-17-52)21-15-48-7-11-53(64)12-8-48)3-2-4-57(61)82-46-44-80-42-40-78-38-36-76-34-32-74-30-28-72-27-29-73-31-33-75-35-37-77-39-41-79-43-45-81-54-13-9-50(10-14-54)51-18-24-68(25-19-51)56-20-26-69-58(47-49-5-6-49)65-66-62(69)59(56)63/h2-4,7-14,20,26,49,51-52H,5-6,15-19,21-25,27-47H2,1H3
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n/an/a 300n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544630
PNG
(CHEMBL4641860)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C62H85ClFN5O13/c1-71-61-55(60(70)52-16-22-67(23-17-52)21-15-48-7-11-53(64)12-8-48)3-2-4-57(61)82-46-44-80-42-40-78-38-36-76-34-32-74-30-28-72-27-29-73-31-33-75-35-37-77-39-41-79-43-45-81-54-13-9-50(10-14-54)51-18-24-68(25-19-51)56-20-26-69-58(47-49-5-6-49)65-66-62(69)59(56)63/h2-4,7-14,20,26,49,51-52H,5-6,15-19,21-25,27-47H2,1H3
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n/an/a 309n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544629
PNG
(CHEMBL4635960)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C66H93ClFN5O15/c1-75-65-59(64(74)56-16-22-71(23-17-56)21-15-52-7-11-57(68)12-8-52)3-2-4-61(65)88-50-48-86-46-44-84-42-40-82-38-36-80-34-32-78-30-28-76-27-29-77-31-33-79-35-37-81-39-41-83-43-45-85-47-49-87-58-13-9-54(10-14-58)55-18-24-72(25-19-55)60-20-26-73-62(51-53-5-6-53)69-70-66(73)63(60)67/h2-4,7-14,20,26,53,55-56H,5-6,15-19,21-25,27-51H2,1H3
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n/an/a 380n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544629
PNG
(CHEMBL4635960)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C66H93ClFN5O15/c1-75-65-59(64(74)56-16-22-71(23-17-56)21-15-52-7-11-57(68)12-8-52)3-2-4-61(65)88-50-48-86-46-44-84-42-40-82-38-36-80-34-32-78-30-28-76-27-29-77-31-33-79-35-37-81-39-41-83-43-45-85-47-49-87-58-13-9-54(10-14-58)55-18-24-72(25-19-55)60-20-26-73-62(51-53-5-6-53)69-70-66(73)63(60)67/h2-4,7-14,20,26,53,55-56H,5-6,15-19,21-25,27-51H2,1H3
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n/an/a 380n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544617
PNG
(CHEMBL4638687)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C54H69ClFN5O9/c1-63-53-47(52(62)44-16-22-59(23-17-44)21-15-40-7-11-45(56)12-8-40)3-2-4-49(53)70-38-36-68-34-32-66-30-28-64-27-29-65-31-33-67-35-37-69-46-13-9-42(10-14-46)43-18-24-60(25-19-43)48-20-26-61-50(39-41-5-6-41)57-58-54(61)51(48)55/h2-4,7-14,20,26,41,43-44H,5-6,15-19,21-25,27-39H2,1H3
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n/an/a 420n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544617
PNG
(CHEMBL4638687)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C54H69ClFN5O9/c1-63-53-47(52(62)44-16-22-59(23-17-44)21-15-40-7-11-45(56)12-8-40)3-2-4-49(53)70-38-36-68-34-32-66-30-28-64-27-29-65-31-33-67-35-37-69-46-13-9-42(10-14-46)43-18-24-60(25-19-43)48-20-26-61-50(39-41-5-6-41)57-58-54(61)51(48)55/h2-4,7-14,20,26,41,43-44H,5-6,15-19,21-25,27-39H2,1H3
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n/an/a 427n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544631
PNG
(CHEMBL4645193)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C58H77ClFN5O11/c1-67-57-51(56(66)48-16-22-63(23-17-48)21-15-44-7-11-49(60)12-8-44)3-2-4-53(57)76-42-40-74-38-36-72-34-32-70-30-28-68-27-29-69-31-33-71-35-37-73-39-41-75-50-13-9-46(10-14-50)47-18-24-64(25-19-47)52-20-26-65-54(43-45-5-6-45)61-62-58(65)55(52)59/h2-4,7-14,20,26,45,47-48H,5-6,15-19,21-25,27-43H2,1H3
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n/an/a 470n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544631
PNG
(CHEMBL4645193)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C58H77ClFN5O11/c1-67-57-51(56(66)48-16-22-63(23-17-48)21-15-44-7-11-49(60)12-8-44)3-2-4-53(57)76-42-40-74-38-36-72-34-32-70-30-28-68-27-29-69-31-33-71-35-37-73-39-41-75-50-13-9-46(10-14-50)47-18-24-64(25-19-47)52-20-26-65-54(43-45-5-6-45)61-62-58(65)55(52)59/h2-4,7-14,20,26,45,47-48H,5-6,15-19,21-25,27-43H2,1H3
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n/an/a 479n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544617
PNG
(CHEMBL4638687)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C54H69ClFN5O9/c1-63-53-47(52(62)44-16-22-59(23-17-44)21-15-40-7-11-45(56)12-8-40)3-2-4-49(53)70-38-36-68-34-32-66-30-28-64-27-29-65-31-33-67-35-37-69-46-13-9-42(10-14-46)43-18-24-60(25-19-43)48-20-26-61-50(39-41-5-6-41)57-58-54(61)51(48)55/h2-4,7-14,20,26,41,43-44H,5-6,15-19,21-25,27-39H2,1H3
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n/an/a 510n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544617
PNG
(CHEMBL4638687)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C54H69ClFN5O9/c1-63-53-47(52(62)44-16-22-59(23-17-44)21-15-40-7-11-45(56)12-8-40)3-2-4-49(53)70-38-36-68-34-32-66-30-28-64-27-29-65-31-33-67-35-37-69-46-13-9-42(10-14-46)43-18-24-60(25-19-43)48-20-26-61-50(39-41-5-6-41)57-58-54(61)51(48)55/h2-4,7-14,20,26,41,43-44H,5-6,15-19,21-25,27-39H2,1H3
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n/an/a 513n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544631
PNG
(CHEMBL4645193)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C58H77ClFN5O11/c1-67-57-51(56(66)48-16-22-63(23-17-48)21-15-44-7-11-49(60)12-8-44)3-2-4-53(57)76-42-40-74-38-36-72-34-32-70-30-28-68-27-29-69-31-33-71-35-37-73-39-41-75-50-13-9-46(10-14-50)47-18-24-64(25-19-47)52-20-26-65-54(43-45-5-6-45)61-62-58(65)55(52)59/h2-4,7-14,20,26,45,47-48H,5-6,15-19,21-25,27-43H2,1H3
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n/an/a 660n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544631
PNG
(CHEMBL4645193)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C58H77ClFN5O11/c1-67-57-51(56(66)48-16-22-63(23-17-48)21-15-44-7-11-49(60)12-8-44)3-2-4-53(57)76-42-40-74-38-36-72-34-32-70-30-28-68-27-29-69-31-33-71-35-37-73-39-41-75-50-13-9-46(10-14-50)47-18-24-64(25-19-47)52-20-26-65-54(43-45-5-6-45)61-62-58(65)55(52)59/h2-4,7-14,20,26,45,47-48H,5-6,15-19,21-25,27-43H2,1H3
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n/an/a 661n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544629
PNG
(CHEMBL4635960)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C66H93ClFN5O15/c1-75-65-59(64(74)56-16-22-71(23-17-56)21-15-52-7-11-57(68)12-8-52)3-2-4-61(65)88-50-48-86-46-44-84-42-40-82-38-36-80-34-32-78-30-28-76-27-29-77-31-33-79-35-37-81-39-41-83-43-45-85-47-49-87-58-13-9-54(10-14-58)55-18-24-72(25-19-55)60-20-26-73-62(51-53-5-6-53)69-70-66(73)63(60)67/h2-4,7-14,20,26,53,55-56H,5-6,15-19,21-25,27-51H2,1H3
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n/an/a 692n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544629
PNG
(CHEMBL4635960)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C66H93ClFN5O15/c1-75-65-59(64(74)56-16-22-71(23-17-56)21-15-52-7-11-57(68)12-8-52)3-2-4-61(65)88-50-48-86-46-44-84-42-40-82-38-36-80-34-32-78-30-28-76-27-29-77-31-33-79-35-37-81-39-41-83-43-45-85-47-49-87-58-13-9-54(10-14-58)55-18-24-72(25-19-55)60-20-26-73-62(51-53-5-6-53)69-70-66(73)63(60)67/h2-4,7-14,20,26,53,55-56H,5-6,15-19,21-25,27-51H2,1H3
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n/an/a 700n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544619
PNG
(CHEMBL4639821)
Show SMILES COc1c(OCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C50H61ClFN5O7/c1-59-49-43(48(58)40-16-22-55(23-17-40)21-15-36-7-11-41(52)12-8-36)3-2-4-45(49)64-34-32-62-30-28-60-27-29-61-31-33-63-42-13-9-38(10-14-42)39-18-24-56(25-19-39)44-20-26-57-46(35-37-5-6-37)53-54-50(57)47(44)51/h2-4,7-14,20,26,37,39-40H,5-6,15-19,21-25,27-35H2,1H3
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n/an/a 800n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544619
PNG
(CHEMBL4639821)
Show SMILES COc1c(OCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C50H61ClFN5O7/c1-59-49-43(48(58)40-16-22-55(23-17-40)21-15-36-7-11-41(52)12-8-36)3-2-4-45(49)64-34-32-62-30-28-60-27-29-61-31-33-63-42-13-9-38(10-14-42)39-18-24-56(25-19-39)44-20-26-57-46(35-37-5-6-37)53-54-50(57)47(44)51/h2-4,7-14,20,26,37,39-40H,5-6,15-19,21-25,27-35H2,1H3
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n/an/a 813n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of 5HT-induced intracellular Ca...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544617
PNG
(CHEMBL4638687)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C54H69ClFN5O9/c1-63-53-47(52(62)44-16-22-59(23-17-44)21-15-40-7-11-45(56)12-8-40)3-2-4-49(53)70-38-36-68-34-32-66-30-28-64-27-29-65-31-33-67-35-37-69-46-13-9-42(10-14-46)43-18-24-60(25-19-43)48-20-26-61-50(39-41-5-6-41)57-58-54(61)51(48)55/h2-4,7-14,20,26,41,43-44H,5-6,15-19,21-25,27-39H2,1H3
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n/an/a 890n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544617
PNG
(CHEMBL4638687)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C54H69ClFN5O9/c1-63-53-47(52(62)44-16-22-59(23-17-44)21-15-40-7-11-45(56)12-8-40)3-2-4-49(53)70-38-36-68-34-32-66-30-28-64-27-29-65-31-33-67-35-37-69-46-13-9-42(10-14-46)43-18-24-60(25-19-43)48-20-26-61-50(39-41-5-6-41)57-58-54(61)51(48)55/h2-4,7-14,20,26,41,43-44H,5-6,15-19,21-25,27-39H2,1H3
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n/an/a 891n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544619
PNG
(CHEMBL4639821)
Show SMILES COc1c(OCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C50H61ClFN5O7/c1-59-49-43(48(58)40-16-22-55(23-17-40)21-15-36-7-11-41(52)12-8-36)3-2-4-45(49)64-34-32-62-30-28-60-27-29-61-31-33-63-42-13-9-38(10-14-42)39-18-24-56(25-19-39)44-20-26-57-46(35-37-5-6-37)53-54-50(57)47(44)51/h2-4,7-14,20,26,37,39-40H,5-6,15-19,21-25,27-35H2,1H3
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n/an/a 990n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544619
PNG
(CHEMBL4639821)
Show SMILES COc1c(OCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C50H61ClFN5O7/c1-59-49-43(48(58)40-16-22-55(23-17-40)21-15-36-7-11-41(52)12-8-36)3-2-4-45(49)64-34-32-62-30-28-60-27-29-61-31-33-63-42-13-9-38(10-14-42)39-18-24-56(25-19-39)44-20-26-57-46(35-37-5-6-37)53-54-50(57)47(44)51/h2-4,7-14,20,26,37,39-40H,5-6,15-19,21-25,27-35H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544618
PNG
(CHEMBL4635373)
Show SMILES COc1c(OCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C52H65ClFN5O8/c1-61-51-45(50(60)42-16-22-57(23-17-42)21-15-38-7-11-43(54)12-8-38)3-2-4-47(51)67-36-34-65-32-30-63-28-27-62-29-31-64-33-35-66-44-13-9-40(10-14-44)41-18-24-58(25-19-41)46-20-26-59-48(37-39-5-6-39)55-56-52(59)49(46)53/h2-4,7-14,20,26,39,41-42H,5-6,15-19,21-25,27-37H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544618
PNG
(CHEMBL4635373)
Show SMILES COc1c(OCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C52H65ClFN5O8/c1-61-51-45(50(60)42-16-22-57(23-17-42)21-15-38-7-11-43(54)12-8-38)3-2-4-47(51)67-36-34-65-32-30-63-28-27-62-29-31-64-33-35-66-44-13-9-40(10-14-44)41-18-24-58(25-19-41)46-20-26-59-48(37-39-5-6-39)55-56-52(59)49(46)53/h2-4,7-14,20,26,39,41-42H,5-6,15-19,21-25,27-37H2,1H3
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n/an/a 1.05E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544630
PNG
(CHEMBL4641860)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C62H85ClFN5O13/c1-71-61-55(60(70)52-16-22-67(23-17-52)21-15-48-7-11-53(64)12-8-48)3-2-4-57(61)82-46-44-80-42-40-78-38-36-76-34-32-74-30-28-72-27-29-73-31-33-75-35-37-77-39-41-79-43-45-81-54-13-9-50(10-14-54)51-18-24-68(25-19-51)56-20-26-69-58(47-49-5-6-49)65-66-62(69)59(56)63/h2-4,7-14,20,26,49,51-52H,5-6,15-19,21-25,27-47H2,1H3
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n/an/a 1.18E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544630
PNG
(CHEMBL4641860)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C62H85ClFN5O13/c1-71-61-55(60(70)52-16-22-67(23-17-52)21-15-48-7-11-53(64)12-8-48)3-2-4-57(61)82-46-44-80-42-40-78-38-36-76-34-32-74-30-28-72-27-29-73-31-33-75-35-37-77-39-41-79-43-45-81-54-13-9-50(10-14-54)51-18-24-68(25-19-51)56-20-26-69-58(47-49-5-6-49)65-66-62(69)59(56)63/h2-4,7-14,20,26,49,51-52H,5-6,15-19,21-25,27-47H2,1H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells co-expressing Gqo5 assessed as inhibition of glutamate-induced intracellu...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544619
PNG
(CHEMBL4639821)
Show SMILES COc1c(OCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C50H61ClFN5O7/c1-59-49-43(48(58)40-16-22-55(23-17-40)21-15-36-7-11-41(52)12-8-36)3-2-4-45(49)64-34-32-62-30-28-60-27-29-61-31-33-63-42-13-9-38(10-14-42)39-18-24-56(25-19-39)44-20-26-57-46(35-37-5-6-37)53-54-50(57)47(44)51/h2-4,7-14,20,26,37,39-40H,5-6,15-19,21-25,27-35H2,1H3
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n/an/a 1.55E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544629
PNG
(CHEMBL4635960)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C66H93ClFN5O15/c1-75-65-59(64(74)56-16-22-71(23-17-56)21-15-52-7-11-57(68)12-8-52)3-2-4-61(65)88-50-48-86-46-44-84-42-40-82-38-36-80-34-32-78-30-28-76-27-29-77-31-33-79-35-37-81-39-41-83-43-45-85-47-49-87-58-13-9-54(10-14-58)55-18-24-72(25-19-55)60-20-26-73-62(51-53-5-6-53)69-70-66(73)63(60)67/h2-4,7-14,20,26,53,55-56H,5-6,15-19,21-25,27-51H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
Article
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n/an/a 1.59E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544629
PNG
(CHEMBL4635960)
Show SMILES COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C66H93ClFN5O15/c1-75-65-59(64(74)56-16-22-71(23-17-56)21-15-52-7-11-57(68)12-8-52)3-2-4-61(65)88-50-48-86-46-44-84-42-40-82-38-36-80-34-32-78-30-28-76-27-29-77-31-33-79-35-37-81-39-41-83-43-45-85-47-49-87-58-13-9-54(10-14-58)55-18-24-72(25-19-55)60-20-26-73-62(51-53-5-6-53)69-70-66(73)63(60)67/h2-4,7-14,20,26,53,55-56H,5-6,15-19,21-25,27-51H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A/Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50544619
PNG
(CHEMBL4639821)
Show SMILES COc1c(OCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
Show InChI InChI=1S/C50H61ClFN5O7/c1-59-49-43(48(58)40-16-22-55(23-17-40)21-15-36-7-11-41(52)12-8-36)3-2-4-45(49)64-34-32-62-30-28-60-27-29-61-31-33-63-42-13-9-38(10-14-42)39-18-24-56(25-19-39)44-20-26-57-46(35-37-5-6-37)53-54-50(57)47(44)51/h2-4,7-14,20,26,37,39-40H,5-6,15-19,21-25,27-35H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT2A/mGlu2 receptor expressed in HEK293 cells assessed as inhibition of 5HT-induced intracellular Ca2+ mobilization inc...


J Med Chem 63: 9928-9949 (2020)


Article DOI: 10.1021/acs.jmedchem.0c01058
BindingDB Entry DOI: 10.7270/Q2ZC86GW
More data for this
Ligand-Target Pair
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