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Compile Data Set for Download or QSAR

Found 9 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 7' and Ligand = 'BDBM50458526'   
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
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
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1.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H] D-lysergic acid diethylamide from 5-HT7R (unknown origin) transfected in HEK293 cells incubated for 1.5 hrs by microbeta scintil...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00110
BindingDB Entry DOI: 10.7270/Q2D50RTX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
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1.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H] D-lysergic acid diethylamide from 5-HT7R (unknown origin) transfected in HEK293 cells incubated for 1.5 hrs by microbeta scintil...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00110
BindingDB Entry DOI: 10.7270/Q2D50RTX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
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2.5n/an/an/an/an/an/an/an/a



Normandie Univ

Curated by ChEMBL


Assay Description
Antagonist activity at 5-HT7 receptor (unknown origin)


Eur J Med Chem 183: (2019)


Article DOI: 10.1016/j.ejmech.2019.111705
BindingDB Entry DOI: 10.7270/Q2377D11
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
PDB

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2.5n/an/an/an/an/an/an/an/a



Universit£ di Catania

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT7 receptor (unknown origin)


J Med Chem 61: 8475-8503 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01898
BindingDB Entry DOI: 10.7270/Q2V98BPM
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
PDB

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2.5n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00633
BindingDB Entry DOI: 10.7270/Q26M3BS8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
PDB

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n/an/an/an/a 21n/an/an/an/a


TBA

Assay Description
Agonist activity at 5-HT7R (unknown origin) transfected in HEK293 cells expressing tTA-dependent luciferase reporter and beta arrestin 2-TEV fusion g...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00110
BindingDB Entry DOI: 10.7270/Q2D50RTX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
PDB

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n/an/an/an/a 21n/an/an/an/a


TBA

Assay Description
Agonist activity at 5-HT7R (unknown origin) transfected in HEK293 cells expressing tTA-dependent luciferase reporter and beta arrestin 2-TEV fusion g...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00110
BindingDB Entry DOI: 10.7270/Q2D50RTX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
PDB

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n/an/an/an/a 83n/an/an/an/a


TBA

Assay Description
Agonist activity at human 5-HT7R transfected in HEK293 cells assessed as Gs-mediated cAMP accumulation incubated for 30 mins by microplate reader ana...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00110
BindingDB Entry DOI: 10.7270/Q2D50RTX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50458526
PNG
(CHEMBL4205349)
Show SMILES CN(C)CCc1cccc(c1)-c1c(C)nn(C)c1C
Show InChI InChI=1S/C16H23N3/c1-12-16(13(2)19(5)17-12)15-8-6-7-14(11-15)9-10-18(3)4/h6-8,11H,9-10H2,1-5H3
PDB

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n/an/an/an/a 83n/an/an/an/a


TBA

Assay Description
Agonist activity at human 5-HT7R transfected in HEK293 cells assessed as Gs-mediated cAMP accumulation incubated for 30 mins by microplate reader ana...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00110
BindingDB Entry DOI: 10.7270/Q2D50RTX
More data for this
Ligand-Target Pair