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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 7' and Ligand = 'BDBM50532904'   
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))
BDBM50532904
PNG
(CHEMBL4557369)
Show SMILES O=C(CCN1CCN(Cc2ccccc2)CC1)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C24H32N4O/c29-24(28-19-17-27(18-20-28)23-9-5-2-6-10-23)11-12-25-13-15-26(16-14-25)21-22-7-3-1-4-8-22/h1-10H,11-21H2
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PC cid
PC sid
UniChem
Article
PubMed
52n/an/an/an/an/an/an/an/a



Universit£ di Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-5-HT from human 5-HT7 receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation spectrometry


Bioorg Med Chem Lett 26: 4052-6 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.080
BindingDB Entry DOI: 10.7270/Q2VM4GS6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50532904
PNG
(CHEMBL4557369)
Show SMILES O=C(CCN1CCN(Cc2ccccc2)CC1)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C24H32N4O/c29-24(28-19-17-27(18-20-28)23-9-5-2-6-10-23)11-12-25-13-15-26(16-14-25)21-22-7-3-1-4-8-22/h1-10H,11-21H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
52n/an/an/an/an/an/an/an/a



Universit£ di Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-5-HT from human 5-HT7 receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation spectrometry


Bioorg Med Chem Lett 26: 4052-6 (2016)


Article DOI: 10.1016/j.bmcl.2016.06.080
BindingDB Entry DOI: 10.7270/Q2VM4GS6
More data for this
Ligand-Target Pair