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SMILES: CCOc1ccccc1N1CCN(CCC(=O)N2CCN(CC2)c2ccccc2)CC1

InChI Key: InChIKey=RPOWRMWFIFOXQA-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50532888   
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 7


(Homo sapiens (Human))
BDBM50532888
PNG
(CHEMBL4457095)
Show SMILES CCOc1ccccc1N1CCN(CCC(=O)N2CCN(CC2)c2ccccc2)CC1
Show InChI InChI=1S/C25H34N4O2/c1-2-31-24-11-7-6-10-23(24)28-16-14-26(15-17-28)13-12-25(30)29-20-18-27(19-21-29)22-8-4-3-5-9-22/h3-11H,2,12-21H2,1H3
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80n/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
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50532888
PNG
(CHEMBL4457095)
Show SMILES CCOc1ccccc1N1CCN(CCC(=O)N2CCN(CC2)c2ccccc2)CC1
Show InChI InChI=1S/C25H34N4O2/c1-2-31-24-11-7-6-10-23(24)28-16-14-26(15-17-28)13-12-25(30)29-20-18-27(19-21-29)22-8-4-3-5-9-22/h3-11H,2,12-21H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
80n/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
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50532888
PNG
(CHEMBL4457095)
Show SMILES CCOc1ccccc1N1CCN(CCC(=O)N2CCN(CC2)c2ccccc2)CC1
Show InChI InChI=1S/C25H34N4O2/c1-2-31-24-11-7-6-10-23(24)28-16-14-26(15-17-28)13-12-25(30)29-20-18-27(19-21-29)22-8-4-3-5-9-22/h3-11H,2,12-21H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
82n/an/an/an/an/an/an/an/a



Universit£ di Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A 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
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50532888
PNG
(CHEMBL4457095)
Show SMILES CCOc1ccccc1N1CCN(CCC(=O)N2CCN(CC2)c2ccccc2)CC1
Show InChI InChI=1S/C25H34N4O2/c1-2-31-24-11-7-6-10-23(24)28-16-14-26(15-17-28)13-12-25(30)29-20-18-27(19-21-29)22-8-4-3-5-9-22/h3-11H,2,12-21H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
82n/an/an/an/an/an/an/an/a



Universit£ di Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A 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
More data for this
Ligand-Target Pair