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BDBM50116960 2-[2-(6-Trifluoromethyl-indol-1-yl)-ethyl]-decahydro-pyrido[1,2-a][1,4]diazepine::CHEMBL81276

SMILES: FC(F)(F)c1ccc2ccn(CCN3CCCN4CCCCC4C3)c2c1

InChI Key: InChIKey=NQTQBHKGMLJHTR-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50116960   
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 (5-HT7)


(Homo sapiens (Human))
BDBM50116960
PNG
(2-[2-(6-Trifluoromethyl-indol-1-yl)-ethyl]-decahyd...)
Show SMILES FC(F)(F)c1ccc2ccn(CCN3CCCN4CCCCC4C3)c2c1
Show InChI InChI=1S/C20H26F3N3/c21-20(22,23)17-6-5-16-7-11-26(19(16)14-17)13-12-24-8-3-10-25-9-2-1-4-18(25)15-24/h5-7,11,14,18H,1-4,8-10,12-13,15H2
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PC cid
PC sid
UniChem

Similars

Article
PubMed
7n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 7 receptor


J Med Chem 46: 2795-812 (2003)


Article DOI: 10.1021/jm030030n
BindingDB Entry DOI: 10.7270/Q2M0465F
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 7 (5-HT7)


(Homo sapiens (Human))
BDBM50116960
PNG
(2-[2-(6-Trifluoromethyl-indol-1-yl)-ethyl]-decahyd...)
Show SMILES FC(F)(F)c1ccc2ccn(CCN3CCCN4CCCCC4C3)c2c1
Show InChI InChI=1S/C20H26F3N3/c21-20(22,23)17-6-5-16-7-11-26(19(16)14-17)13-12-24-8-3-10-25-9-2-1-4-18(25)15-24/h5-7,11,14,18H,1-4,8-10,12-13,15H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7n/an/an/an/an/an/an/an/a



NPS Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 7 receptor on HEK293 cells using radioligand [3H]-LSD


Bioorg Med Chem Lett 12: 2451-4 (2002)


Article DOI: 10.1016/s0960-894x(02)00438-9
BindingDB Entry DOI: 10.7270/Q25T3JTZ
More data for this
Ligand-Target Pair