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BDBM50186308 2-ethyl-8-(3-(piperidin-1-yl)propoxy)-1,2,3,4-tetrahydroisoquinoline::CHEMBL209098

SMILES: CCN1CCc2cccc(OCCCN3CCCCC3)c2C1

InChI Key: InChIKey=KDDRLLCATKACPK-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50186308   
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
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50186308
PNG
(2-ethyl-8-(3-(piperidin-1-yl)propoxy)-1,2,3,4-tetr...)
Show SMILES CCN1CCc2cccc(OCCCN3CCCCC3)c2C1
Show InChI InChI=1S/C19H30N2O/c1-2-20-14-10-17-8-6-9-19(18(17)16-20)22-15-7-13-21-11-4-3-5-12-21/h6,8-9H,2-5,7,10-16H2,1H3
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KEGG

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CHEMBL
PC cid
PC sid
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Similars

Article
PubMed
95n/an/an/an/an/an/an/an/a



BIOPROJET-BIOTECH

Curated by ChEMBL


Assay Description
Binding affinity to histamine H3 receptor (unknown origin)


Bioorg Med Chem 21: 4526-9 (2013)


Article DOI: 10.1016/j.bmc.2013.05.035
BindingDB Entry DOI: 10.7270/Q2J9699Q
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50186308
PNG
(2-ethyl-8-(3-(piperidin-1-yl)propoxy)-1,2,3,4-tetr...)
Show SMILES CCN1CCc2cccc(OCCCN3CCCCC3)c2C1
Show InChI InChI=1S/C19H30N2O/c1-2-20-14-10-17-8-6-9-19(18(17)16-20)22-15-7-13-21-11-4-3-5-12-21/h6,8-9H,2-5,7,10-16H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
95.2n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]N-alpha-methylhistamine from human cloned H3 receptor


Bioorg Med Chem Lett 16: 3415-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.004
BindingDB Entry DOI: 10.7270/Q2WM1D07
More data for this
Ligand-Target Pair