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BDBM50104827 2-(2-Methoxy-4-phenethyloxy-phenyl)-ethylamine::CHEMBL327128

SMILES: COc1cc(OCCc2ccccc2)ccc1CCN

InChI Key: InChIKey=FGCUUVXZCGWSBT-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50104827   
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 2A


(Rattus norvegicus (rat))
BDBM50104827
PNG
(2-(2-Methoxy-4-phenethyloxy-phenyl)-ethylamine | C...)
Show SMILES COc1cc(OCCc2ccccc2)ccc1CCN
Show InChI InChI=1S/C17H21NO2/c1-19-17-13-16(8-7-15(17)9-11-18)20-12-10-14-5-3-2-4-6-14/h2-8,13H,9-12,18H2,1H3
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PC sid
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PubMed
110n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity against rat 5-hydroxytryptamine 2A receptor using [3H]-DOB as radioligand


J Med Chem 44: 3283-91 (2001)


BindingDB Entry DOI: 10.7270/Q2MW2GFJ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50104827
PNG
(2-(2-Methoxy-4-phenethyloxy-phenyl)-ethylamine | C...)
Show SMILES COc1cc(OCCc2ccccc2)ccc1CCN
Show InChI InChI=1S/C17H21NO2/c1-19-17-13-16(8-7-15(17)9-11-18)20-12-10-14-5-3-2-4-6-14/h2-8,13H,9-12,18H2,1H3
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
172n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity against rat 5-hydroxytryptamine 2A receptor using [3H]-Ketanserin as radioligand


J Med Chem 44: 3283-91 (2001)


BindingDB Entry DOI: 10.7270/Q2MW2GFJ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Rattus norvegicus (Rat))
BDBM50104827
PNG
(2-(2-Methoxy-4-phenethyloxy-phenyl)-ethylamine | C...)
Show SMILES COc1cc(OCCc2ccccc2)ccc1CCN
Show InChI InChI=1S/C17H21NO2/c1-19-17-13-16(8-7-15(17)9-11-18)20-12-10-14-5-3-2-4-6-14/h2-8,13H,9-12,18H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
810n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity against rat 5-hydroxytryptamine 2C receptor using [3H]-mesulergine as radioligand


J Med Chem 44: 3283-91 (2001)


BindingDB Entry DOI: 10.7270/Q2MW2GFJ
More data for this
Ligand-Target Pair