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BDBM50325725 (R)-N-benzyl-1-(3-methoxyphenyl)ethanamine::CHEMBL1224190

SMILES: COc1cccc(c1)[C@@H](C)NCc1ccccc1

InChI Key: InChIKey=AWFLVVVPPDRGCE-CYBMUJFWSA-N

Data: 2 EC50

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 = 50325725   
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
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50325725
PNG
((R)-N-benzyl-1-(3-methoxyphenyl)ethanamine | CHEMB...)
Show SMILES COc1cccc(c1)[C@@H](C)NCc1ccccc1 |r|
Show InChI InChI=1S/C16H19NO/c1-13(15-9-6-10-16(11-15)18-2)17-12-14-7-4-3-5-8-14/h3-11,13,17H,12H2,1-2H3/t13-/m1/s1
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>5.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Positive allosteric modulation of calcium sensing receptor by FLIPR assay in absence of extracellular calcium


Bioorg Med Chem Lett 20: 5544-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.060
BindingDB Entry DOI: 10.7270/Q2Z89CM3
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50325725
PNG
((R)-N-benzyl-1-(3-methoxyphenyl)ethanamine | CHEMB...)
Show SMILES COc1cccc(c1)[C@@H](C)NCc1ccccc1 |r|
Show InChI InChI=1S/C16H19NO/c1-13(15-9-6-10-16(11-15)18-2)17-12-14-7-4-3-5-8-14/h3-11,13,17H,12H2,1-2H3/t13-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.20E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Positive allosteric modulation of calcium sensing receptor by FLIPR assay in presence of extracellular calcium


Bioorg Med Chem Lett 20: 5544-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.060
BindingDB Entry DOI: 10.7270/Q2Z89CM3
More data for this
Ligand-Target Pair