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Compile Data Set for Download or QSAR

Found 1 hit of kd for monomerid = 50035179   
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
Melatonin receptor type 1A/1B


(Homo sapiens (Human))
BDBM50035179
PNG
(Agomelatine | CHEMBL10878 | N-[2-(7-Methoxy-naphth...)
Show SMILES COc1ccc2cccc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C15H17NO2/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13/h3-7,10H,8-9H2,1-2H3,(H,16,17)
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Article
PubMed
n/an/an/a 0.100n/an/an/an/an/a



Institut de Chimie Pharmaceutique

Curated by ChEMBL


Assay Description
Binding affinity to melatonin receptor measured on ovine pars tuberalis membrane


J Med Chem 37: 3231-9 (1994)


Article DOI: 10.1021/jm00046a006
BindingDB Entry DOI: 10.7270/Q2S75K1J
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)