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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melatonin receptor type 1B' and Ligand = 'BDBM50093277'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM50093277
PNG
(CHEMBL132340 | N-[2-(9-Methoxy-2,3-dihydro-1H-phen...)
Show SMILES COc1ccc2cccc3CCC(CCNC(C)=O)c1c23
Show InChI InChI=1S/C18H21NO2/c1-12(20)19-11-10-15-7-6-13-4-3-5-14-8-9-16(21-2)18(15)17(13)14/h3-5,8-9,15H,6-7,10-11H2,1-2H3,(H,19,20)
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PC cid
PC sid
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Similars

PubMed
0.390n/an/an/an/an/an/an/an/a



Université de Paris-Sud

Curated by ChEMBL


Assay Description
Binding affinity for melatonin receptor type 1B, expressed in HEK-293 cells (2-[125I]-Iodomelatonin is used as radioligand)


J Med Chem 43: 4051-62 (2000)


BindingDB Entry DOI: 10.7270/Q20Z72JX
More data for this
Ligand-Target Pair