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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 = 'BDBM50125638'   
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))
BDBM50125638
PNG
(1-[4-(6-Methoxy-indan-1-yl)-piperazin-1-yl]-ethano...)
Show SMILES COc1ccc2CCC(N3CCN(CC3)C(C)=O)c2c1
Show InChI InChI=1S/C16H22N2O2/c1-12(19)17-7-9-18(10-8-17)16-6-4-13-3-5-14(20-2)11-15(13)16/h3,5,11,16H,4,6-10H2,1-2H3
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PubMed
n/an/a 44n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro receptor binding at MT2 (Melatonin) receptor.


Bioorg Med Chem Lett 13: 1199-202 (2003)


BindingDB Entry DOI: 10.7270/Q2C24VTB
More data for this
Ligand-Target Pair