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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 = 'BDBM50093291'   
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))
BDBM50093291
PNG
(CHEMBL131575 | Cyclopropanecarboxylic acid [2-(4,9...)
Show SMILES COc1ccc2ccc(OC)c3C(CCNC(=O)C4CC4)CCc1c23
Show InChI InChI=1S/C21H25NO3/c1-24-17-9-6-13-7-10-18(25-2)20-14(5-8-16(17)19(13)20)11-12-22-21(23)15-3-4-15/h6-7,9-10,14-15H,3-5,8,11-12H2,1-2H3,(H,22,23)
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PC sid
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Similars

PubMed
1.59n/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