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Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50464408   
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))
BDBM50464408
PNG
(CHEMBL4285145)
Show SMILES COC(=O)NCC1CCc2ccc3ccc(OC)cc3c12
Show InChI InChI=1S/C17H19NO3/c1-20-14-8-7-11-3-4-12-5-6-13(10-18-17(19)21-2)16(12)15(11)9-14/h3-4,7-9,13H,5-6,10H2,1-2H3,(H,18,19)
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0.400n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT2 receptor expressed in CHO cell membranes after 120 mins by filter binding method


Eur J Med Chem 141: 552-566 (2017)


Article DOI: 10.1016/j.ejmech.2017.10.025
BindingDB Entry DOI: 10.7270/Q2CC13BX
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM50464408
PNG
(CHEMBL4285145)
Show SMILES COC(=O)NCC1CCc2ccc3ccc(OC)cc3c12
Show InChI InChI=1S/C17H19NO3/c1-20-14-8-7-11-3-4-12-5-6-13(10-18-17(19)21-2)16(12)15(11)9-14/h3-4,7-9,13H,5-6,10H2,1-2H3,(H,18,19)
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2n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in CHO cell membranes after 120 mins by filter binding method


Eur J Med Chem 141: 552-566 (2017)


Article DOI: 10.1016/j.ejmech.2017.10.025
BindingDB Entry DOI: 10.7270/Q2CC13BX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50464408
PNG
(CHEMBL4285145)
Show SMILES COC(=O)NCC1CCc2ccc3ccc(OC)cc3c12
Show InChI InChI=1S/C17H19NO3/c1-20-14-8-7-11-3-4-12-5-6-13(10-18-17(19)21-2)16(12)15(11)9-14/h3-4,7-9,13H,5-6,10H2,1-2H3,(H,18,19)
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Article
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100n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-mesulergine from human 5-HT2C receptor expressed in CHO cell membranes after 60 mins by TopCount scintillation counting method


Eur J Med Chem 141: 552-566 (2017)


Article DOI: 10.1016/j.ejmech.2017.10.025
BindingDB Entry DOI: 10.7270/Q2CC13BX
More data for this
Ligand-Target Pair