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BDBM50423064 CHEMBL244263

SMILES: CCC(=O)NCCCc1cn2CCCc3cccc1c23

InChI Key: InChIKey=WIWPPVPMBNTTAQ-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50423064   
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 1C


(Xenopus)
BDBM50423064
PNG
(CHEMBL244263)
Show SMILES CCC(=O)NCCCc1cn2CCCc3cccc1c23
Show InChI InChI=1S/C17H22N2O/c1-2-16(20)18-10-4-7-14-12-19-11-5-8-13-6-3-9-15(14)17(13)19/h3,6,9,12H,2,4-5,7-8,10-11H2,1H3,(H,18,20)
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.68E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Eur J Med Chem 42: 1004-13 (2007)

More data for this
Ligand-Target Pair