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BDBM50072656 CHEMBL111879::N-(3-Methoxy-6,7,8,9-tetrahydro-5H-benzocyclohepten-5-ylmethyl)-butyramide

SMILES: CCCC(=O)NCC1CCCCc2ccc(OC)cc12

InChI Key: InChIKey=POVFROAPSBEDQU-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50072656   
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


(Chick)		BDBM50072656
PNG
(CHEMBL111879 | N-(3-Methoxy-6,7,8,9-tetrahydro-5H-...)
Show SMILES CCCC(=O)NCC1CCCCc2ccc(OC)cc12
Show InChI InChI=1S/C17H25NO2/c1-3-6-17(19)18-12-14-8-5-4-7-13-9-10-15(20-2)11-16(13)14/h9-11,14H,3-8,12H2,1-2H3,(H,18,19)
KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 1n/an/an/an/an/an/an/an/a



Université de Paris-Sud

Curated by ChEMBL


Assay Description
Binding affinity measured against Chicken brain melatonin receptor by using 2-[125I]-iodomelatonin as radioligand

Bioorg Med Chem Lett 8: 3325-30 (1999)


BindingDB Entry DOI: 10.7270/Q2R78DD7
More data for this
Ligand-Target Pair