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BDBM50261954 9-(2-Hydroxy-4-methyl-6-oxocyclohexyl)-3-methyl-2,3,4,9-tetrahydro-1H-xanthen-1-one::CHEMBL468414

SMILES: CC1CC(=O)C(C2C3=C(CC(C)CC3=O)Oc3ccccc23)C(=O)C1

InChI Key: InChIKey=XYVGIADQFVKMPQ-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50261954   
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
Neuropeptide Y receptor type 5 ( NPY Y5)


(Homo sapiens (Human))		BDBM50261954
PNG
(9-(2-Hydroxy-4-methyl-6-oxocyclohexyl)-3-methyl-2,...)
Show SMILES CC1CC(=O)C(C2C3=C(CC(C)CC3=O)Oc3ccccc23)C(=O)C1 |t:7,(10.69,7.19,;10.67,5.66,;9.32,4.91,;9.3,3.37,;7.96,4.14,;10.63,2.59,;10.61,1.05,;9.26,.29,;9.26,-1.26,;7.93,-2.03,;6.59,-1.26,;5.25,-2.02,;6.59,.29,;7.93,1.06,;7.93,2.6,;10.59,-2.04,;11.93,-1.27,;13.26,-2.04,;14.6,-1.27,;14.59,.28,;13.26,1.04,;11.93,.27,;11.97,3.34,;13.29,2.56,;11.99,4.87,)|
Show InChI InChI=1S/C21H22O4/c1-11-7-14(22)20(15(23)8-11)19-13-5-3-4-6-17(13)25-18-10-12(2)9-16(24)21(18)19/h3-6,11-12,19-20H,7-10H2,1-2H3
KEGG

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Similars
Article
PubMed
 193n/an/an/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]PYY from human recombinant neuropeptide Y5 receptor expressed in thymidine kinase deficient human LM cells

J Med Chem 51: 4765-70 (2008)


Article DOI: 10.1021/jm8003587
BindingDB Entry DOI: 10.7270/Q2J96664
More data for this
Ligand-Target Pair