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BDBM50161050 3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carboxylic acid (4-piperidin-1-yl-phenyl)-amide::CHEMBL368247

SMILES: Cc1onc(c1C(=O)Nc1ccc(cc1)N1CCCCC1)-c1c(Cl)cccc1Cl

InChI Key: InChIKey=CKPKLRKUVZVFRF-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50161050   
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
Ghrelin receptor


(Homo sapiens (Human))		BDBM50161050
PNG
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)
Show SMILES Cc1onc(c1C(=O)Nc1ccc(cc1)N1CCCCC1)-c1c(Cl)cccc1Cl |(-2.43,3.45,;-3.38,2.24,;-4.92,2.33,;-5.45,.89,;-4.27,-.08,;-2.99,.77,;-1.52,.37,;-1.11,-1.12,;-.41,1.46,;1.08,1.07,;1.83,2.43,;3.37,2.44,;4.15,1.11,;3.41,-.23,;1.87,-.24,;5.69,1.12,;6.46,2.47,;7.99,2.47,;8.77,1.16,;8.03,-.21,;6.49,-.21,;-4.18,-1.62,;-5.48,-2.47,;-6.86,-1.77,;-5.39,-4.01,;-4.01,-4.7,;-2.73,-3.87,;-2.8,-2.32,;-1.33,-2.71,)|
Show InChI InChI=1S/C22H21Cl2N3O2/c1-14-19(21(26-29-14)20-17(23)6-5-7-18(20)24)22(28)25-15-8-10-16(11-9-15)27-12-3-2-4-13-27/h5-11H,2-4,12-13H2,1H3,(H,25,28)
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Similars
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of binding to human growth hormone secretagogue receptor

Bioorg Med Chem Lett 15: 1201-4 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD
More data for this
Ligand-Target Pair