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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM50438799'   
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
Orexin receptor type 2


(Homo sapiens (Human))		BDBM50438799
PNG
(CHEMBL2413515)
Show SMILES Cc1noc(n1)-c1ccccc1CN1CCCC2(CCN(CC2)c2nc(C)cc(C)n2)C1=O
Show InChI InChI=1S/C25H30N6O2/c1-17-15-18(2)27-24(26-17)30-13-10-25(11-14-30)9-6-12-31(23(25)32)16-20-7-4-5-8-21(20)22-28-19(3)29-33-22/h4-5,7-8,15H,6,9-14,16H2,1-3H3
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 7n/an/an/an/an/an/an/an/a



Janssen Research& Development

Curated by ChEMBL


Assay Description
Antagonist activity at human orexin receptor 2 expressed in CHO cells assessed as inhibition of orexin-A-induced calcium flux by FLIPR assay

Bioorg Med Chem Lett 23: 4761-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.06.057
BindingDB Entry DOI: 10.7270/Q25140NJ
More data for this
Ligand-Target Pair