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SMILES: COc1ccc2ccn(CCn3cc(NC(=O)c4ncoc4-c4cccc(C)c4)cn3)c2c1

InChI Key: InChIKey=QSGDIIDNYHCWCV-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 221408   
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
Orexin receptor type 2


(Homo sapiens (Human))		BDBM221408
PNG
(US9303023, 105)
Show SMILES COc1ccc2ccn(CCn3cc(NC(=O)c4ncoc4-c4cccc(C)c4)cn3)c2c1
Show InChI InChI=1S/C25H23N5O3/c1-17-4-3-5-19(12-17)24-23(26-16-33-24)25(31)28-20-14-27-30(15-20)11-10-29-9-8-18-6-7-21(32-2)13-22(18)29/h3-9,12-16H,10-11H2,1-2H3,(H,28,31)
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US Patent
n/an/a 9n/an/an/an/an/a37



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
Chinese hamster ovary (CHO) cells expressing the human orexin-1 receptor and the human orexin-2 receptor, respectively, are grown in culture medium (...

US Patent US9303023 (2016)


BindingDB Entry DOI: 10.7270/Q2251H10
More data for this
Ligand-Target Pair