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Substrate Report for: AZD1979

AZD1979	Type	Not A/B H target
		Azaspiro
		Oxadiazol
		Azetidin
	Other_Name (8)
	Chemical_Nomenclature	[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-[3-[4-(2-oxa-6-azaspiro[3.3]heptan-6-ylmethyl)phenoxy]azetidin-1-yl]methanone
	Formula	C25H26N4O5
	CAS_number	1254035-84-1
	MW	462.5
	Paper	Li_2016_Drug.Metab.Dispos_44_1341
		Toselli_2017_Drug.Metab.Dispos_45_966
		Toselli_2019_J.Med.Chem_62_7383
	Comment	AZD1979 is a melanin concentrating hormone receptor 1 (MCHr1) antagonist designed for the treatment of obesity.. EPHX1 hydration and ring opening of the oxetanyl moiety of AZD1979 and is inhibited by Progabide
	Gene_locus	human-EPHX1
	CID	49801838
	Family	Epoxide_hydrolase
	InChIKey	BKKPIQPFRAPEAY-UHFFFAOYSA-N
	CanonicalSMILES	COC1=CC=C(C=C1)C2=NN=C(O2)C(=O)N3CC(C3)OC4=CC=C(C=C4)CN5CC6(C5)COC6
	InChI	InChI=1S/C25H26N4O5/c1-31-19-8-4-18(5-9-19)22-26-27-23(34-22)24(30)29-11-21(12-29)33-20-6-2-17(3-7-20)10-28-13-25(14-28)15-32-16-25/h2-9,21H,10-16H2,1H3