Tan Lab | DSigDB

Gene Set: D4 : CTD - Selegiline

Collection

D4 : CTD

Chemical Name

Selegiline ( From PubChem : SELEGILINE )

FDA	NPC	WHO	Indian	Australia	China	Traditional Herbal	Clinical Trail
Approved	Not	Not	Not	Not	Not	Not	Not

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
187.281 g/mol	0	1	2.1826	True

Structure

InChI

InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1

InChIKey

MEZLKOACVSPNER-GFCCVEGCSA-N

Links

Gene (19 / 46)

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Source	Type	Unit	Gene	PMID	Other
CTD	affects(localization)		AIFM1		D012642
CTD	decreases(reaction)		AIFM1		D012642
CTD	decreases(reaction)		CASP3		D012642
CTD	increases(expression)		CASP3		D012642
CTD	decreases(reaction)		CASP3		D012642
CTD	increases(expression)		CASP3		D012642
CTD	affects(metabolic processing)		CYP1A2		D012642
CTD	decreases(reaction)		FOS		D012642
CTD	increases(expression)		FOS		D012642
CTD	decreases(reaction)		GAPDH		D012642
CTD	increases(expression)		GAPDH		D012642
CTD	decreases(reaction)		JUN		D012642
CTD	increases(expression)		JUN		D012642
CTD	increases(expression)		JUN		D012642
CTD	affects(binding)		MAOB		D012642
CTD	decreases(activity)		MAOB		D012642
CTD	decreases(reaction)		MAPK1		D012642
CTD	increases(phosphorylation)		MAPK1		D012642
CTD	decreases(reaction)		MAPK3		D012642
CTD	increases(phosphorylation)		MAPK3		D012642
CTD	affects(reaction)		MYC		D012642
CTD	increases(expression)		MYC		D012642
CTD	increases(phosphorylation)		MYC		D012642
CTD	decreases(reaction)		PARK2		D012642
CTD	increases(expression)		PARK2		D012642
CTD	decreases(reaction)		SLC22A2		D012642
CTD	increases(uptake)		SLC22A2		D012642
CTD	decreases(reaction)		SNCA		D012642
CTD	increases(expression)		SNCA		D012642
CTD	decreases(reaction)		SNCA		D012642
CTD	increases(expression)		SNCA		D012642
CTD	decreases(reaction)		TXN		D012642
CTD	increases(expression)		TXN		D012642
CTD	affects(response to substance)		TXN		D012642
CTD	affects(reaction)		TXN		D012642
PubChem	None	uM	CYP1A2	-	GI(Protien) :
PubChem	None	uM	CYP1A2	-	GI(Protien) :
ChEMBL	Inhibition	-	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Inhibition	-	CYP2C9	-	Target : CHEMBL3397
ChEMBL	Inhibition	-	CYP2D6	-	Target : CHEMBL289
ChEMBL	Inhibition	-	CYP3A4	-	Target : CHEMBL340
ChEMBL	Inhibition	-	MAOA	-	Target : CHEMBL1951
ChEMBL	Inhibition	-	MAOA	-	Target : CHEMBL1951
ChEMBL	Inhibition	-	MAOB	-	Target : CHEMBL2039
ChEMBL	Inhibition	-	MAOB	-	Target : CHEMBL2039
ChEMBL	Inhibition	-	MAOB	-	Target : CHEMBL2039

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