Tan Lab | DSigDB

Gene Set: D4 : CTD - Mefloquine

Collection

D4 : CTD

Chemical Name

Mefloquine ( From PubChem : MEFLOQUINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
378.312 g/mol	2	3	4.7767	True

Structure

InChI

InChI=1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2/t12-,15+/m0/s1

InChIKey

Links

Gene (7 / 19)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(export)			ABCC1		D015767
CTD	decreases(reaction)			ABCC1		D015767
CTD	affects(transport)			ABCC1		D015767
CTD	increases(activity)			ABCC1		D015767
CTD	decreases(activity)			ABCC1		D015767
CTD	affects(export)			ABCC4		D015767
CTD	decreases(reaction)			ABCC4		D015767
CTD	increases(activity)			ABCC4		D015767
CTD	decreases(activity)			ABCC4		D015767
CTD	affects(metabolic processing)			CYP3A4		D015767
CTD	decreases(reaction)			CYP3A4		D015767
CTD	decreases(reaction)			KCNH2		D015767
CTD	increases(transport)			KCNH2		D015767
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	7.308	TDP1	-	GI(Protien) :
PubChem	Potency	uM	8.200	TDP1	-	GI(Protien) :
PubChem	Potency	uM	10.000	SMAD3	-	GI(Protien) :
PubChem	Potency	uM	8.912	TDP1	-	GI(Protien) :
PubChem	Potency	uM	12.589	TDP1	-	GI(Protien) :

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