Tan Lab | DSigDB

Gene Set: D4 : CTD - DEET

Collection

D4 : CTD

Chemical Name

DEET ( From PubChem : N,N-DIETHYL-3-METHYLBENZAMIDE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
191.269 g/mol	0	2	2.477	True

Structure

InChI

InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3

InChIKey

Links

Gene (13 / 21)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(activity)			ACHE		D003671
CTD	decreases(activity)			BCHE		D003671
CTD	increases(metabolic processing)			CYP1A2		D003671
CTD	increases(expression)			CYP1A2		D003671
CTD	increases(metabolic processing)			CYP2A6		D003671
CTD	increases(expression)			CYP2A6		D003671
CTD	decreases(reaction)			CYP2B6		D003671
CTD	increases(metabolic processing)			CYP2B6		D003671
CTD	increases(expression)			CYP2B6		D003671
CTD	increases(metabolic processing)			CYP2C19		D003671
CTD	increases(metabolic processing)			CYP2D6		D003671
CTD	increases(metabolic processing)			CYP2E1		D003671
CTD	increases(metabolic processing)			CYP3A4		D003671
CTD	increases(expression)			CYP3A4		D003671
CTD	increases(metabolic processing)			CYP3A5		D003671
PubChem	Potency-Replicate_1	uM	60.509	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	2.660	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.314	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	25.797	ESR1	-	GI(Protien) :
PubChem	Potency	uM	25.119	HPGD	-	GI(Protien) :
ChEMBL	Potency	nM	25118.900	HPGD	-	Target : CHEMBL1293255

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