Tan Lab | DSigDB

Gene Set: D4 : CTD - Allethrin

Collection

D4 : CTD

Chemical Name

Allethrin ( From PubChem : ALLETHRIN )

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
302.408 g/mol	0	3	4.002	True

Structure

InChI

InChI=1S/C19H26O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h7,9,14,16-17H,1,8,10H2,2-6H3/t14-,16-,17+/m1/s1

InChIKey

ZCVAOQKBXKSDMS-OIISXLGYSA-N

Links

Gene (25 / 39)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	increases(expression)			BAX		D000487
CTD	decreases(expression)			BCL2		D000487
CTD	increases(activity)			CASP3		D000487
CTD	increases(metabolic processing)			CES1		C018465
CTD	increases(expression)			CYP3A4		C018465
CTD	increases(metabolic processing)			CYP3A4		C018465
CTD	affects(expression)			IFNG		C018465
CTD	affects(cotreatment)			IFNG		C018465
CTD	increases(expression)			IFNG		C018465
CTD	increases(expression)			IL1B		D000487
CTD	affects(expression)			IL4		C018465
CTD	affects(cotreatment)			IL4		C018465
CTD	increases(expression)			IL4		C018465
CTD	increases(expression)			MMP9		D000487
CTD	increases(activity)			MTF1		D000487
CTD	increases(activity)			MYC		D000487
CTD	increases(activity)			NR1I2		C018465
CTD	increases(activity)			PPARG		D000487
CTD	increases(activity)			RARA		D000487
CTD	increases(activity)			SP1		D000487
CTD	increases(expression)			TNF		D000487
CTD	increases(expression)			WNT10B		D000487
PubChem	Potency-Replicate_1	uM	18.268	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	18.268	CYP19A1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	36.449	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	43.679	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	57.098	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	58.265	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	48.092	HSPB1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	12.589	NR1I2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	39.811	NR1I2	-	GI(Protien) :
PubChem	Potency	uM	24.337	TDP1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	48.558	AR	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	46.730	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	54.483	ESR1	-	GI(Protien) :
PubChem	Potency	uM	61.131	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	19.953	NR1I2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	48.966	NR3C1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.872	PPARD	-	GI(Protien) :

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