Tan Lab | DSigDB

Gene Set: D4 : CTD - Hexylresorcinol

Collection

D4 : CTD

Chemical Name

Hexylresorcinol ( From PubChem : 4-HEXYLRESORCINOL )

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
194.27 g/mol	2	2	3.2206	True

Structure

InChI

InChI=1S/C12H18O2/c1-2-3-4-5-6-10-7-8-11(13)9-12(10)14/h7-9,13-14H,2-6H2,1H3

InChIKey

WFJIVOKAWHGMBH-UHFFFAOYSA-N

Links

Gene (15 / 35)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(reaction)			AR		D006604
CTD	increases(activity)			AR		D006604
CTD	decreases(activity)			CAT		D006604
CTD	increases(activity)			ESR1		D006604
CTD	increases(activity)			GSR		D006604
CTD	affects(localization)			TGM2		D006604
CTD	decreases(activity)			TGM2		D006604
CTD	increases(response to substance)			TGM2		D006604
PubChem	Potency-Replicate_1	uM	43.641	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	43.780	AR	-	GI(Protien) :
PubChem	AR Potency (uM)	uM	68.799	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	61.131	CYP19A1	-	GI(Protien) :
PubChem	Potency	uM	1.259	CYP3A4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.756	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.710	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	24.337	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	48.978	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	54.941	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	59.324	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM		ESR1	-	GI(Protien) :
PubChem	None	uM		GFER	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	24.337	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	24.411	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	26.601	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	27.642	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	66.824	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	48.966	NR3C1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	11.882	PPARG	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :
PubChem	None	uM		SLC5A7	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	7.308	TDP1	-	GI(Protien) :
PubChem	Potency	uM	25.929	TDP1	-	GI(Protien) :
PubChem	Potency	uM	44.668	USP1	-	GI(Protien) :
ChEMBL	Potency	nM	1258.900	CYP3A4	-	Target : CHEMBL340

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