Tan Lab | DSigDB

Gene Set: D4 : CTD - Piperonyl Butoxide

Collection

D4 : CTD

Chemical Name

Piperonyl Butoxide ( From PubChem : PIPERONYL BUTOXIDE )

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
338.439 g/mol	0	5	3.7177	True

Structure

InChI

InChI=1S/C19H30O5/c1-3-5-7-20-8-9-21-10-11-22-14-17-13-19-18(23-15-24-19)12-16(17)6-4-2/h12-13H,3-11,14-15H2,1-2H3

InChIKey

Links

Gene (12 / 19)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	increases(expression)			CYP1A1		D010882
CTD	increases(expression)			CYP1A2		D010882
CTD	affects(cotreatment)			IFNG		D010882
CTD	increases(expression)			IFNG		D010882
CTD	affects(cotreatment)			IL4		D010882
CTD	increases(expression)			IL4		D010882
CTD	decreases(expression)			PDCD4		D010882
CTD	increases(expression)			PDCD4		D010882
CTD	increases(expression)			TNFAIP3		D010882
CTD	decreases(expression)			TPD52		D010882
PubChem	AhR Potency (uM)	uM	20.318	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.690	AHR	-	GI(Protien) :
PubChem	Potency	uM	10.000	ALDH1A1	-	GI(Protien) :
PubChem	Potency	uM	0.501	CYP3A4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	44.668	NR1I2	-	GI(Protien) :
PubChem	Potency	uM	31.623	TSHR	-	GI(Protien) :
ChEMBL	Potency	nM	10000.000	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Potency	nM	501.200	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	31622.800	TSHR	-	Target : CHEMBL1963

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