Tan Lab | DSigDB

Gene Set: D4 : CTD - pantoprazole

Collection

D4 : CTD

Chemical Name

pantoprazole ( From PubChem : PANTOPRAZOLE )

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
383.37 g/mol	1	6	3.75	True

Structure

InChI

InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)/t26-/m1/s1

InChIKey

Links

Gene (10 / 21)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	increases(expression)			ABCA1		C064276
CTD	affects(transport)			ABCC2		C064276
CTD	increases(reaction)			ABCC2		C064276
CTD	affects(transport)			ABCG2		C064276
CTD	decreases(reaction)			ABCG2		C064276
CTD	affects(response to substance)			CYP2C19		C064276
CTD	increases(metabolic processing)			CYP2C19		C064276
CTD	decreases(reaction)			CYP2C19		C064276
CTD	increases(hydroxylation)			CYP2C19		C064276
CTD	decreases(activity)			CYP2C19		C064276
CTD	decreases(reaction)			CYP2C9		C064276
CTD	increases(hydroxylation)			CYP2C9		C064276
CTD	increases(metabolic processing)			CYP3A4		C064276
CTD	decreases(reaction)			CYP3A4		C064276
CTD	increases(hydroxylation)			CYP3A4		C064276
CTD	increases(expression)			CYP3A4		C064276
PubChem	AhR Potency (uM)	uM	13.333	AHR	-	GI(Protien) :
PubChem	Potency	uM	25.119	MAPT	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	22.816	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	39.811	VDR	-	GI(Protien) :
ChEMBL	Potency	nM	25118.900	MAPT	-	Target : CHEMBL1293224

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