Tan Lab | DSigDB

Gene Set: D4 : CTD - tolcapone

Collection

D4 : CTD

Chemical Name

tolcapone ( From PubChem : TOLCAPONE )

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
273.241 g/mol	2	3	3.0686	True

Structure

InChI

InChI=1S/C14H11NO5/c1-8-2-4-9(5-3-8)13(17)10-6-11(15(19)20)14(18)12(16)7-10/h2-7,16,18H,1H3

InChIKey

Links

Gene (10 / 33)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(activity)			ABCB11		C066340
CTD	decreases(activity)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	decreases(reaction)			COMT		C066340
CTD	increases(abundance)			COMT		C066340
CTD	decreases(abundance)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	decreases(abundance)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	decreases(abundance)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	increases(abundance)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	increases(abundance)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	increases(abundance)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	increases(abundance)			COMT		C066340
CTD	decreases(activity)			COMT		C066340
CTD	increases(abundance)			COMT		C066340
CTD	decreases(reaction)			CYP1A1		C066340
CTD	increases(activity)			CYP1A1		C066340
CTD	decreases(reaction)			CYP1A2		C066340
CTD	increases(activity)			CYP1A2		C066340
CTD	increases(response to substance)			CYP3A4		C066340
CTD	decreases(activity)			KCNH2		C066340
CTD	affects(binding)			SNCA		C066340
CTD	decreases(reaction)			SNCA		C066340
CTD	decreases(glucuronidation)			UGT1A9		C066340
CTD	increases(glucuronidation)			UGT1A9		C066340
PubChem	None	uM		NR1H4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	34.665	NR3C1	-	GI(Protien) :
PubChem	None	uM		NR3C1	-	GI(Protien) :

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