Tan Lab | DSigDB

Gene Set: D4 : CTD - Propafenone

Collection

D4 : CTD

Chemical Name

Propafenone ( From PubChem : PROPAFENONE )

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
341.444 g/mol	2	4	3.6323	True

Structure

InChI

InChI=1S/C21H27NO3/c1-2-14-22-15-18(23)16-25-21-11-7-6-10-19(21)20(24)13-12-17-8-4-3-5-9-17/h3-11,18,22-23H,2,12-16H2,1H3/t18-/m1/s1

InChIKey

Links

Gene (13 / 29)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(binding)			ADRB1		D011405
CTD	decreases(activity)			ADRB1		D011405
CTD	affects(binding)			ADRB2		D011405
CTD	decreases(activity)			ADRB2		D011405
CTD	increases(activity)			CASP3		D011405
CTD	increases(activity)			CASP7		D011405
CTD	affects(response to substance)			CYP2D6		D011405
CTD	affects(activity)			KCNH2		D011405
CTD	affects(binding)			KCNH2		D011405
CTD	decreases(activity)			KCNH2		D011405
CTD	decreases(reaction)			KCNH2		D011405
CTD	increases(transport)			KCNH2		D011405
CTD	decreases(activity)			KCNH2		D011405
CTD	decreases(reaction)			KCNK18		D011405
CTD	increases(transport)			KCNK18		D011405
CTD	decreases(reaction)			SLC22A1		D011405
CTD	increases(uptake)			SLC22A1		D011405
CTD	decreases(reaction)			SLC22A3		D011405
CTD	increases(uptake)			SLC22A3		D011405
CTD	decreases(reaction)			SLC22A4		D011405
CTD	increases(uptake)			SLC22A4		D011405
PubChem	Potency	uM	10.000	DRD1	-	GI(Protien) :
PubChem	Potency	uM	16.482	MTOR	-	GI(Protien) :
PubChem	Potency	uM	4.598	TDP1	-	GI(Protien) :
PubChem	Potency	uM	9.175	TDP1	-	GI(Protien) :
PubChem	Potency	uM	11.886	TDP1	-	GI(Protien) :
PubChem	Potency	uM	14.963	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	10000.000	DRD1	-	Target : CHEMBL2056
ChEMBL	Potency	nM	16481.600	MTOR	-	Target : CHEMBL2842

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