Tan Lab | DSigDB

Gene Set: D4 : TTD - AMENTOFLAVONE

Collection

D4 : TTD

Chemical Name

AMENTOFLAVONE ( From PubChem : AMENTOFLAVONE )

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
538.458 g/mol	6	10	5.134	False(1/4)

Structure

InChI

InChI=1S/C30H18O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-12,31-36H

InChIKey

YUSWMAULDXZHPY-UHFFFAOYSA-N

Links

Gene (24 / 36)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			GABRA1		Successful target
TTD	Inhibitor			GABRA2		Research target
TTD	Inhibitor			GABRA3		Research target
TTD	Inhibitor			GABRA5		Clinical trial target
TTD	Inhibitor			GABRB2		Successful target
TTD	Inhibitor			GABRG2		Successful target
TTD	Inhibitor			MCL1		Clinical trial target
TTD	Inhibitor			XDH		Successful target
PubChem	None	uM		ATG4B	-	GI(Protien) :
PubChem	Potency	uM	44.668	FEN1	-	GI(Protien) :
PubChem	Potency	uM	47.755	FEN1	-	GI(Protien) :
PubChem	None	uM		FGF22	-	GI(Protien) :
PubChem	Potency	uM	14.125	HPGD	-	GI(Protien) :
PubChem	Potency	uM	14.125	MAPT	-	GI(Protien) :
PubChem	IC50	uM	1.634	MCL1	-	GI(Protien) :
PubChem	None	uM		MCL1	-	GI(Protien) :
PubChem	None	uM		PAFAH1B2	-	GI(Protien) :
PubChem	None	uM		PAFAH1B3	-	GI(Protien) :
PubChem	None	uM		PAFAH2	-	GI(Protien) :
PubChem	None	uM		PLA2G1B	-	GI(Protien) :
PubChem	None	uM		PLA2G7	-	GI(Protien) :
PubChem	None	uM		PLA2G7	-	GI(Protien) :
PubChem	Potency	uM	17.783	POLH	-	GI(Protien) :
PubChem	Potency	uM	33.808	POLH	-	GI(Protien) :
PubChem	Potency	uM	31.623	POLI	-	GI(Protien) :
PubChem	Potency	uM	79.433	POLK	-	GI(Protien) :
PubChem	None	uM		PPP1CA	-	GI(Protien) :
PubChem	None	uM		PPP1CA	-	GI(Protien) :
PubChem	None	uM		RBBP8	-	GI(Protien) :
PubChem	IC50	uM	8.984	VCP	-	GI(Protien) :
PubChem	None	uM		VCP	-	GI(Protien) :
PubChem	None	uM		VCP	-	GI(Protien) :
ChEMBL	Potency	nM	14125.400	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	14125.400	MAPT	-	Target : CHEMBL1293224
ChEMBL	IC50	nM	1634.070	MCL1	-	Target : CHEMBL4361
ChEMBL	IC50	nM	8984.000	VCP	-	Target : CHEMBL1075145

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