Tan Lab | DSigDB

Gene Set: D4 : Boss - 5,6-benzoflavone

Collection

D4 : Boss

Chemical Name

5,6-benzoflavone ( From PubChem : 5,6-BENZOFLAVONE )

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
272.297 g/mol	0	2	4.6132	True

Structure

InChI

InChI=1S/C19H12O2/c20-16-12-18(14-7-2-1-3-8-14)21-17-11-10-13-6-4-5-9-15(13)19(16)17/h1-12H

InChIKey

Links

Gene (13 / 24)

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Source	Type	Unit	Value	Gene	PMID	Other
BOSS	Text Mining			AHR
BOSS	Text Mining			CYGB
BOSS	Text Mining			CYP2C8
PubChem	Potency-Replicate_1	uM	4.856	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	5.661	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	13.685	CYP19A1	-	GI(Protien) :
PubChem	None	uM		CYP19A1	-	GI(Protien) :
PubChem	None	uM		EPAS1	-	GI(Protien) :
PubChem	None	uM		EPAS1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	2.434	ESR1	-	GI(Protien) :
PubChem	None	uM		HIF1A	-	GI(Protien) :
PubChem	None	uM		MC4R	-	GI(Protien) :
PubChem	None	uM		MC4R	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	0.831	NFE2L2	-	GI(Protien) :
PubChem	None	uM		NR0B1	-	GI(Protien) :
PubChem	AC50_uM	uM	0.260	PAX8	-	GI(Protien) :
PubChem	AC50_uM	uM	0.260	PAX8	-	GI(Protien) :
PubChem	AC50_uM	uM	5.900	PAX8	-	GI(Protien) :
PubChem	None	uM		PAX8	-	GI(Protien) :
PubChem	None	uM		TNFRSF10B	-	GI(Protien) :
PubChem	None	uM		TNFRSF10B	-	GI(Protien) :
PubChem	None	uM		TNFRSF10B	-	GI(Protien) :
ChEMBL	Activity	-		AHR	-	Target : CHEMBL3201
ChEMBL	Inhibition	-		CYP1B1	-	Target : CHEMBL4878

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