Tan Lab | DSigDB

Gene Set: D4 : CTD - 4-tert-butyl-4'-methoxydibenzoylmethane

Collection

D4 : CTD

Chemical Name

4-tert-butyl-4'-methoxydibenzoylmethane ( From PubChem : AVOBENZONE )

FDA	NPC	WHO	Indian	Australia	China	Traditional Herbal	Clinical Trail
Approved	Not	Not	Approved	Not	Not	Not	Not

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
310.387 g/mol	0	3	4.4484	True

Structure

InChI

InChI=1S/C20H22O3/c1-20(2,3)16-9-5-14(6-10-16)18(21)13-19(22)15-7-11-17(23-4)12-8-15/h5-12H,13H2,1-4H3

InChIKey

XNEFYCZVKIDDMS-UHFFFAOYSA-N

Links

Gene (6 / 13)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(reaction)			GSTP1		C049935
CTD	increases(metabolic processing)			GSTP1		C049935
PubChem	Potency-Replicate_1	uM	26.603	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	65.809	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	65.809	ESR1	-	GI(Protien) :
PubChem	Potency	uM	31.623	KAT2A	-	GI(Protien) :
ChEMBL	Potency	nM	7943.300	APEX1	-	Target : CHEMBL5619
ChEMBL	Potency	nM	8912.500	APEX1	-	Target : CHEMBL5619
ChEMBL	Potency	nM	31622.800	KAT2A	-	Target : CHEMBL5501
ChEMBL	Potency	nM	12589.300	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	31622.800	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	25118.900	TDP1	-	Target : CHEMBL1075138
ChEMBL	Potency	nM	19952.600	TDP1	-	Target : CHEMBL1075138

Download gene sets

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Contact us
Tan Lab , Mail Stop 8117
12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA

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