Tan Lab | DSigDB

Gene Set: D4 : CTD - gallocatechol

Collection

D4 : CTD

Chemical Name

gallocatechol ( From PubChem : CHEBI:71224 )

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
306.267 g/mol	6	7	1.2517	False(3/4)

Structure

InChI

InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1

InChIKey

Links

Gene (13 / 18)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	increases(expression)			ABCB11		C057580
CTD	affects(activity)			ABCC1		C057580
CTD	increases(expression)			NR0B2		C057580
CTD	affects(cotreatment)			NR1H4		C057580
CTD	increases(activity)			NR1H4		C057580
PubChem	Potency	uM	15.849	HPGD	-	GI(Protien) :
PubChem	Potency	uM	25.119	MAPT	-	GI(Protien) :
PubChem	Potency	uM	3.981	POLK	-	GI(Protien) :
PubChem	Potency	uM	3.264	TDP1	-	GI(Protien) :
PubChem	None	uM		UBE2N	-	GI(Protien) :
ChEMBL	Potency	nM	5011.900	APEX1	-	Target : CHEMBL5619
ChEMBL	Potency	nM	15848.900	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	1412.500	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	25118.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	35481.300	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	5011.900	TDP1	-	Target : CHEMBL1075138
ChEMBL	Potency	nM	15848.900	TDP1	-	Target : CHEMBL1075138
ChEMBL	Activity	-		ALB	-	Target : CHEMBL3253

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