Tan Lab | DSigDB

Gene Set: D4 : CTD - rutecarpine

Collection

D4 : CTD

Chemical Name

rutecarpine ( From PubChem : RUTAECARPINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
287.315 g/mol	1	3	3.1009	True

Structure

InChI

InChI=1S/C18H13N3O/c22-18-13-6-2-4-8-15(13)20-17-16-12(9-10-21(17)18)11-5-1-3-7-14(11)19-16/h1-8,19H,9-10H2

InChIKey

ACVGWSKVRYFWRP-UHFFFAOYSA-N

Links

Gene (21 / 40)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	increases(expression)			AHR		C028632
CTD	increases(expression)			AHRR		C028632
CTD	increases(expression)			CYP1A1		C028632
CTD	affects(binding)			CYP1A2		C028632
CTD	decreases(activity)			CYP1A2		C028632
CTD	affects(binding)			CYP1B1		C028632
CTD	decreases(activity)			CYP1B1		C028632
PubChem	None	uM		AHR	-	GI(Protien) :
PubChem	None	uM		AHR	-	GI(Protien) :
PubChem	Potency	uM	3.263	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	8.196	ATAD5	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	15.849	HIF1A	-	GI(Protien) :
PubChem	None	uM		ITGA4	-	GI(Protien) :
PubChem	Potency	uM	2.909	NPC1	-	GI(Protien) :
PubChem	None	uM		NR0B1	-	GI(Protien) :
PubChem	None	uM		NR0B1	-	GI(Protien) :
PubChem	None	uM		NR0B1	-	GI(Protien) :
PubChem	None	uM		NR1I2	-	GI(Protien) :
PubChem	None	uM		NR5A1	-	GI(Protien) :
PubChem	Potency	uM	0.820	PARK2	-	GI(Protien) :
PubChem	Potency	uM	1.778	RAB9A	-	GI(Protien) :
PubChem	Potency	uM	2.909	RAB9A	-	GI(Protien) :
PubChem	None	uM		SENP6	-	GI(Protien) :
PubChem	None	uM		SENP7	-	GI(Protien) :
PubChem	None	uM		SMARCA2	-	GI(Protien) :
PubChem	None	uM		SMARCA2	-	GI(Protien) :
PubChem	Potency	uM	7.943	SMN2	-	GI(Protien) :
PubChem	Potency	uM	0.316	THPO	-	GI(Protien) :
ChEMBL	Potency	nM	3262.900	ATAD5	-	Target : CHEMBL1741209
ChEMBL	Potency	nM	8196.100	ATAD5	-	Target : CHEMBL1741209
ChEMBL	AC50	nM	316.230	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	15848.900	HIF1A	-	Target : CHEMBL4261
ChEMBL	Potency	nM	25118.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	2909.300	NPC1	-	Target : CHEMBL1293277
ChEMBL	Potency	nM	2909.300	RAB9A	-	Target : CHEMBL1293294
ChEMBL	Potency	nM	1778.300	RAB9A	-	Target : CHEMBL1293294
ChEMBL	Potency	nM	7943.300	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	316.200	THPO	-	Target : CHEMBL1293256

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