Tan Lab | DSigDB

Gene Set: D4 : TTD - Caffeic acid phenethyl ester

Collection

D4 : TTD

Chemical Name

Caffeic acid phenethyl ester ( From PubChem : CAFFEIC ACID PHENETHYL ESTER )

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
284.307 g/mol	2	4	2.8969	True

Structure

InChI

InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+

InChIKey

SWUARLUWKZWEBQ-VQHVLOKHSA-N

Links

Gene (19 / 36)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			RELA		Research target
PubChem	Potency	uM	0.501	ALOX15	-	GI(Protien) :
PubChem	Potency	uM	20.588	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	3.548	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	3.981	EHMT2	-	GI(Protien) :
PubChem	None	uM		GFER	-	GI(Protien) :
PubChem	Potency	uM	0.891	GLS	-	GI(Protien) :
PubChem	None	uM		HSP90AA1	-	GI(Protien) :
PubChem	None	uM		KCNK3	-	GI(Protien) :
PubChem	None	uM		KCNK3	-	GI(Protien) :
PubChem	Potency	uM	3.288	MTOR	-	GI(Protien) :
PubChem	None	uM		PAFAH1B2	-	GI(Protien) :
PubChem	Potency	uM	15.849	SMN2	-	GI(Protien) :
PubChem	Potency	uM	17.783	SMN2	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	1.032	TDP1	-	GI(Protien) :
PubChem	Potency	uM	1.458	TDP1	-	GI(Protien) :
PubChem	Potency	uM	2.239	TDP1	-	GI(Protien) :
PubChem	Potency	uM	2.593	TDP1	-	GI(Protien) :
PubChem	Potency	uM	2.818	TDP1	-	GI(Protien) :
PubChem	Potency	uM	3.264	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	501.200	ALOX15	-	Target : CHEMBL2903
ChEMBL	Potency	nM	10000.000	ALOX15B	-	Target : CHEMBL2457
ChEMBL	Potency	nM	20587.800	ATAD5	-	Target : CHEMBL1741209
ChEMBL	Potency	nM	3981.100	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	3548.100	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	19952.600	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	89125.100	KDM4A	-	Target : CHEMBL5896
ChEMBL	Potency	nM	25118.900	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	19952.600	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	15848.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	12589.300	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	11220.200	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	3288.500	MTOR	-	Target : CHEMBL2842
ChEMBL	Potency	nM	15848.900	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	17782.800	SMN1; SMN2	-	Target : CHEMBL1293232

Download gene sets

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