Tan Lab | DSigDB

Gene Set: D4 : TTD - Devazepide

Collection

D4 : TTD

Chemical Name

Devazepide ( From PubChem : DEVAZEPIDE [USAN:INN] )

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
408.452 g/mol	2	5	3.6293	True

Structure

InChI

InChI=1S/C25H20N4O2/c1-29-21-14-8-6-12-18(21)22(16-9-3-2-4-10-16)27-23(25(29)31)28-24(30)20-15-17-11-5-7-13-19(17)26-20/h2-15,23,26H,1H3,(H,28,30)/t23-/m0/s1

InChIKey

NFHRQQKPEBFUJK-QHCPKHFHSA-N

Links

Gene (9 / 15)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Antagonist			CCKAR		Clinical trial target
TTD	Antagonist			CCKAR		Clinical trial target
PubChem	AhR Potency (uM)	uM	11.436	AHR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	7.562	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	9.521	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	29.849	CYP19A1	-	GI(Protien) :
PubChem	None	uM		CYP19A1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	2.391	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	4.772	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	15.545	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.710	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	9.438	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	14.396	NR1H4	-	GI(Protien) :
PubChem	None	uM		PPARD	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :

Download gene sets

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