Tan Lab | DSigDB

Gene Set: D4 : TTD - GNF-PF-3955

Collection

D4 : TTD

Chemical Name

GNF-PF-3955 ( From PubChem : GNF-PF-3955 )

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
453.493 g/mol	2	8	3.6934	True

Structure

InChI

InChI=1S/C26H23N5O3/c1-17-7-5-12-31-23(17)29-24-21(26(31)33)15-20(25(32)28-16-19-10-6-14-34-19)22(27)30(24)13-11-18-8-3-2-4-9-18/h2-10,12,14-15,27H,11,13,16H2,1H3,(H,28,32)

InChIKey

AINLDDVHMMTZDO-UHFFFAOYSA-N

Links

Gene (14 / 19)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			MCL1		Clinical trial target
PubChem	Average IC50	uM	34.050	APOBEC3G	-	GI(Protien) :
PubChem	None	uM		BCL2L1	-	GI(Protien) :
PubChem	IC50	uM		CBFB	-	GI(Protien) :
PubChem	None	uM		ESR1	-	GI(Protien) :
PubChem	None	uM		ESR2	-	GI(Protien) :
PubChem	Potency	uM	2.909	GMNN	-	GI(Protien) :
PubChem	Potency	uM	18.356	GMNN	-	GI(Protien) :
PubChem	None	uM		IL1B	-	GI(Protien) :
PubChem	None	uM		KLK7	-	GI(Protien) :
PubChem	None	uM		MAPT	-	GI(Protien) :
PubChem	IC50	uM	3.568	MCL1	-	GI(Protien) :
PubChem	None	uM		MCL1	-	GI(Protien) :
PubChem	IC50	uM		RUNX1	-	GI(Protien) :
PubChem	None	uM		SLC5A7	-	GI(Protien) :
PubChem	None	uM		SLC5A7	-	GI(Protien) :
PubChem	Potency	uM	14.581	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	25118.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	IC50	nM	3567.910	MCL1	-	Target : CHEMBL4361

Download gene sets

gmt, text, Detailed text