Tan Lab | DSigDB

Gene Set: D4 : TTD - NSC-645827

Collection

D4 : TTD

Chemical Name

NSC-645827 ( From PubChem : NSC-645827 )

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
323.349 g/mol	2	7	1.5858	True

Structure

InChI

InChI=1S/C17H17N5O2/c1-21(2)8-7-18-12-4-5-13-16-15(12)17(24)11-9-10(23)3-6-14(11)22(16)20-19-13/h3-6,9,18,23H,7-8H2,1-2H3

InChIKey

Links

Gene (12 / 20)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			NQO1		Clinical trial target
PubChem	None	uM		DNMT1	-	GI(Protien) :
PubChem	Potency	uM	1.695	EYA2	-	GI(Protien) :
PubChem	Potency	uM	8.492	FEN1	-	GI(Protien) :
PubChem	Potency	uM	12.589	FEN1	-	GI(Protien) :
PubChem	Potency	uM	23.109	IDH1	-	GI(Protien) :
PubChem	None	uM		IL1B	-	GI(Protien) :
PubChem	AC50_uM	uM	4.731	MITF	-	GI(Protien) :
PubChem	AC50_uM	uM	4.731	MITF	-	GI(Protien) :
PubChem	AC50_uM	uM	4.731	MITF	-	GI(Protien) :
PubChem	AC50_uM	uM	46.048	MITF	-	GI(Protien) :
PubChem	None	uM		NR5A1	-	GI(Protien) :
PubChem	None	uM		NR5A2	-	GI(Protien) :
PubChem	IC50	uM	62.560	RACGAP1	-	GI(Protien) :
PubChem	None	uM		SIX1	-	GI(Protien) :
PubChem	Potency	uM	0.184	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.184	TDP1	-	GI(Protien) :
ChEMBL	AC50	nM	4731.000	MITF	-	Target : CHEMBL1741165
ChEMBL	AC50	nM	4731.000	MITF	-	Target : CHEMBL1741165
ChEMBL	AC50	nM	4731.000	MITF	-	Target : CHEMBL1741165

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