Tan Lab | DSigDB

Gene Set: D4 : TTD - Amsacrine

Collection

D4 : TTD

Chemical Name

Amsacrine ( From PubChem : AMSACRINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
393.459 g/mol	2	5	5.7385	False(3/4)

Structure

InChI

InChI=1S/C21H19N3O3S/c1-27-20-13-14(24-28(2,25)26)11-12-19(20)23-21-15-7-3-5-9-17(15)22-18-10-6-4-8-16(18)21/h3-13,24H,1-2H3,(H,22,23)

InChIKey

Links

Gene (15 / 28)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			TOP2A		Successful target
TTD	Drug(s)			TOP2A		Successful target
TTD	Inhibitor			TOP2B		Successful target
TTD	Drug(s)			TOP2B		Successful target
PubChem	Potency	uM	14.575	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	0.355	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	79.433	CBX1	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	1.122	DRD1	-	GI(Protien) :
PubChem	Potency	uM	11.917	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	1.000	GLS	-	GI(Protien) :
PubChem	Potency	uM	0.521	MTOR	-	GI(Protien) :
PubChem	Potency	uM	3.690	MTOR	-	GI(Protien) :
ChEMBL	Inhibition	-		CYP1A2	-	Target : CHEMBL3356
ChEMBL	AC50	nM	7943.280	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Inhibition	-		CYP2C19	-	Target : CHEMBL3622
ChEMBL	Inhibition	-		CYP2C9	-	Target : CHEMBL3397
ChEMBL	Inhibition	-		CYP2D6	-	Target : CHEMBL289
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	31622.800	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	31622.800	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Activity	-		TOP2A	-	Target : CHEMBL1806
ChEMBL	Inhibition	-		TOP2A	-	Target : CHEMBL1806
ChEMBL	Inhibition	-		TOP2A	-	Target : CHEMBL1806
ChEMBL	Activity	-		TOP2A	-	Target : CHEMBL1806
ChEMBL	Activity	-		TOP2A	-	Target : CHEMBL1806

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