Tan Lab | DSigDB

Gene Set: D4 : TTD - Lapatinib

Collection

D4 : TTD

Chemical Name

Lapatinib ( From PubChem : LAPATINIB )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
581.058 g/mol	2	7	7.6838	False(2/4)

Structure

InChI

InChI=1S/C29H26ClFN4O4S/c1-40(36,37)12-11-32-16-23-7-10-27(39-23)20-5-8-26-24(14-20)29(34-18-33-26)35-22-6-9-28(25(30)15-22)38-17-19-3-2-4-21(31)13-19/h2-10,13-15,18,32H,11-12,16-17H2,1H3,(H,33,34,35)

InChIKey

BCFGMOOMADDAQU-UHFFFAOYSA-N

Links

Gene (5 / 25)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
TTD	Multitarget			EGFR		Successful target
TTD	Inhibitor			EGFR		Successful target
TTD	Drug(s)			EGFR		Successful target
TTD	Multitarget			ERBB2		Successful target
TTD	Inhibitor			ERBB2		Successful target
TTD	Drug(s)			ERBB2		Successful target
PubChem	None	uM	0.920	EGFR	-	GI(Protien) :
PubChem	None	uM	1.200	EGFR	-	GI(Protien) :
PubChem	None	uM	2.100	EGFR	-	GI(Protien) :
PubChem	None	uM	2.200	EGFR	-	GI(Protien) :
PubChem	None	uM	2.400	EGFR	-	GI(Protien) :
PubChem	None	uM	2.800	EGFR	-	GI(Protien) :
PubChem	None	uM	3.500	EGFR	-	GI(Protien) :
PubChem	None	uM	3.900	EGFR	-	GI(Protien) :
PubChem	None	uM	4.200	EGFR	-	GI(Protien) :
PubChem	None	uM	8.600	EGFR	-	GI(Protien) :
PubChem	None	uM	7.000	ERBB2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	26.601	HSPB1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	4.216	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	4.343	YES1		GI(Protien) :
ChEMBL	Inhibition	-		EGFR	-	Target : CHEMBL203
ChEMBL	Inhibition	-		EGFR	-	Target : CHEMBL203
ChEMBL	Inhibition	-		EGFR	-	Target : CHEMBL203
ChEMBL	Inhibition	-		ERBB2	-	Target : CHEMBL1824
ChEMBL	Inhibition	-		ERBB2	-	Target : CHEMBL1824

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