Tan Lab | DSigDB

Gene Set: D4 : TTD - Mebendazole

Collection

D4 : TTD

Chemical Name

Mebendazole ( From PubChem : MEBENDAZOLE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
295.293 g/mol	2	5	3.0452	True

Structure

InChI

InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21)

InChIKey

Links

Gene (11 / 18)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Drug(s)			TUBB		Successful target
PubChem	None	uM		ABCB1	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	3.879	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	4.522	AHR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	0.349	AR	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	0.286	GMNN	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	3.758	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	1.059	NR1H4	-	GI(Protien) :
PubChem	None	uM		NR1H4	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	0.255	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.326	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.360	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.461	TDP1	-	GI(Protien) :
ChEMBL	AC50	nM	3981.070	CYP1A2	-	Target : CHEMBL3356

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