Tan Lab | DSigDB

Gene Set: D4 : CTD - Thiabendazole

Collection

D4 : CTD

Chemical Name

Thiabendazole ( From PubChem : THIABENDAZOLE )

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
201.248 g/mol	1	3	2.6864	True

Structure

InChI

InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)

InChIKey

Links

Gene (14 / 33)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	increases(expression)			CYP1A1		D013827
CTD	affects(metabolic processing)			CYP1A2		D013827
CTD	increases(reaction)			CYP1A2		D013827
CTD	affects(metabolic processing)			CYP1A2		D013827
CTD	decreases(activity)			CYP1A2		D013827
CTD	increases(expression)			CYP1A2		D013827
CTD	increases(expression)			CYP2B6		D013827
CTD	decreases(activity)			CYP2C9		D013827
CTD	increases(expression)			CYP3A4		D013827
CTD	increases(metabolic processing)			MPO		D013827
CTD	increases(expression)			UTRN		D013827
PubChem	AhR Potency (uM)	uM	5.011	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	8.413	AHR	-	GI(Protien) :
PubChem	Potency	uM	12.589	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	13.685	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	14.867	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	15.449	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	27.306	AHR	-	GI(Protien) :
PubChem	Potency	uM	11.220	BRCA1	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	9.688	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	16.785	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	24.485	ESR1	-	GI(Protien) :
PubChem	None	uM		FKBP1A	-	GI(Protien) :
PubChem	None	uM		INS	-	GI(Protien) :
PubChem	Potency	uM	8.912	SMN2	-	GI(Protien) :
PubChem	Potency	uM	12.589	SMN2	-	GI(Protien) :
PubChem	Potency	uM	25.119	SMN2	-	GI(Protien) :
ChEMBL	AC50	nM	125.890	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	12589.300	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	25118.900	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	8912.500	SMN1; SMN2	-	Target : CHEMBL1293232

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