Tan Lab | DSigDB

Gene Set: D4 : CTD - 6-Mercaptopurine

Collection

D4 : CTD

Chemical Name

6-Mercaptopurine ( From PubChem : 6-MERCAPTOPURINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
152.177 g/mol	2	3	1.0155	True

Structure

InChI

InChI=1S/C5H4N4S/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)

InChIKey

GLVAUDGFNGKCSF-UHFFFAOYSA-N

Links

Gene (36 / 57)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(expression)			BCL2L1		D015122
CTD	affects(binding)			CD28		D015122
CTD	decreases(reaction)			CD28		D015122
CTD	increases(activity)			CD28		D015122
CTD	affects(localization)			GAPDH		D015122
CTD	increases(expression)			GCLM		D015122
CTD	increases(expression)			GPX2		D015122
CTD	increases(expression)			GPX3		D015122
CTD	increases(expression)			GSS		D015122
CTD	affects(response to substance)			GSTM1		D015122
CTD	affects(response to substance)			HLA-DQA1		D015122
CTD	affects(response to substance)			HLA-DRB1		D015122
CTD	increases(expression)			IMPDH2		D015122
CTD	decreases(phosphorylation)			MAP2K1		D015122
CTD	affects(binding)			NFKB1		D015122
CTD	decreases(reaction)			NFKB1		D015122
CTD	increases(activity)			NFKB1		D015122
CTD	increases(response to substance)			NUDT15		D015122
CTD	affects(localization)			RELA		D015122
CTD	affects(binding)			RELA		D015122
CTD	decreases(reaction)			RELA		D015122
CTD	increases(activity)			RELA		D015122
CTD	increases(expression)			SOD2		D015122
CTD	affects(response to substance)			TPMT		D015122
CTD	affects(metabolic processing)			TPMT		D015122
CTD	affects(response to substance)			TYMS		D015122
CTD	increases(expression)			VAV1		D015122
CTD	affects(response to substance)			VDR		D015122
PubChem	AhR Potency (uM)	uM	21.132	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	21.156	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.737	AHR	-	GI(Protien) :
PubChem	Potency	uM	7.943	ALDH1A1	-	GI(Protien) :
PubChem	Potency	uM	50.119	BAZ2B	-	GI(Protien) :
PubChem	Potency	uM	3.162	HBB	-	GI(Protien) :
PubChem	Potency	uM	6.310	HBB	-	GI(Protien) :
PubChem	Potency	uM	2.593	IDH1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	3.762	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	4.736	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	7.497	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	9.438	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	18.837	TDP1	-	GI(Protien) :
PubChem	None	uM		TNFRSF10B	-	GI(Protien) :
PubChem	Potency	uM	7.943	TP53	-	GI(Protien) :
ChEMBL	Potency	nM	7943.300	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Potency	nM	50118.700	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Inhibition	-		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	3162.300	HBB	-	Target : CHEMBL4331
ChEMBL	Potency	nM	6309.600	HBB	-	Target : CHEMBL4331
ChEMBL	Potency	nM	6309.600	KDM4A	-	Target : CHEMBL5896
ChEMBL	Potency	nM	19952.600	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	31622.800	TDP1	-	Target : CHEMBL1075138
ChEMBL	Potency	nM	7943.300	TP53	-	Target : CHEMBL4096

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