Tan Lab | DSigDB

Gene Set: D4 : CTD - 1,2-benzisothiazoline-3-one

Collection

D4 : CTD

Chemical Name

1,2-benzisothiazoline-3-one ( From PubChem : 1,2-BENZISOTHIAZOL-3(2H)-ONE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
151.186 g/mol	1	2	1.5896	True

Structure

InChI

InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)

InChIKey

DMSMPAJRVJJAGA-UHFFFAOYSA-N

Links

Gene (34 / 50)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(reaction)			E2F1		C015699
CTD	increases(expression)			E2F1		C015699
CTD	decreases(reaction)			ESR1		C015699
CTD	increases(activity)			ESR1		C015699
CTD	decreases(activity)			ESR1		C015699
CTD	increases(expression)			MAFF		C015699
CTD	increases(expression)			MT2A		C015699
CTD	increases(expression)			NQO1		C015699
CTD	increases(expression)			TXN		C015699
PubChem	None	uM		ABHD5	-	GI(Protien) :
PubChem	None	uM		ABHD5	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	27.306	AR	-	GI(Protien) :
PubChem	Potency	uM	50.119	BAZ2B	-	GI(Protien) :
PubChem	IC50	uM	12.200	CACNA1B	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	30.638	CYP19A1	-	GI(Protien) :
PubChem	Potency	uM	1.778	EHMT2	-	GI(Protien) :
PubChem	None	uM		HNF4A	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	54.941	HSPB1	-	GI(Protien) :
PubChem	None	uM		IL1B	-	GI(Protien) :
PubChem	Potency	uM	8.912	KAT2A	-	GI(Protien) :
PubChem	None	uM		KCNJ1	-	GI(Protien) :
PubChem	None	uM		KCNJ1	-	GI(Protien) :
PubChem	None	uM		KCNQ1	-	GI(Protien) :
PubChem	Potency	uM	11.220	MAPT	-	GI(Protien) :
PubChem	Potency	uM	25.119	MAPT	-	GI(Protien) :
PubChem	Potency	uM	27.306	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	44.668	NR1H4	-	GI(Protien) :
PubChem	None	uM		NR2E3	-	GI(Protien) :
PubChem	None	uM		PLIN5	-	GI(Protien) :
PubChem	None	uM		PLIN5	-	GI(Protien) :
PubChem	Potency	uM	5.323	PLK1	-	GI(Protien) :
PubChem	Potency	uM	25.119	POLI	-	GI(Protien) :
PubChem	None	uM		PRMT1	-	GI(Protien) :
PubChem	None	uM		PRMT1	-	GI(Protien) :
PubChem	Potency	uM	19.953	RXRA	-	GI(Protien) :
PubChem	None	uM		S1PR4	-	GI(Protien) :
PubChem	None	uM		S1PR4	-	GI(Protien) :
PubChem	None	uM		SMARCA2	-	GI(Protien) :
PubChem	Potency	uM	0.651	TDP1	-	GI(Protien) :
PubChem	Potency	uM	1.300	TDP1	-	GI(Protien) :
PubChem	Potency	uM	15.849	THRB	-	GI(Protien) :
PubChem	Potency	uM	31.623	WRN	-	GI(Protien) :
ChEMBL	IC50	nM	12200.000	APBA1	-	Target : CHEMBL2097170
ChEMBL	Potency	nM	50118.700	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	IC50	nM	12200.000	CACNA1B	-	Target : CHEMBL2097170
ChEMBL	Potency	nM	1778.300	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	8912.500	KAT2A	-	Target : CHEMBL5501
ChEMBL	Potency	nM	31622.800	KDM4A	-	Target : CHEMBL5896
ChEMBL	Potency	nM	25118.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	11220.200	MAPT	-	Target : CHEMBL1293224

Download gene sets

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