Tan Lab | DSigDB

Gene Set: D4 : CTD - indirubin-3'-monoxime

Collection

D4 : CTD

Chemical Name

indirubin-3'-monoxime ( From PubChem : INDIRUBIN-3'-MONOXIME )

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
277.277 g/mol	3	4	0.8364	True

Structure

InChI

InChI=1S/C16H11N3O2/c20-16-13(9-5-1-3-7-11(9)18-16)15-14(19-21)10-6-2-4-8-12(10)17-15/h1-8,17,19,21H

InChIKey

LDEWQRSYYHTQRA-UHFFFAOYSA-N

Links

Gene (55 / 107)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(expression)			ACTB		C474021
CTD	affects(binding)			AHR		C474021
CTD	increases(activity)			AHR		C474021
CTD	increases(activity)			AR		C474021
CTD	decreases(expression)			BAX		C474021
CTD	affects(cotreatment)			BCL2L1		C474021
CTD	increases(expression)			BCL2L1		C474021
CTD	affects(cotreatment)			CASP8		C474021
CTD	increases(expression)			CASP8		C474021
CTD	affects(cotreatment)			CAT		C474021
CTD	decreases(expression)			CAT		C474021
CTD	affects(cotreatment)			CCL4		C474021
CTD	decreases(expression)			CCL4		C474021
CTD	decreases(activity)			CDK2		C474021
CTD	affects(cotreatment)			CDKN1A		C474021
CTD	increases(expression)			CDKN1A		C474021
CTD	affects(cotreatment)			CYP1A1		C474021
CTD	increases(expression)			CYP1A1		C474021
CTD	decreases(expression)			EPHX2		C474021
CTD	decreases(expression)			GPX1		C474021
CTD	decreases(activity)			GSK3B		C474021
CTD	increases(expression)			GSR		C474021
CTD	affects(cotreatment)			HMOX1		C474021
CTD	decreases(expression)			HMOX1		C474021
CTD	affects(cotreatment)			HSPA2		C474021
CTD	decreases(expression)			HSPA2		C474021
CTD	affects(cotreatment)			HSPA6		C474021
CTD	decreases(expression)			HSPA6		C474021
CTD	affects(cotreatment)			HSPA9		C474021
CTD	decreases(expression)			HSPA9		C474021
CTD	increases(expression)			HSPA9		C474021
CTD	increases(expression)			KLK3		C474021
CTD	decreases(activity)			LCK		C474021
CTD	affects(cotreatment)			MT2A		C474021
CTD	decreases(expression)			MT2A		C474021
CTD	affects(cotreatment)			NFKBIA		C474021
CTD	decreases(expression)			NFKBIA		C474021
CTD	affects(cotreatment)			PTGS2		C474021
CTD	increases(expression)			PTGS2		C474021
CTD	decreases(expression)			RAD23A		C474021
CTD	affects(cotreatment)			SERPINE1		C474021
CTD	increases(expression)			SERPINE1		C474021
CTD	decreases(activity)			SGK1		C474021
CTD	affects(cotreatment)			SOD2		C474021
CTD	decreases(expression)			SOD2		C474021
CTD	increases(expression)			UNG		C474021
PubChem	Potency	uM	10.691	ARSA	-	GI(Protien) :
PubChem	Potency	uM	25.119	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	3.981	CBX1	-	GI(Protien) :
PubChem	None	uM		CLK3	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	6.310	CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	31.623	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	8.912	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	11.220	GLS	-	GI(Protien) :
PubChem	Potency	uM	0.631	HTT	-	GI(Protien) :
PubChem	Potency	uM	1.413	HTT	-	GI(Protien) :
PubChem	None	uM		HTT	-	GI(Protien) :
PubChem	None	uM		MAP3K5	-	GI(Protien) :
PubChem	Potency	uM	10.000	MAPK1	-	GI(Protien) :
PubChem	Potency	uM	0.562	MAPT	-	GI(Protien) :
PubChem	Potency	uM	0.708	MAPT	-	GI(Protien) :
PubChem	Potency	uM	1.585	MAPT	-	GI(Protien) :
PubChem	Potency	uM	2.818	MAPT	-	GI(Protien) :
PubChem	None	uM		MAPT	-	GI(Protien) :
PubChem	Potency	uM	6.310	MPHOSPH8	-	GI(Protien) :
PubChem	Potency	uM	7.519	MPHOSPH8	-	GI(Protien) :
PubChem	Potency	uM	4.611	NPC1	-	GI(Protien) :
PubChem	None	uM		PAK6	-	GI(Protien) :
PubChem	None	uM		PAK7	-	GI(Protien) :
PubChem	Potency	uM	10.322	PARK2	-	GI(Protien) :
PubChem	Potency	uM	12.589	PKM	-	GI(Protien) :
PubChem	None	uM		SLK	-	GI(Protien) :
PubChem	Potency	uM	12.589	SMN2	-	GI(Protien) :
PubChem	Potency	uM	14.125	SMN2	-	GI(Protien) :
PubChem	None	uM		STK16	-	GI(Protien) :
PubChem	Potency	uM	25.119	TP53	-	GI(Protien) :
PubChem	Potency	uM	25.119	TP53	-	GI(Protien) :
PubChem	Potency	uM	0.772	YES1		GI(Protien) :
ChEMBL	Potency	nM	3981.100	CBX1	-	Target : CHEMBL1741193
ChEMBL	AC50	nM	31.620	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	6309.600	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Potency	nM	31622.800	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	7943.280	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	7943.300	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	8912.500	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	1412.500	HTT	-	Target : CHEMBL5514
ChEMBL	Potency	nM	631.000	HTT	-	Target : CHEMBL5514
ChEMBL	Potency	nM	10000.000	MAPK1	-	Target : CHEMBL4040
ChEMBL	Potency	nM	15848.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	10000.000	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	3548.100	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	2818.400	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	1584.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	562.300	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	707.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	6309.600	MPHOSPH8	-	Target : CHEMBL1741210
ChEMBL	Potency	nM	7519.300	MPHOSPH8	-	Target : CHEMBL1741210
ChEMBL	Potency	nM	4610.900	NPC1	-	Target : CHEMBL1293277
ChEMBL	Potency	nM	12589.300	PKM	-	Target : CHEMBL1075189
ChEMBL	Potency	nM	14125.400	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	12589.300	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	25118.900	TP53	-	Target : CHEMBL4096
ChEMBL	Potency	nM	25118.900	TP53	-	Target : CHEMBL4096

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