Tan Lab | DSigDB

Gene Set: D4 : TTD - 6-bromoindirubin-3-oxime

Collection

D4 : TTD

Chemical Name

6-bromoindirubin-3-oxime ( From PubChem : INDIRUBIN DERIV. 7A )

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
356.173 g/mol	3	5	1.4972	True

Structure

InChI

InChI=1S/C16H10BrN3O2/c17-8-5-6-9-12(7-8)19-16(21)13(9)15-14(20-22)10-3-1-2-4-11(10)18-15/h1-7,20,22H,(H,19,21)/b15-13-

InChIKey

WNWSUJQVZJJGLF-SQFISAMPSA-N

Links

Gene (35 / 63)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			AURKA		Clinical trial target
TTD	Inhibitor			AURKB		Research target
TTD	Inhibitor			AURKC		Clinical trial target
PubChem	Potency	uM	21.331	ARSA	-	GI(Protien) :
PubChem	Potency	uM	0.920	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	2.818	CBX1	-	GI(Protien) :
PubChem	None	uM		CSNK1G1	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	4.467	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	8.437	EHMT2	-	GI(Protien) :
PubChem	None	uM		MAP3K5	-	GI(Protien) :
PubChem	Potency	uM	10.000	MAPK1	-	GI(Protien) :
PubChem	Potency	uM	28.184	MAPK1	-	GI(Protien) :
PubChem	Potency	uM	2.239	MAPT	-	GI(Protien) :
PubChem	Potency	uM	3.548	MPHOSPH8	-	GI(Protien) :
PubChem	Potency	uM	5.973	MPHOSPH8	-	GI(Protien) :
PubChem	Potency	uM	2.328	MTOR	-	GI(Protien) :
PubChem	Potency	uM	5.212	MTOR	-	GI(Protien) :
PubChem	Potency	uM	2.909	NPC1	-	GI(Protien) :
PubChem	None	uM		PAK6	-	GI(Protien) :
PubChem	None	uM		PAK7	-	GI(Protien) :
PubChem	Potency	uM	2.593	PARK2	-	GI(Protien) :
PubChem	Potency	uM	15.849	PKM	-	GI(Protien) :
PubChem	Potency	uM	3.663	RAB9A	-	GI(Protien) :
PubChem	None	uM		SLK	-	GI(Protien) :
PubChem	Potency	uM	15.849	SMN2	-	GI(Protien) :
PubChem	Potency	uM	0.251	THPO	-	GI(Protien) :
PubChem	Potency	uM	12.589	TP53	-	GI(Protien) :
PubChem	Potency	uM	12.589	TP53	-	GI(Protien) :
PubChem	Potency	uM	12.589	USP2	-	GI(Protien) :
PubChem	Potency	uM	0.154	YES1		GI(Protien) :
ChEMBL	Inhibition	-		ALOX5	-	Target : CHEMBL215
ChEMBL	Inhibition	-		ALOX5	-	Target : CHEMBL215
ChEMBL	Potency	nM	919.600	ATAD5	-	Target : CHEMBL1741209
ChEMBL	Potency	nM	3981.100	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Potency	nM	2818.400	CBX1	-	Target : CHEMBL1741193
ChEMBL	Potency	nM	7943.300	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	4466.800	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	8436.800	EHMT2	-	Target : CHEMBL6032
ChEMBL	Inhibition	-		EPHX2	-	Target : CHEMBL2409
ChEMBL	Potency	nM	3162.300	KDM4A	-	Target : CHEMBL5896
ChEMBL	Potency	nM	10000.000	MAPK1	-	Target : CHEMBL4040
ChEMBL	Potency	nM	28183.800	MAPK1	-	Target : CHEMBL4040
ChEMBL	Potency	nM	8912.500	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	2238.700	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	3548.100	MPHOSPH8	-	Target : CHEMBL1741210
ChEMBL	Potency	nM	5972.800	MPHOSPH8	-	Target : CHEMBL1741210
ChEMBL	Potency	nM	5211.900	MTOR	-	Target : CHEMBL2842
ChEMBL	Potency	nM	2328.100	MTOR	-	Target : CHEMBL2842
ChEMBL	Potency	nM	10322.500	NFE2L2	-	Target : CHEMBL1075094
ChEMBL	Potency	nM	2909.300	NPC1	-	Target : CHEMBL1293277
ChEMBL	Potency	nM	3548.100	NPC1	-	Target : CHEMBL1293277
ChEMBL	Potency	nM	15848.900	PKM	-	Target : CHEMBL1075189
ChEMBL	Inhibition	-		PTGES	-	Target : CHEMBL5658
ChEMBL	Potency	nM	3662.600	RAB9A	-	Target : CHEMBL1293294
ChEMBL	Potency	nM	3548.100	RAB9A	-	Target : CHEMBL1293294
ChEMBL	Potency	nM	28183.800	RECQL	-	Target : CHEMBL1293236
ChEMBL	IC50	nM	5600.000	SENP7	-	Target : CHEMBL1741213
ChEMBL	Potency	nM	15848.900	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	251.200	THPO	-	Target : CHEMBL1293256
ChEMBL	Potency	nM	12589.300	TP53	-	Target : CHEMBL4096
ChEMBL	Potency	nM	12589.300	TP53	-	Target : CHEMBL4096
ChEMBL	Potency	nM	12589.300	USP2	-	Target : CHEMBL1293227

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