Tan Lab | DSigDB

Gene Set: D4 : TTD - AG-490

Collection

D4 : TTD

Chemical Name

AG-490 ( From PubChem : TYRPHOSTIN B42 )

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
294.305 g/mol	3	5	2.71208	True

Structure

InChI

InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)/b14-8+

InChIKey

TUCIOBMMDDOEMM-RIYZIHGNSA-N

Links

Gene (23 / 41)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			EGFR		Successful target
TTD	Inhibitor			JAK2		Clinical trial target
TTD	Inhibitor			JAK3		Successful target
PubChem	None	uM		ALPI	-	GI(Protien) :
PubChem	Potency	uM	12.589	BAZ2B	-	GI(Protien) :
PubChem	Potency	uM	10.000	CBX1	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	15.849	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	4.744	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	5.012	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	5.623	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	0.562	GLS	-	GI(Protien) :
PubChem	Potency	uM	8.912	GMNN	-	GI(Protien) :
PubChem	Potency	uM	10.000	HIF1A	-	GI(Protien) :
PubChem	None	uM		HSP90AA1	-	GI(Protien) :
PubChem	Potency	uM	25.119	HSPA5	-	GI(Protien) :
PubChem	None	uM		IDE	-	GI(Protien) :
PubChem	None	uM		IDE	-	GI(Protien) :
PubChem	Potency	uM	12.589	KCNH2		GI(Protien) :
PubChem	Potency	uM	12.589	KCNH2		GI(Protien) :
PubChem	None	uM		PLA2G7	-	GI(Protien) :
PubChem	Potency	uM	11.220	POLH	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	29.855	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	12589.300	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Potency	nM	10000.000	CBX1	-	Target : CHEMBL1741193
ChEMBL	AC50	nM	7943.280	CYP1A2	-	Target : CHEMBL3356
ChEMBL	AC50	nM	15848.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	15848.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	5623.400	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	5011.900	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	4744.400	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	8912.500	GMNN	-	Target : CHEMBL1293278
ChEMBL	Potency	nM	10000.000	HIF1A	-	Target : CHEMBL4261
ChEMBL	Potency	nM	15848.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Inhibition	-		JAK2	-	Target : CHEMBL2971
ChEMBL	Potency	nM	15848.900	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	19952.600	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	31622.800	RECQL	-	Target : CHEMBL1293236

Download gene sets

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