Tan Lab | DSigDB

Gene Set: D4 : TTD - CGS-15943

Collection

D4 : TTD

Chemical Name

CGS-15943 ( From PubChem : CGS 15943 )

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
285.689 g/mol	1	6	3.3543	True

Structure

InChI

InChI=1S/C13H8ClN5O/c14-7-3-4-9-8(6-7)12-17-11(10-2-1-5-20-10)18-19(12)13(15)16-9/h1-6H,(H2,15,16)

InChIKey

Links

Gene (15 / 25)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			ADORA1		Successful target
TTD	Inhibitor			ADORA2A		Successful target
TTD	Inhibitor			ADORA2B		Successful target
TTD	Inhibitor			ADORA3		Successful target
PubChem	None	uM		AHR	-	GI(Protien) :
PubChem	None	uM		AHR	-	GI(Protien) :
PubChem	Potency	uM	0.596	APOBEC3G	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	1.300	DRD1	-	GI(Protien) :
PubChem	Potency	uM	2.512	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	5.012	HIF1A	-	GI(Protien) :
PubChem	Potency	uM	50.119	MPHOSPH8	-	GI(Protien) :
PubChem	Potency	uM	5.848	MTOR	-	GI(Protien) :
PubChem	Potency	uM	1.458	NFE2L2	-	GI(Protien) :
PubChem	None	uM		NR1I2	-	GI(Protien) :
PubChem	Potency	uM	1.496	TDP1	-	GI(Protien) :
PubChem	Potency	uM	6.310	TDP1	-	GI(Protien) :
PubChem	Potency	uM	8.912	TDP1	-	GI(Protien) :
ChEMBL	AC50	nM	63.100	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	1299.500	DRD1	-	Target : CHEMBL2056
ChEMBL	Potency	nM	2511.900	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	5011.900	HIF1A	-	Target : CHEMBL4261
ChEMBL	Potency	nM	50118.700	MPHOSPH8	-	Target : CHEMBL1741210
ChEMBL	Potency	nM	5847.900	MTOR	-	Target : CHEMBL2842

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