Tan Lab | DSigDB

Gene Set: D4 : TTD - Trichostatin

Collection

D4 : TTD

Chemical Name

Trichostatin ( From PubChem : TRICHOSTATIN A )

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
302.368 g/mol	2	5	2.9702	True

Structure

InChI

InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+/t13-/m1/s1

InChIKey

Links

Gene (13 / 24)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			HDAC1		Successful target
PubChem	Potency	uM	28.184	ALDH1A1	-	GI(Protien) :
PubChem	Potency	uM	0.629	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	14.083	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	15.849	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	17.783	GBA	-	GI(Protien) :
PubChem	None	uM		SMN1	-	GI(Protien) :
PubChem	Potency	uM	1.122	SMN2	-	GI(Protien) :
PubChem	Potency	uM	1.413	SMN2	-	GI(Protien) :
ChEMBL	Potency	nM	28183.800	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Inhibition	-		CFTR	-	Target : CHEMBL4051
ChEMBL	Potency	nM	15848.900	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	17782.800	GBA	-	Target : CHEMBL2179
ChEMBL	Activity	-		HDAC1	-	Target : CHEMBL325
ChEMBL	Inhibition	-		HDAC1	-	Target : CHEMBL325
ChEMBL	Inhibition	-		HDAC2	-	Target : CHEMBL1937
ChEMBL	Activity	-		HDAC6	-	Target : CHEMBL1865
ChEMBL	Inhibition	-		HDAC6	-	Target : CHEMBL1865
ChEMBL	Inhibition	-		HDAC7	-	Target : CHEMBL2716
ChEMBL	Inhibition	-		HDAC7	-	Target : CHEMBL2716
ChEMBL	Activity	-		SIRT2	-	Target : CHEMBL4462
ChEMBL	Activity	-		SIRT2	-	Target : CHEMBL4462
ChEMBL	Potency	nM	1412.500	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	1122.000	SMN1; SMN2	-	Target : CHEMBL1293232

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