Tan Lab | DSigDB

Gene Set: D4 : TTD - Mycophenolic acid

Collection

D4 : TTD

Chemical Name

Mycophenolic acid ( From PubChem : MYCOPHENOIC ACID )

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
320.337 g/mol	2	6	2.7332	True

Structure

InChI

InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+

InChIKey

Links

Gene (13 / 34)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			IMPDH2		Successful target
TTD	Drug(s)			IMPDH2		Successful target
PubChem	Potency-Replicate_1	uM	0.406	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.910	AR	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	0.098	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.512	ESR1	-	GI(Protien) :
PubChem	None	uM		MDM2	-	GI(Protien) :
PubChem	None	uM		MDM2	-	GI(Protien) :
PubChem	None	uM		MDM4	-	GI(Protien) :
PubChem	None	uM		MDM4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.473	PPARG	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :
PubChem	None	uM		SMN1	-	GI(Protien) :
PubChem	Potency	uM	0.398	SMN2	-	GI(Protien) :
PubChem	Potency	uM	0.501	SMN2	-	GI(Protien) :
PubChem	Potency	uM	0.631	SMN2	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	0.033	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.114	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.114	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.150	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.184	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.299	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.366	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.376	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.581	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	25118.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	12589.300	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Activity	-		PPARG	-	Target : CHEMBL235
ChEMBL	Activity	-		PPARG	-	Target : CHEMBL235
ChEMBL	Potency	nM	398.100	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	501.200	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	631.000	SMN1; SMN2	-	Target : CHEMBL1293232

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