Tan Lab | DSigDB

Gene Set: D4 : TTD - PHENMEDIPHAM

Collection

D4 : TTD

Chemical Name

PHENMEDIPHAM ( From PubChem : PHENMEDIPHAM )

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
300.309 g/mol	2	6	3.9302	True

Structure

InChI

InChI=1S/C16H16N2O4/c1-11-5-3-6-12(9-11)18-16(20)22-14-8-4-7-13(10-14)17-15(19)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)

InChIKey

Links

Gene (6 / 16)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			FAAH		Successful target
PubChem	Potency-Replicate_1	uM	2.731	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	4.856	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	19.331	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	27.306	AHR	-	GI(Protien) :
PubChem	Potency	uM	25.119	CYP3A4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	8.635	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.690	ESR1	-	GI(Protien) :
PubChem	Potency	uM	31.623	MAPK1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	48.558	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	52.431	NFE2L2	-	GI(Protien) :
ChEMBL	Potency	nM	25118.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Inhibition	-		FAAH	-	Target : CHEMBL2243
ChEMBL	Inhibition	-		FAAH	-	Target : CHEMBL2243
ChEMBL	Inhibition	-		FAAH	-	Target : CHEMBL2243
ChEMBL	Potency	nM	31622.800	MAPK1	-	Target : CHEMBL4040

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