Tan Lab | DSigDB

Gene Set: D4 : TTD - BTNP

Collection

D4 : TTD

Chemical Name

BTNP ( From PubChem : BROMOENOL LACTONE )

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
317.177 g/mol	0	2	4.4967	True

Structure

InChI

InChI=1S/C16H13BrO2/c17-10-12-8-9-15(16(18)19-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,10,15H,8-9H2/b12-10+/t15-/m1/s1

InChIKey

Links

Gene (9 / 16)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			FAAH		Successful target
PubChem	Potency	uM	0.501	ALDH1A1	-	GI(Protien) :
PubChem	Potency	uM	0.631	ALDH1A1	-	GI(Protien) :
PubChem	Potency	uM	18.349	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	25.119	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	19.953	HPGD	-	GI(Protien) :
PubChem	Potency	uM	5.623	KCNH2		GI(Protien) :
PubChem	Potency	uM	5.623	KCNH2		GI(Protien) :
PubChem	Potency	uM	17.783	MAPT	-	GI(Protien) :
PubChem	Potency	uM	9.466	RGS4	-	GI(Protien) :
PubChem	Potency	uM	17.783	VDR	-	GI(Protien) :
ChEMBL	Potency	nM	630.900	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Potency	nM	501.200	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Potency	nM	18348.900	ATAD5	-	Target : CHEMBL1741209
ChEMBL	Potency	nM	19952.600	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	17782.800	MAPT	-	Target : CHEMBL1293224

Download gene sets