Tan Lab | DSigDB

Gene Set: D4 : Boss - dihydroharmine

Collection

D4 : Boss

Chemical Name

dihydroharmine ( From PubChem : HARMALINE )

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
214.263 g/mol	1	3	0.4683	True

Structure

InChI

InChI=1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,14H,5-6H2,1-2H3

InChIKey

Links

Gene (19 / 26)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
BOSS	Text Mining			CYP2C8
BOSS	Text Mining			MAOA
BOSS	Text Mining			MAOB
PubChem	None	uM		AHR	-	GI(Protien) :
PubChem	Potency	uM	9.200	ATAD5	-	GI(Protien) :
PubChem	IC50	uM		CBFB	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	3.981	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	15.849	HTT	-	GI(Protien) :
PubChem	None	uM		IL1B	-	GI(Protien) :
PubChem	None	uM		KLK7	-	GI(Protien) :
PubChem	None	uM		KLK7	-	GI(Protien) :
PubChem	None	uM		MAP4K2	-	GI(Protien) :
PubChem	None	uM		PREPL	-	GI(Protien) :
PubChem	None	uM		PSMD14	-	GI(Protien) :
PubChem	IC50	uM		RUNX1	-	GI(Protien) :
PubChem	None	uM		SLC5A7	-	GI(Protien) :
PubChem	None	uM		SLC5A7	-	GI(Protien) :
PubChem	Potency	uM	18.356	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	9200.000	ATAD5	-	Target : CHEMBL1741209
ChEMBL	Potency	nM	3981.100	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	39810.700	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	31622.800	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	25118.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	15848.900	HTT	-	Target : CHEMBL5514
ChEMBL	Potency	nM	14125.400	RECQL	-	Target : CHEMBL1293236

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