Tan Lab | DSigDB

Gene Set: D1 - Approved - NEFAZODONE HYDROCHLORIDE

Collection

D1 : Approved

Chemical Name

NEFAZODONE HYDROCHLORIDE

FDA	NPC	WHO	Indian	Australia	China	Traditional Herbal	Clinical Trail
Approved	Not	Not	Not	Not	Not	Not	Not

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
506.468 g/mol	1	7	4.3568	False(3/4)

Structure

InChI

InChI=1S/C25H32ClN5O2.ClH/c1-2-24-27-31(25(32)30(24)18-19-33-23-10-4-3-5-11-23)13-7-12-28-14-16-29(17-15-28)22-9-6-8-21(26)20-22;/h3-6,8-11,20H,2,7,12-19H2,1H3;1H

InChIKey

DYCKFEBIOUQECE-UHFFFAOYSA-N

Links

Gene (12 / 21)

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Source	Type	Unit	Value	Gene	PMID	Other
PubChem	Potency	uM	9.521	AR	-	GI(Protien) :
PubChem	Potency	uM	11.883	AR	-	GI(Protien) :
PubChem	Potency	uM	18.834	AR	-	GI(Protien) :
PubChem	Potency	uM	21.314	AR	-	GI(Protien) :
PubChem	Potency	uM	29.849	CYP19A1	-	GI(Protien) :
PubChem	Potency	uM	33.492	CYP19A1	-	GI(Protien) :
PubChem		uM		DRD1	-	GI(Protien) :
PubChem		uM		DRD3	-	GI(Protien) :
PubChem	Potency	uM	7.498	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	8.096	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	18.834	ESR1	-	GI(Protien) :
PubChem	Potency	uM	26.603	ESR1	-	GI(Protien) :
PubChem		uM		HTR2A	-	GI(Protien) :
PubChem		uM		HTR2C	-	GI(Protien) :
PubChem	Potency	uM	16.360	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	26.832	NR3C1	-	GI(Protien) :
PubChem		uM		SLC6A2	-	GI(Protien) :
PubChem		uM		SLC6A4	-	GI(Protien) :
PubChem	Potency	uM	5.309	TDP1	-	GI(Protien) :
PubChem	Potency	uM	14.963	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	16360.100	NFE2L2	-	Target : CHEMBL1075094

Download gene sets

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