Tan Lab | DSigDB

Gene Set: D4 : CTD - N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-N-(2-pyridinyl)cyclohexanecarboxamide

Collection

D4 : CTD

Chemical Name

N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-N-(2-pyridinyl)cyclohexanecarboxamide ( From PubChem : WAY-100635 )

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
422.563 g/mol	0	6	3.8286	True

Structure

InChI

InChI=1S/C25H34N4O2/c1-31-23-12-6-5-11-22(23)28-18-15-27(16-19-28)17-20-29(24-13-7-8-14-26-24)25(30)21-9-3-2-4-10-21/h5-8,11-14,21H,2-4,9-10,15-20H2,1H3

InChIKey

SBPRIAGPYFYCRT-UHFFFAOYSA-N

Links

Gene (2 / 12)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(binding)			HTR1A		C090413
CTD	decreases(reaction)			HTR1A		C090413
CTD	increases(activity)			HTR1A		C090413
CTD	affects(binding)			HTR1A		C090413
CTD	decreases(activity)			HTR1A		C090413
PubChem	Potency	uM	3.981	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	None	uM		HTR1A		GI(Protien) :
PubChem	None	uM		HTR1A		GI(Protien) :
PubChem	None	uM		HTR1A		GI(Protien) :
ChEMBL	AC50	nM	3981.070	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	3981.100	CYP3A4	-	Target : CHEMBL340

Download gene sets

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Contact us
Tan Lab , Mail Stop 8117
12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA

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