Tan Lab | DSigDB

Gene Set: D4 : CTD - alpha-pentyl-3-(2-quinolinylmethoxy)benzenemethanol

Collection

D4 : CTD

Chemical Name

alpha-pentyl-3-(2-quinolinylmethoxy)benzenemethanol ( From PubChem : REV 5901 )

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
335.439 g/mol	1	3	5.4275	False(3/4)

Structure

InChI

InChI=1S/C22H25NO2/c1-2-3-4-12-22(24)18-9-7-10-20(15-18)25-16-19-14-13-17-8-5-6-11-21(17)23-19/h5-11,13-15,22,24H,2-4,12,16H2,1H3/t22-/m0/s1

InChIKey

Links

Gene (11 / 20)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(activity)			ALOX5		C049740
CTD	affects(binding)			CYSLTR1		C049740
CTD	decreases(reaction)			CYSLTR1		C049740
CTD	increases(activity)			CYSLTR1		C049740
CTD	decreases(activity)			CYSLTR1		C049740
CTD	decreases(reaction)			IL1B		C049740
CTD	increases(expression)			IL1B		C049740
CTD	increases(reaction)			INS		C049740
CTD	increases(secretion)			INS		C049740
CTD	decreases(reaction)			PTGS2		C049740
CTD	increases(expression)			PTGS2		C049740
PubChem	Potency	uM	14.125	HPGD	-	GI(Protien) :
PubChem	Potency	uM	14.581	IDH1	-	GI(Protien) :
PubChem	None	uM		KCNK3	-	GI(Protien) :
PubChem	None	uM		KCNK9	-	GI(Protien) :
PubChem	None	uM		KCNK9	-	GI(Protien) :
PubChem	None	uM		KCNK9	-	GI(Protien) :
PubChem	None	uM		KCNQ1	-	GI(Protien) :
ChEMBL	Potency	nM	14125.400	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	28183.800	RECQL	-	Target : CHEMBL1293236

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