Tan Lab | DSigDB

Gene Set: D4 : CTD - phenylmethylpyrazolone

Collection

D4 : CTD

Chemical Name

phenylmethylpyrazolone ( From PubChem : EDARAVONE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
174.199 g/mol	0	3	1.2998	True

Structure

InChI

InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3

InChIKey

QELUYTUMUWHWMC-UHFFFAOYSA-N

Links

Gene (25 / 47)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(binding)			HIF1A		C005435
CTD	decreases(reaction)			HIF1A		C005435
CTD	affects(expression)			HIF1A		C005435
CTD	increases(expression)			HIF1A		C005435
CTD	affects(cotreatment)			IL1B		C005435
CTD	decreases(reaction)			IL1B		C005435
CTD	increases(expression)			IL1B		C005435
CTD	decreases(activity)			IL1B		C005435
CTD	increases(phosphorylation)			MAPK8		C005435
CTD	decreases(reaction)			NGF		C005435
CTD	increases(expression)			NGF		C005435
CTD	decreases(degradation)			NOS3		C005435
CTD	affects(binding)			VEGFA		C005435
CTD	decreases(reaction)			VEGFA		C005435
CTD	affects(binding)			VEGFA		C005435
CTD	affects(expression)			VEGFA		C005435
CTD	decreases(reaction)			VEGFA		C005435
CTD	increases(expression)			VEGFA		C005435
PubChem	Potency-Replicate_1	uM	10.871	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	16.053	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	20.087	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	26.603	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	30.825	AHR	-	GI(Protien) :
PubChem	Potency	uM	5.012	ALDH1A1	-	GI(Protien) :
PubChem	Potency	uM	10.000	ALDH1A1	-	GI(Protien) :
PubChem	None	uM		APAF1	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	25.119	CYP3A4	-	GI(Protien) :
PubChem	None	uM		GSTO1	-	GI(Protien) :
PubChem	None	uM		MBD2	-	GI(Protien) :
PubChem	None	uM		PADI4	-	GI(Protien) :
PubChem	None	uM		PLCG1	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :
PubChem	None	uM		PSIP1	-	GI(Protien) :
PubChem	None	uM		ROCK2	-	GI(Protien) :
PubChem	IC50	uM		SAE1	-	GI(Protien) :
PubChem	None	uM		SENP8	-	GI(Protien) :
PubChem	None	uM		TDP2	-	GI(Protien) :
PubChem	IC50	uM		UBA2	-	GI(Protien) :
PubChem	IC50	uM		UBE2I	-	GI(Protien) :
PubChem	None	uM		VCP	-	GI(Protien) :
PubChem	Potency	uM	3.981	VDR	-	GI(Protien) :
ChEMBL	Potency	nM	5011.900	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Potency	nM	10000.000	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	AC50	nM	12589.200	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	25118.900	CYP3A4	-	Target : CHEMBL340

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