Tan Lab | DSigDB

Gene Set: D1 - Approved - SULFINPYRAZONE

Collection

D1 : Approved

Chemical Name

SULFINPYRAZONE

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
404.482 g/mol	0	5	4.7912	True

Structure

InChI

InChI=1S/C23H20N2O3S/c26-22-21(16-17-29(28)20-14-8-3-9-15-20)23(27)25(19-12-6-2-7-13-19)24(22)18-10-4-1-5-11-18/h1-15,21H,16-17H2/t29-/m0/s1

InChIKey

Links

Gene (11 / 23)

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Source	Type	Unit	Value	Gene	PMID	Other
PubChem		uM		ABCB1	-	GI(Protien) :
PubChem	Potency	uM	0.794	ALDH1A1	-	GI(Protien) :
PubChem	Potency	uM	12.589	CYP3A4	-	GI(Protien) :
PubChem	IC50_MICROM	uM	14.400	FPR1	-	GI(Protien) :
PubChem		uM		FPR1	-	GI(Protien) :
PubChem	Potency	uM	10.000	HPGD	-	GI(Protien) :
PubChem	Potency	uM	12.589	HPGD	-	GI(Protien) :
PubChem	Potency	uM	22.387	HPGD	-	GI(Protien) :
PubChem		uM		ITGA4	-	GI(Protien) :
PubChem		uM		ITGA4	-	GI(Protien) :
PubChem		uM		PRMT1	-	GI(Protien) :
PubChem		uM		PRMT1	-	GI(Protien) :
PubChem		uM		SLC22A12		GI(Protien) :
PubChem		uM		SLC22A12		GI(Protien) :
PubChem	Potency	uM	28.184	VDR	-	GI(Protien) :
ChEMBL	Potency	nM	794.300	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Potency	nM	12589.300	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	7079.500	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	22387.200	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	10000.000	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	12589.300	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	17782.800	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	28183.800	VDR	-	Target : CHEMBL1977

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