Tan Lab | DSigDB

Gene Set: D4 : TTD - Bifonazole

Collection

D4 : TTD

Chemical Name

Bifonazole ( From PubChem : BIFONAZOLE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
310.392 g/mol	0	2	5.1878	False(3/4)

Structure

InChI

InChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H/t22-/m1/s1

InChIKey

Links

Gene (19 / 33)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			CYP51A1		Successful target
TTD	Drug(s)			CYP51A1		Successful target
PubChem	Potency-Replicate_1	uM	1.059	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	5.108	AHR	-	GI(Protien) :
PubChem	None	uM		AHR	-	GI(Protien) :
PubChem	Potency	uM	22.387	ALDH1A1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	23.014	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.915	AR	-	GI(Protien) :
PubChem	IC50_Mean	uM	8.500	ATG4B	-	GI(Protien) :
PubChem	None	uM		ATG4B	-	GI(Protien) :
PubChem	None	uM		ATG4B	-	GI(Protien) :
PubChem	Potency	uM	19.953	BAZ2B	-	GI(Protien) :
PubChem	Potency	uM	25.119	BAZ2B	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.750	CYP19A1	-	GI(Protien) :
PubChem	None	uM		CYP19A1	-	GI(Protien) :
PubChem	Potency	uM	10.322	GMNN	-	GI(Protien) :
PubChem	AC50_uM	uM	1.064	HSP90AA1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	17.441	HSPB1	-	GI(Protien) :
PubChem	None	uM		LYPLA2	-	GI(Protien) :
PubChem	None	uM		NPBWR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	18.832	NR1H4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.915	NR3C1	-	GI(Protien) :
PubChem	IC50_Mean	uM	8.890	PLA2G1B	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	26.601	PPARD	-	GI(Protien) :
PubChem	None	uM		PPP1CA	-	GI(Protien) :
PubChem	Potency	uM	10.322	TDP1	-	GI(Protien) :
PubChem	Potency	uM	23.109	TDP1	-	GI(Protien) :
PubChem	Potency	uM	23.715	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	22387.200	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	IC50	nM	8500.000	ATG4B	-	Target : CHEMBL1741221
ChEMBL	Potency	nM	25118.900	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Potency	nM	19952.600	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Potency	nM	25118.900	KDM4A	-	Target : CHEMBL5896

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