Tan Lab | DSigDB

Gene Set: D4 : TTD - Oxatomide

Collection

D4 : TTD

Chemical Name

Oxatomide ( From PubChem : OXATOMIDE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
426.553 g/mol	1	4	4.0027	True

Structure

InChI

InChI=1S/C27H30N4O/c32-27-28-24-14-7-8-15-25(24)31(27)17-9-16-29-18-20-30(21-19-29)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,26H,9,16-21H2,(H,28,32)

InChIKey

BAINIUMDFURPJM-UHFFFAOYSA-N

Links

Gene (12 / 26)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Antagonist			HRH1		Successful target
TTD	Drug(s)			HRH1		Successful target
PubChem	Ratio Potency (uM)	uM	25.822	AR	-	GI(Protien) :
PubChem	AR Potency (uM)	uM	32.230	AR	-	GI(Protien) :
PubChem	EC50_1	uM	5.150	CACNA1H	-	GI(Protien) :
PubChem	None	uM		CACNA1H	-	GI(Protien) :
PubChem	None	uM		CACNA1H	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	0.794	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	15.849	CYP3A4	-	GI(Protien) :
PubChem	None	uM		DRD1	-	GI(Protien) :
PubChem	None	uM		DRD2	-	GI(Protien) :
PubChem	Potency	uM	10.000	HIF1A	-	GI(Protien) :
PubChem	Potency	uM	25.119	HIF1A	-	GI(Protien) :
PubChem	Potency	uM	3.548	KCNH2		GI(Protien) :
PubChem	Potency	uM	3.548	KCNH2		GI(Protien) :
PubChem	None	uM		NR3C1	-	GI(Protien) :
PubChem	Potency	uM	7.499	TDP1	-	GI(Protien) :
PubChem	Potency	uM	7.499	TDP1	-	GI(Protien) :
ChEMBL	EC50	nM	5150.000	CACNA1H	-	Target : CHEMBL1859
ChEMBL	AC50	nM	794.330	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	794.300	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	15848.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	10000.000	HIF1A	-	Target : CHEMBL4261
ChEMBL	Potency	nM	25118.900	HIF1A	-	Target : CHEMBL4261

Download gene sets

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