Tan Lab | DSigDB

Gene Set: D4 : CTD - 2-aminoethoxydiphenylborane

Collection

D4 : CTD

Chemical Name

2-aminoethoxydiphenylborane ( From PubChem : 2-AMINOETHYL DIPHENYLBORINATE )

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
225.094 g/mol	1	2	1.4679	True

Structure

InChI

InChI=1S/C14H16BNO/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12,16H2

InChIKey

Links

Gene (7 / 16)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(reaction)			CD28		C504876
CTD	increases(abundance)			CD28		C504876
PubChem	Potency	uM	0.631	ALOX15	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	12.589	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	16.360	TDP1	-	GI(Protien) :
PubChem	Potency	uM	10.000	VDR	-	GI(Protien) :
PubChem	Potency	uM	14.125	VDR	-	GI(Protien) :
PubChem	Potency	uM	17.783	VDR	-	GI(Protien) :
ChEMBL	Potency	nM	631.000	ALOX15	-	Target : CHEMBL2903
ChEMBL	Potency	nM	19952.600	ALOX15B	-	Target : CHEMBL2457
ChEMBL	AC50	nM	15848.900	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	12589.300	CYP3A4	-	Target : CHEMBL340
ChEMBL	AC50	nM	12589.200	CYP3A4	-	Target : CHEMBL340

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