Tan Lab | DSigDB

Gene Set: D4 : CTD - 6-methyl-2-(phenylethynyl)pyridine

Collection

D4 : CTD

Chemical Name

6-methyl-2-(phenylethynyl)pyridine ( From PubChem : MPEP )

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
193.244 g/mol	0	1	2.7898	True

Structure

InChI

InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3

InChIKey

Links

Gene (16 / 27)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(activity)			CYP1A2		C121465
CTD	affects(binding)			GRM5		C121465
CTD	decreases(reaction)			GRM5		C121465
PubChem	Potency	uM	8.196	ATAD5	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	10.000	CYP2C9	-	GI(Protien) :
PubChem	Potency	uM	19.953	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	5.805	NPC1	-	GI(Protien) :
PubChem	Potency	uM	2.909	PARK2	-	GI(Protien) :
PubChem	Potency	uM	25.119	PKM	-	GI(Protien) :
PubChem	Potency	uM	5.012	RAB9A	-	GI(Protien) :
PubChem	Potency	uM	12.589	SMN2	-	GI(Protien) :
PubChem	Potency	uM	29.855	TDP1	-	GI(Protien) :
PubChem	Potency	uM	1.000	THPO	-	GI(Protien) :
PubChem	Potency	uM	12.589	TP53	-	GI(Protien) :
ChEMBL	Potency	nM	8196.100	ATAD5	-	Target : CHEMBL1741209
ChEMBL	Potency	nM	7943.300	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Potency	nM	10000.000	CYP2C9	-	Target : CHEMBL3397
ChEMBL	Potency	nM	19952.600	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	12589.300	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	5804.800	NPC1	-	Target : CHEMBL1293277
ChEMBL	Potency	nM	25118.900	PKM	-	Target : CHEMBL1075189
ChEMBL	Potency	nM	5011.900	RAB9A	-	Target : CHEMBL1293294
ChEMBL	Potency	nM	12589.300	SMN1; SMN2	-	Target : CHEMBL1293232
ChEMBL	Potency	nM	1000.000	THPO	-	Target : CHEMBL1293256
ChEMBL	Potency	nM	12589.300	TP53	-	Target : CHEMBL4096

Download gene sets