Tan Lab | DSigDB

Gene Set: D4 : CTD - Ticlopidine

Collection

D4 : CTD

Chemical Name

Ticlopidine ( From PubChem : TICLOPIDINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
263.786 g/mol	0	2	3.8977	True

Structure

InChI

InChI=1S/C14H14ClNS/c15-13-4-2-1-3-11(13)9-16-7-5-14-12(10-16)6-8-17-14/h1-4,6,8H,5,7,9-10H2

InChIKey

PHWBOXQYWZNQIN-UHFFFAOYSA-N

Links

Gene (18 / 67)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(activity)			ABCB11		D013988
CTD	decreases(activity)			ABCC2		D013988
CTD	increases(activity)			CASP3		D013988
CTD	increases(reaction)			CASP3		D013988
CTD	increases(activity)			CASP7		D013988
CTD	increases(reaction)			CASP7		D013988
CTD	increases(cleavage)			CYP1A2		D013988
CTD	increases(oxidation)			CYP1A2		D013988
CTD	decreases(reaction)			CYP1A2		D013988
CTD	increases(oxidation)			CYP1A2		D013988
CTD	decreases(activity)			CYP1A2		D013988
CTD	affects(metabolic processing)			CYP2B6		D013988
CTD	decreases(reaction)			CYP2B6		D013988
CTD	decreases(reaction)			CYP2B6		D013988
CTD	increases(metabolic processing)			CYP2B6		D013988
CTD	decreases(activity)			CYP2B6		D013988
CTD	increases(cleavage)			CYP2C19		D013988
CTD	increases(oxidation)			CYP2C19		D013988
CTD	decreases(reaction)			CYP2C19		D013988
CTD	increases(hydroxylation)			CYP2C19		D013988
CTD	decreases(reaction)			CYP2C19		D013988
CTD	increases(metabolic processing)			CYP2C19		D013988
CTD	decreases(reaction)			CYP2C19		D013988
CTD	increases(oxidation)			CYP2C19		D013988
CTD	decreases(activity)			CYP2C19		D013988
CTD	increases(cleavage)			CYP2C8		D013988
CTD	increases(oxidation)			CYP2C8		D013988
CTD	increases(cleavage)			CYP2C9		D013988
CTD	increases(oxidation)			CYP2C9		D013988
CTD	increases(cleavage)			CYP2D6		D013988
CTD	increases(oxidation)			CYP2D6		D013988
CTD	decreases(activity)			CYP2D6		D013988
CTD	increases(degradation)			CYP3A4		D013988
CTD	increases(cleavage)			CYP3A4		D013988
CTD	increases(oxidation)			CYP3A4		D013988
CTD	increases(response to substance)			CYP3A4		D013988
CTD	decreases(reaction)			CYP3A4		D013988
CTD	increases(oxidation)			CYP3A4		D013988
CTD	increases(reaction)			CYP3A4		D013988
CTD	increases(cleavage)			CYP3A5		D013988
CTD	increases(oxidation)			CYP3A5		D013988
CTD	affects(cotreatment)			HMOX1		D013988
CTD	decreases(reaction)			HMOX1		D013988
CTD	increases(expression)			HMOX1		D013988
CTD	increases(reaction)			HMOX1		D013988
CTD	affects(expression)			THBS1		D013988
CTD	increases(expression)			UGT1A1		D013988
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	0.040	CYP2C19	-	GI(Protien) :
PubChem	None	uM		CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	0.398	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	11.883	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	21.293	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.891	ESR1	-	GI(Protien) :
PubChem	None	uM		MAP3K3	-	GI(Protien) :
PubChem	None	uM		MAP4K2	-	GI(Protien) :
ChEMBL	Inhibition	-		CYP1A2	-	Target : CHEMBL3356
ChEMBL	AC50	nM	501.190	CYP1A2	-	Target : CHEMBL3356
ChEMBL	AC50	nM	39.810	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Potency	nM	39.800	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Inhibition	-		CYP2C9	-	Target : CHEMBL3397
ChEMBL	AC50	nM	398.110	CYP2D6	-	Target : CHEMBL289
ChEMBL	Inhibition	-		CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	398.100	CYP2D6	-	Target : CHEMBL289
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340

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