Tan Lab | DSigDB

Gene Set: D4 : TTD - Fasudil

Collection

D4 : TTD

Chemical Name

Fasudil ( From PubChem : AT 877 )

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
291.369 g/mol	1	5	2.5663	True

Structure

InChI

InChI=1S/C14H17N3O2S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14/h1,3-5,7,11,15H,2,6,8-10H2

InChIKey

Links

Gene (8 / 18)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			ROCK1		Clinical trial target
PubChem	Potency	uM	0.200	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	12.589	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	AC50_uM	uM	0.837	PRKACA	-	GI(Protien) :
PubChem	AC50_uM	uM	1.558	PRKACA	-	GI(Protien) :
PubChem	AC50_uM	uM	5.980	STK33	-	GI(Protien) :
PubChem	AC50_uM	uM	9.440	STK33	-	GI(Protien) :
PubChem	AC50_uM	uM	12.600	STK33	-	GI(Protien) :
ChEMBL	AC50	nM	199.530	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	199.500	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	12589.200	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	12589.300	CYP3A4	-	Target : CHEMBL340
ChEMBL	AC50	nM	1558.000	PRKACA	-	Target : CHEMBL4101
ChEMBL	Inhibition	-		PRKACB	-	Target : CHEMBL2918
ChEMBL	Inhibition	-		PRKX	-	Target : CHEMBL5818
ChEMBL	Inhibition	-		ROCK2	-	Target : CHEMBL2973

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