Tan Lab | DSigDB

Gene Set: D4 : TTD - (S)-Rolipram

Collection

D4 : TTD

Chemical Name

(S)-Rolipram ( From PubChem : ROLIPRAM )

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
275.343 g/mol	1	4	2.9489	True

Structure

InChI

InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m1/s1

InChIKey

Links

Gene (12 / 26)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			PDE4A		Clinical trial target
TTD	Inhibitor			PDE4A		Successful target
TTD	Inhibitor			PDE4B		Clinical trial target
TTD	Inhibitor			PDE4B		Research target
TTD	Inhibitor			PDE4C		Clinical trial target
TTD	Inhibitor			PDE4D		Clinical trial target
TTD	Inhibitor			PDE4D		Successful target
PubChem	None	uM		CFTR	-	GI(Protien) :
PubChem	IC50_CF-PAF_Mean	uM		CFTR	-	GI(Protien) :
PubChem	None	uM		CFTR	-	GI(Protien) :
PubChem	None	uM		DRD1	-	GI(Protien) :
PubChem	None	uM		DRD2	-	GI(Protien) :
PubChem	None	uM		DRD2	-	GI(Protien) :
PubChem	Potency	uM	0.046	GLP1R	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	39.811	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	None	uM		PDE4B	-	GI(Protien) :
ChEMBL	Inhibition	-		ADRB2	-	Target : CHEMBL210
ChEMBL	Potency	nM	28.200	CREBBP	-	Target : CHEMBL5747
ChEMBL	AC50	nM	3981.070	CYP1A2	-	Target : CHEMBL3356
ChEMBL	AC50	nM	2511.890	CYP1A2	-	Target : CHEMBL3356
ChEMBL	AC50	nM	3162.280	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	39810.700	CYP3A4	-	Target : CHEMBL340
ChEMBL	AC50	nM	39810.700	CYP3A4	-	Target : CHEMBL340

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