EcoDrugPlus


Trade Names	DILOR DILOR-400 LUFYLLIN NEOTHYLLINE
Synonyms	Dilor Dilor-400 Diprophylline Dyphilline Dyphylline Glyphylline Lufyllin NSC-14305 Neothylline
Status
Molecule Category	Free-form
UNII	263T0E9RR9
EPA CompTox	DTXSID6022975


InChI Key	KSCFJBIXMNOVSH-UHFFFAOYSA-N
Smiles	Cn1c(=O)c2c(ncn2CC(O)CO)n(C)c1=O
InChI	InChI=1S/C10H14N4O4/c1-12-8-7(9(17)13(2)10(12)18)14(5-11-8)3-6(16)4-15/h5-6,15-16H,3-4H2,1-2H3

Property Name	Value
Molecular Formula	C10H14N4O4
Molecular Weight	254.25
AlogP	-2.21
Hydrogen Bond Acceptor	8.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	3.0
Polar Surface Area	102.28
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	18.0

Mechanism of Action	Action	Reference
Phosphodiesterase 3A inhibitor	INHIBITOR	PubMed DailyMed

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides	-	-	-	-	92.75-94.34

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Cricetulus griseus	-	-	-	-	92.75-94.34

Target Conservation

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A

Organism : Homo sapiens

Query Gene : ENSG00000065989

Target Name : Phosphodiesterase 4

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B

Organism : Homo sapiens

Query Gene : ENSG00000184588

Target Name : Phosphodiesterase 4

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C

Organism : Homo sapiens

Query Gene : ENSG00000105650

Target Name : Phosphodiesterase 4

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Protein : Phosphodiesterase 4

Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D

Organism : Homo sapiens

Query Gene : ENSG00000113448

Target Name : Phosphodiesterase 4

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Protein : Phosphodiesterase 3A

Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A

Organism : Homo sapiens

Query Gene : ENSG00000172572

Target Name : Phosphodiesterase 3A

Organism : Homo sapiens


Protein: Phosphodiesterase 4 Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4A Organism : Homo sapiens P27815 ENSG00000065989











Protein: Phosphodiesterase 4 Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4B Organism : Homo sapiens Q07343 ENSG00000184588













Protein: Phosphodiesterase 4 Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4C Organism : Homo sapiens Q08493 ENSG00000105650








Protein: Phosphodiesterase 4 Description: cAMP-specific 3',5'-cyclic phosphodiesterase 4D Organism : Homo sapiens Q08499 ENSG00000113448












Protein: Phosphodiesterase 3A Description: cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A Organism : Homo sapiens Q14432 ENSG00000172572

Resources	Reference
CAS NUMBER	479-18-5
ChEBI	4728
ChEMBL	CHEMBL1752
DrugBank	DB00651
DrugCentral	976
FDA SRS	263T0E9RR9
Human Metabolome Database	HMDB0014789
Guide to Pharmacology	7070
KEGG	C07819
PharmGKB	PA164748027
PubChem	3182
SureChEMBL	SCHEMBL8192
ZINC	ZINC00057147

DYPHYLLINE

Structure

Physicochemical Descriptors

Pharmacology

Target Conservation

Related Entries

Cross References