PCIDB

KNApSAcK Metabolite C00043196

Metabolite

KNApSAcK Entry

id C00043196
Name 3-Methylxanthine
CAS RN 1076-22-8
Standard InChI InChI=1S/C6H6N4O2/c1-10-4-3(7-2-8-4)5(11)9-6(10)12/h2H,1H3,(H,7,8)(H,9,11,12)
Standard InChI (Main Layer) InChI=1S/C6H6N4O2/c1-10-4-3(7-2-8-4)5(11)9-6(10)12/h2H,1H3,(H,7,8)(H,9,11,12)

Cluster

Phytochemical cluster No. 12
KCF-S cluster No. 2266

Link

ChEMBL

By standard InChI CHEMBL619
By standard InChI Main Layer CHEMBL619

KEGG

By LinkDB C16357

CTD

By CAS RN C029703

Species

Summary

Plant class

class name count

Family

family name count
Styelidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Symplegma rubra 581062 Styelidae Metazoa

Human Protein / Gene in interaction

6 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P29274 Adenosine receptor A2a Adenosine receptor CHEMBL619 CHEMBL642334 (1) CHEMBL640346 (1)
CHEMBL680424 (1)
0 / 0
Q08493 cAMP-specific 3',5'-cyclic phosphodiesterase 4C PDE_4C CHEMBL619 CHEMBL821509 (1)
0 / 0
Q07343 cAMP-specific 3',5'-cyclic phosphodiesterase 4B PDE_4B CHEMBL619 CHEMBL821509 (1)
0 / 0
P27815 cAMP-specific 3',5'-cyclic phosphodiesterase 4A PDE_4A CHEMBL619 CHEMBL821509 (1)
0 / 0
Q08499 cAMP-specific 3',5'-cyclic phosphodiesterase 4D PDE_4D CHEMBL619 CHEMBL821509 (1)
1 / 0
P29275 Adenosine receptor A2b Adenosine receptor CHEMBL619 CHEMBL642334 (1) CHEMBL640346 (1)
0 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (1)

OMIM preferred title UniProt
#614613 Acrodysostosis 2, with or without hormone resistance; acrdys2 Q08499

Diseases related to CTD interactions

1 disease from interactions of metabolites

MeSH disease OMIM compound disease name evidence type reference
pmid
D012640 C029703 Seizures marker/mechanism
8799489