Drug General Information
Drug ID
D0A9WP
Former ID
DNC000791
Drug Name
Immucillin-G
Drug Type
Small molecular drug
Indication Discovery agent Investigative [535761]
Structure
Download
2D MOL

3D MOL

Formula
C11H15N5O4
Canonical SMILES
C1=C(C2=C(N1)C(=O)N=C(N2)N)C3C(C(C(N3)CO)O)O
InChI
1S/C11H15N5O4/c12-11-15-5-3(1-13-7(5)10(20)16-11)6-9(19)8(18)4(2-17)14-6/h1,4,6,8-9,13-14,17-19H,2H2,(H3,12,15,16,20)/t4-,6+,8+,9-/m1/s1
InChIKey
KBIDJCVAURJXFG-QDBWXMFUSA-N
CAS Number
CAS 1110-47-0
PubChem Compound ID
PubChem Substance ID
SuperDrug ATC ID
J01CE01
SuperDrug CAS ID
cas=000061336
Target and Pathway
Target(s) Purine nucleoside phosphorylase Target Info Inhibitor [535761]
BioCyc Pathway Arsenate detoxification I (glutaredoxin)
Purine nucleotides degradation
Urate biosynthesis/inosine 5'-phosphate degradation
Purine deoxyribonucleosides degradation
Purine ribonucleosides degradation to ribose-1-phosphate
Guanosine nucleotides degradation
Adenosine nucleotides degradation
Superpathway of purine nucleotide salvage
Adenine and adenosine salvage III
Guanine and guanosine salvage
KEGG Pathway Purine metabolism
Pyrimidine metabolism
Nicotinate and nicotinamide metabolism
Metabolic pathways
NetPath Pathway TCR Signaling Pathway
EGFR1 Signaling Pathway
PANTHER Pathway Adenine and hypoxanthine salvage pathway
Xanthine and guanine salvage pathway
PathWhiz Pathway Purine Metabolism
Nicotinate and Nicotinamide Metabolism
Reactome Purine salvage
Purine catabolism
WikiPathways miR-targeted genes in squamous cell - TarBase
miR-targeted genes in lymphocytes - TarBase
miR-targeted genes in leukocytes - TarBase
miR-targeted genes in epithelium - TarBase
Metabolism of nucleotides
References
Ref 535761Exploring structure-activity relationships of transition state analogues of human purine nucleoside phosphorylase. J Med Chem. 2003 Jul 17;46(15):3412-23.
Ref 535761Exploring structure-activity relationships of transition state analogues of human purine nucleoside phosphorylase. J Med Chem. 2003 Jul 17;46(15):3412-23.

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