Drug Information

Drug General Information
Drug ID
D0C2FS
Former ID
DNC003944
Drug Name
2-(2-Mercapto-ethyl)-pentanedioic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [526615]
Formula
C7H12O4S
Canonical SMILES
C(CC(=O)O)C(CCS)C(=O)O
InChI
1S/C7H12O4S/c8-6(9)2-1-5(3-4-12)7(10)11/h5,12H,1-4H2,(H,8,9)(H,10,11)
InChIKey
SMGZBRVSYVJHCB-UHFFFAOYSA-N
PubChem Compound ID
9794137
Target and Pathway
Target(s) Glutamate carboxypeptidase II Target Info Inhibitor [526615]
KEGG Pathway Alanine, aspartate and glutamate metabolism
Metabolic pathways
Vitamin digestion and absorption
NetPath Pathway TCR Signaling Pathway
TNFalpha Signaling Pathway
Reactome Amino acid synthesis and interconversion (transamination)
WikiPathways One Carbon Metabolism
References
Ref 526615J Med Chem. 2003 May 8;46(10):1989-96.Synthesis and biological evaluation of thiol-based inhibitors of glutamate carboxypeptidase II: discovery of an orally active GCP II inhibitor.
Ref 526615J Med Chem. 2003 May 8;46(10):1989-96.Synthesis and biological evaluation of thiol-based inhibitors of glutamate carboxypeptidase II: discovery of an orally active GCP II inhibitor.

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