Drug General Information
Drug ID
D05QCG
Former ID
DNC003403
Drug Name
N-[O-Phosphono-Pyridoxyl]-Isoleucine
Drug Type
Small molecular drug
Indication Discovery agent Investigative [551393]
Structure
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2D MOL

3D MOL

Formula
C14H23N2O7P
Canonical SMILES
CCC(C)C(C(=O)O)NCC1=C(C(=NC=C1COP(=O)(O)O)C)O
InChI
1S/C14H23N2O7P/c1-4-8(2)12(14(18)19)16-6-11-10(7-23-24(20,21)22)5-15-9(3)13(11)17/h5,8,12,16-17H,4,6-7H2,1-3H3,(H,18,19)(H2,20,21,22)/t8-,12?/m0/s1
InChIKey
GZZDWFDWHXPWJK-KBPLZSHQSA-N
PubChem Compound ID
PubChem Substance ID
Target and Pathway
Target(s) Branched chain amino acid-dependent aminotransferase Target Info Inhibitor [551393]
BioCyc Pathway Leucine degradation
Valine degradation
Isoleucine degradation
KEGG Pathway Valine, leucine and isoleucine degradation
Valine, leucine and isoleucine biosynthesis
Pantothenate and CoA biosynthesis
Metabolic pathways
Biosynthesis of antibiotics
2-Oxocarboxylic acid metabolism
Biosynthesis of amino acids
PANTHER Pathway Alanine biosynthesis
Isoleucine biosynthesis
Leucine biosynthesis
Valine biosynthesis
WikiPathways Metabolism of amino acids and derivatives
References
Ref 551393How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6.
Ref 551393How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6.

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