Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D05QCG
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| Former ID |
DNC003403
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| Drug Name |
N-[O-Phosphono-Pyridoxyl]-Isoleucine
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| Synonyms |
ILP; AC1L9K3U; (3S)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]-3-methylpentanoic acid
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C14H23N2O7P
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| Canonical SMILES |
CCC(C)C(C(=O)O)NCC1=C(C(=NC=C1COP(=O)(O)O)C)O
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| 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+/m1/s1
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| InChIKey |
GZZDWFDWHXPWJK-PELKAZGASA-N
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| PubChem Compound ID | ||||
| PubChem Substance ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Branched-chain-amino-acid transaminase 2 (BCAT2) | Target Info | Inhibitor | [1] |
| BioCyc | 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 | Top | |||
|---|---|---|---|---|
| REF 1 | How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6. | |||
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