Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0V7RG
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| Former ID |
DNC000073
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| Drug Name |
4-substituted 2,4-dioxobutanoic acids
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| Synonyms |
Guvacine; 1,2,5,6-tetrahydropyridine-3-carboxylic acid; 498-96-4; 1,2,5,6-Tetrahydro-3-pyridinecarboxylic acid; UNII-41538P325K; 1,2,5,6-Tetrahydronicotinic acid; CHEBI:5576; 1,2,3,6-tetrahydropyridine-5-carboxylic acid; 41538P325K; 1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid; MLS000859975; SMR000326834; Spectrum_001426; Tocris-0234; SpecPlus_000808; Lopac-G-007; AC1Q5RCN; Spectrum2_001474; Spectrum4_001753; Spectrum3_001511; Spectrum5_000606; Biomol-NT_000253; C10149; AC1L1G5E; Lopac0_000571; BSPBio_003181; KBioSS_001906
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1], [2] | |
| Structure |
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Download2D MOL |
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| Formula |
C6H9NO2
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| Canonical SMILES |
C1CNCC(=C1)C(=O)O
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| InChI |
1S/C6H9NO2/c8-6(9)5-2-1-3-7-4-5/h2,7H,1,3-4H2,(H,8,9)
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| InChIKey |
QTDZOWFRBNTPQR-UHFFFAOYSA-N
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| CAS Number |
CAS 498-96-4
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| PubChem Compound ID | ||||
| PubChem Substance ID |
12335, 7404166, 8152236, 11111208, 11113419, 11342079, 11362262, 11364320, 11366882, 11369444, 11372780, 11375364, 11377606, 11485163, 11487664, 11489290, 11491326, 11493567, 11495240, 11537685, 15242887, 26751657, 29222664, 47216949, 47589156, 47662482, 47736669, 47959948, 50104352, 57321859, 79857638, 90270526, 90340745, 103092316, 103153356, 103276025, 103917585, 104303791, 117542420, 124749820, 124880171, 124880172, 124880173, 125607225, 126688864, 126736933, 128992155, 129071653, 132565147, 134339610
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| ChEBI ID |
CHEBI:5576
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | CAP-dependent endonuclease (CDE) | Target Info | Inhibitor | [1] |
| Gamma-aminobutyric acid uptake (GABAU) | Target Info | Inhibitor | [3] | |
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Anti-influenza virus activities of 4-substituted 2,4-dioxobutanoic acid inhibitors. Antimicrob Agents Chemother. 1996 May;40(5):1304-7. | |||
| REF 2 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 4691). | |||
| REF 3 | GABA uptake inhibitors. Design, molecular pharmacology and therapeutic aspects. Curr Pharm Des. 2000 Aug;6(12):1193-209. | |||
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