N-hydroxy-4-phosphonobutanamide: structure given in first source [Medical Subject Headings (MeSH), National Library of Medicine, extracted Dec-2023]
| ID Source | ID |
|---|---|
| PubMed CID | 126892 |
| CHEMBL ID | 1161784 |
| SCHEMBL ID | 3190877 |
| MeSH ID | M0217856 |
| Synonym |
|---|
| 4PB , |
| 1TSI , |
| CHEMBL1161784 , |
| [4-(hydroxyamino)-4-oxobutyl]phosphonic acid |
| bdbm50379999 |
| 6y7zle6wcn , |
| 4pbh |
| 146086-80-8 |
| unii-6y7zle6wcn |
| n-hydroxy-4-phosphonobutanamide |
| phosphonic acid, (4-(hydroxyamino)-4-oxobutyl)- |
| SCHEMBL3190877 |
| DTXSID20163267 |
| 4-(hydroxyamino)-4-oxobutylphosphonic acid |
| p-(4-(hydroxyamino)-4-oxobutyl)phosphonic acid |
| phosphonic acid, p-(4-(hydroxyamino)-4-oxobutyl)- |
| Protein | Taxonomy | Measurement | Average | Min (ref.) | Avg (ref.) | Max (ref.) | Bioassay(s) |
|---|---|---|---|---|---|---|---|
| Chain A, Triosephosphate Isomerase | Trypanosoma brucei brucei | Ki | 330.0000 | 330.0000 | 330.0000 | 330.0000 | AID977610 |
| 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Mycolicibacterium smegmatis MC2 155 | IC50 (µMol) | 1.4800 | 0.0800 | 0.5975 | 1.4800 | AID653489 |
| 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 | IC50 (µMol) | 0.2570 | 0.0200 | 0.7421 | 3.5000 | AID243156 |
| [prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023] | |||||||
| Process | via Protein(s) | Taxonomy |
|---|---|---|
| isopentenyl diphosphate biosynthetic process, methylerythritol 4-phosphate pathway | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| isoprenoid biosynthetic process | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| isopentenyl diphosphate biosynthetic process, methylerythritol 4-phosphate pathway | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| isopentenyl diphosphate biosynthetic process, methylerythritol 4-phosphate pathway involved in terpenoid biosynthetic process | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| [Information is prepared from geneontology information from the June-17-2024 release] | ||
| Process | via Protein(s) | Taxonomy |
|---|---|---|
| oxidoreductase activity | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| manganese ion binding | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| 1-deoxy-D-xylulose-5-phosphate reductoisomerase activity | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| identical protein binding | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| metal ion binding | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| NADPH binding | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| [Information is prepared from geneontology information from the June-17-2024 release] | ||
| Process | via Protein(s) | Taxonomy |
|---|---|---|
| Dxr protein complex | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | Escherichia coli K-12 |
| [Information is prepared from geneontology information from the June-17-2024 release] | ||
| Assay ID | Title | Year | Journal | Article |
|---|---|---|---|---|
| AID977610 | Experimentally measured binding affinity data (Ki) for protein-ligand complexes derived from PDB | 1992 | Protein science : a publication of the Protein Society, Dec, Volume: 1, Issue:12 | Structure of the complex between trypanosomal triosephosphate isomerase and N-hydroxy-4-phosphono-butanamide: binding at the active site despite an "open" flexible loop conformation. |
| AID1811 | Experimentally measured binding affinity data derived from PDB | 1992 | Protein science : a publication of the Protein Society, Dec, Volume: 1, Issue:12 | Structure of the complex between trypanosomal triosephosphate isomerase and N-hydroxy-4-phosphono-butanamide: binding at the active site despite an "open" flexible loop conformation. |
| AID653492 | Antimycobacterial activity against Mycobacterium smegmatis at 400 nmol/disc after 24 hrs by paper disc diffusion method | 2012 | European journal of medicinal chemistry, May, Volume: 51 | Growth inhibition of Mycobacterium smegmatis by prodrugs of deoxyxylulose phosphate reducto-isomerase inhibitors, promising anti-mycobacterial agents. |
| AID653489 | Inhibition of Mycobacterium smegmatis DSM 43756 ATCC 19420 N-terminal his-tagged DXR expressed in XL1-blue Escherichia coli using NADPH and DXP as substrate preincubated for 2 mins with substrate before compound addition | 2012 | European journal of medicinal chemistry, May, Volume: 51 | Growth inhibition of Mycobacterium smegmatis by prodrugs of deoxyxylulose phosphate reducto-isomerase inhibitors, promising anti-mycobacterial agents. |
| AID1334846 | Growth inhibition of Mycobacterium smegmatis incubated overnight by paper disc diffusion method | 2017 | Bioorganic & medicinal chemistry, 01-15, Volume: 25, Issue:2 | Synthesis and biological evaluation of phosphate isosters of fosmidomycin and analogs as inhibitors of Escherichia coli and Mycobacterium smegmatis 1-deoxyxylulose 5-phosphate reductoisomerases. |
| AID1334844 | Growth inhibition of fosmidomycin resistant Escherichia coli incubated overnight by paper disc diffusion method | 2017 | Bioorganic & medicinal chemistry, 01-15, Volume: 25, Issue:2 | Synthesis and biological evaluation of phosphate isosters of fosmidomycin and analogs as inhibitors of Escherichia coli and Mycobacterium smegmatis 1-deoxyxylulose 5-phosphate reductoisomerases. |
| AID243156 | Inhibitory concentration against DOXP reductoisomerase | 2005 | Journal of medicinal chemistry, May-19, Volume: 48, Issue:10 | AFMoC enhances predictivity of 3D QSAR: a case study with DOXP-reductoisomerase. |
| AID1334837 | Inhibition of Escherichia coli His6-tagged DXR preincubated for 2 mins in presence of NADPH followed by DXP substrate addition | 2017 | Bioorganic & medicinal chemistry, 01-15, Volume: 25, Issue:2 | Synthesis and biological evaluation of phosphate isosters of fosmidomycin and analogs as inhibitors of Escherichia coli and Mycobacterium smegmatis 1-deoxyxylulose 5-phosphate reductoisomerases. |
| AID1334840 | Growth inhibition of Escherichia coli XL1 blue at 400 nmol/disc incubated overnight by paper disc diffusion method | 2017 | Bioorganic & medicinal chemistry, 01-15, Volume: 25, Issue:2 | Synthesis and biological evaluation of phosphate isosters of fosmidomycin and analogs as inhibitors of Escherichia coli and Mycobacterium smegmatis 1-deoxyxylulose 5-phosphate reductoisomerases. |
| [information is prepared from bioassay data collected from National Library of Medicine (NLM), extracted Dec-2023] | ||||
| Timeframe | Studies, This Drug (%) | All Drugs % |
|---|---|---|
| pre-1990 | 0 (0.00) | 18.7374 |
| 1990's | 1 (16.67) | 18.2507 |
| 2000's | 2 (33.33) | 29.6817 |
| 2010's | 3 (50.00) | 24.3611 |
| 2020's | 0 (0.00) | 2.80 |
| [information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023] | ||
According to the monthly volume, diversity, and competition of internet searches for this compound, as well the volume and growth of publications, there is estimated to be weak demand-to-supply ratio for research on this compound.
| This Compound (12.82) All Compounds (24.57) |
| Publication Type | This drug (%) | All Drugs (%) |
|---|---|---|
| Trials | 0 (0.00%) | 5.53% |
| Reviews | 0 (0.00%) | 6.00% |
| Case Studies | 0 (0.00%) | 4.05% |
| Observational | 0 (0.00%) | 0.25% |
| Other | 6 (100.00%) | 84.16% |
| [information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023] | ||