2-(N-morpholino)ethanesulfonic acid
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Overview
- DrugBank ID
- DB03814
- Type
- Small Molecule
- Clinical Trials
- Phase 0
- 0
- Phase 1
- 0
- Phase 2
- 0
- Phase 3
- 0
- Phase 4
- 0
- Mechanism of Action
Identification
- Generic Name
- 2-(N-morpholino)ethanesulfonic acid
- DrugBank Accession Number
- DB03814
- Background
Not Available
- Type
- Small Molecule
- Groups
- Experimental
- Structure
- Weight
- Average: 195.237
Monoisotopic: 195.056528599 - Chemical Formula
- C6H13NO4S
- Synonyms
- 2-(4-morpholinyl)ethanesulfonic acid
- 2-(morpholin-4-yl)ethanesulfonic acid
- 2-(N-morpholino)ethanesulfonic acid
- 2-morpholinoethanesulphonic acid
- 4-morpholineethanesulfonic acid
- 4-morpholinethanesulfonic acid
- MES
- External IDs
- NSC-157116
Pharmacology
- Indication
Not Available
Reduce drug development failure ratesBuild, train, & validate machine-learning modelswith evidence-based and structured datasets.Build, train, & validate predictive machine-learning models with structured datasets.- Contraindications & Blackbox Warnings
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- Pharmacodynamics
Not Available
- Mechanism of action
Target Actions Organism A11-beta-hydroxysteroid dehydrogenase 1 inhibitorHumans APeptide deformylase, mitochondrial inhibitorHumans ABeta-lactamase inhibitorStaphylococcus aureus AAcetylcholinesterase inhibitorHumans AGlutamine--fructose-6-phosphate aminotransferase [isomerizing] inhibitorEscherichia coli (strain K12) AChymase inhibitorHumans ACholinesterase inhibitorHumans UDihydrofolate reductase Not Available Yeast UCopper-containing nitrite reductase Not Available Achromobacter cycloclastes UGlutathione S-transferase P Not Available Humans UHydroxylamine reductase Not Available Desulfovibrio desulfuricans (strain ATCC 27774 / DSM 6949) UDiaminopimelate decarboxylase Not Available Escherichia coli (strain K12) UAlpha-xylosidase Not Available Escherichia coli (strain K12) ULimonene-1,2-epoxide hydrolase Not Available Rhodococcus erythropolis UMannan endo-1,4-beta-mannosidase Not Available Cellvibrio japonicus (strain Ueda107) UBeta-1,4-galactosyltransferase 1 Not Available Humans UTyrosine-protein kinase transforming protein Abl Not Available Abelson murine leukemia virus UBifunctional protein GlmU Not Available Escherichia coli (strain K12) UThiol:disulfide interchange protein DsbC Not Available Escherichia coli (strain K12) UGlyceraldehyde-3-phosphate dehydrogenase A Not Available Escherichia coli (strain K12) U(S)-mandelate dehydrogenase Not Available Pseudomonas putida UCopper-containing nitrite reductase Not Available Alcaligenes xylosoxydans xylosoxydans U33 kDa chaperonin Not Available Escherichia coli (strain K12) UFree methionine-R-sulfoxide reductase Not Available Escherichia coli (strain K12) UOrnithine cyclodeaminase Not Available Pseudomonas putida (strain KT2440) UDihydropteridine reductase Not Available Humans UArgininosuccinate lyase Not Available Humans UO-acetyl-ADP-ribose deacetylase Not Available Escherichia coli (strain K12) UADP-ribosylation factor-like protein 3 Not Available Humans UBeta-lactamase Not Available Proteus vulgaris U3-deoxy-D-manno-octulosonate 8-phosphate phosphatase KdsC Not Available Haemophilus influenzae (strain ATCC 51907 / DSM 11121 / KW20 / Rd) ULethal(3)malignant brain tumor-like protein 1 Not Available Humans URibonuclease Z Not Available Bacillus subtilis (strain 168) UPeroxiredoxin-6 Not Available Humans UHypothetical gliding protein Not Available Thermus thermophilus UProlyl endopeptidase Pep Not Available Myxococcus xanthus UPulmonary surfactant-associated protein A1 Not Available Humans UManganese catalase Not Available Lactobacillus plantarum UChorismate mutase AroH Not Available Thermus thermophilus UBiflaviolin synthase CYP158A2 Not Available Streptomyces coelicolor (strain ATCC BAA-471 / A3(2) / M145) UInterferon-inducible GTPase 5 Not Available Humans - Absorption
Not Available
- Volume of distribution
Not Available
- Protein binding
Not Available
- Metabolism
- Not Available
- Route of elimination
Not Available
- Half-life
Not Available
- Clearance
Not Available
- Adverse Effects
- Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.
- Toxicity
Not Available
- Pathways
- Not Available
- Pharmacogenomic Effects/ADRs
- Not Available
Interactions
- Drug Interactions
- This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.Not Available
- Food Interactions
- Not Available
Categories
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as morpholines. These are organic compounds containing a morpholine moiety, which consists of a six-member aliphatic saturated ring with the formula C4H9NO, where the oxygen and nitrogen atoms lie at positions 1 and 4, respectively.
- Kingdom
- Organic compounds
- Super Class
- Organoheterocyclic compounds
- Class
- Oxazinanes
- Sub Class
- Morpholines
- Direct Parent
- Morpholines
- Alternative Parents
- Sulfonyls / Organosulfonic acids / Alkanesulfonic acids / Trialkylamines / Oxacyclic compounds / Dialkyl ethers / Azacyclic compounds / Organopnictogen compounds / Organic oxides / Hydrocarbon derivatives
- Substituents
- Aliphatic heteromonocyclic compound / Alkanesulfonic acid / Amine / Azacycle / Dialkyl ether / Ether / Hydrocarbon derivative / Morpholine / Organic nitrogen compound / Organic oxide
- Molecular Framework
- Aliphatic heteromonocyclic compounds
- External Descriptors
- organosulfonic acid, MES (CHEBI:39005)
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- 2GNK67Q0C4
- CAS number
- 4432-31-9
- InChI Key
- SXGZJKUKBWWHRA-UHFFFAOYSA-N
- InChI
- InChI=1S/C6H13NO4S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h1-6H2,(H,8,9,10)
- IUPAC Name
- 4-(2-sulfonatoethyl)morpholin-4-ium
- SMILES
- OS(=O)(=O)CCN1CCOCC1
References
- General References
- Not Available
- External Links
- PubChem Compound
- 4478249
- PubChem Substance
- 46507795
- ChemSpider
- 70541
- ChEBI
- 39005
- ChEMBL
- CHEMBL1234276
- ZINC
- ZINC000001583444
- PDBe Ligand
- MES
- Wikipedia
- MES_(buffer)
- PDB Entries
- 10gs / 11gs / 12gs / 13gs / 14gs / 16gs / 17gs / 18gs / 19gs / 1a7t … show 2026 more
Clinical Trials
- Clinical Trials
Clinical Trial & Rare Diseases Add-on Data Package
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Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
- Not Available
- Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Solid
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 61.1 mg/mL ALOGPS logP -1.8 ALOGPS logP -2.5 Chemaxon logS -0.5 ALOGPS pKa (Strongest Acidic) -1.5 Chemaxon pKa (Strongest Basic) 6.51 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 70.87 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 53.64 m3·mol-1 Chemaxon Polarizability 18.67 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
Property Value Probability Human Intestinal Absorption - 0.5 Blood Brain Barrier + 0.9 Caco-2 permeable - 0.6087 P-glycoprotein substrate Non-substrate 0.6448 P-glycoprotein inhibitor I Non-inhibitor 0.6976 P-glycoprotein inhibitor II Non-inhibitor 0.9811 Renal organic cation transporter Non-inhibitor 0.7887 CYP450 2C9 substrate Non-substrate 0.8858 CYP450 2D6 substrate Non-substrate 0.8017 CYP450 3A4 substrate Non-substrate 0.6155 CYP450 1A2 substrate Non-inhibitor 0.8233 CYP450 2C9 inhibitor Non-inhibitor 0.8427 CYP450 2D6 inhibitor Non-inhibitor 0.8844 CYP450 2C19 inhibitor Non-inhibitor 0.8079 CYP450 3A4 inhibitor Non-inhibitor 0.9623 CYP450 inhibitory promiscuity Low CYP Inhibitory Promiscuity 0.9671 Ames test AMES toxic 0.5181 Carcinogenicity Non-carcinogens 0.6105 Biodegradation Ready biodegradable 0.9587 Rat acute toxicity 2.3838 LD50, mol/kg Not applicable hERG inhibition (predictor I) Strong inhibitor 0.9425 hERG inhibition (predictor II) Non-inhibitor 0.7564
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
Spectrum Spectrum Type Splash Key Predicted GC-MS Spectrum - GC-MS Predicted GC-MS splash10-0nvl-9400000000-28f4e362c9075f85012c Predicted MS/MS Spectrum - 10V, Positive (Annotated) Predicted LC-MS/MS splash10-0002-0900000000-1ffdeda4a861bcf136fb Predicted MS/MS Spectrum - 10V, Negative (Annotated) Predicted LC-MS/MS splash10-0006-0900000000-e61455327057089d45c7 Predicted MS/MS Spectrum - 20V, Positive (Annotated) Predicted LC-MS/MS splash10-0udj-1900000000-c02b8fdbbd9a9db5b6ba Predicted MS/MS Spectrum - 20V, Negative (Annotated) Predicted LC-MS/MS splash10-0006-2900000000-0659ff0bc40b03c06617 Predicted MS/MS Spectrum - 40V, Positive (Annotated) Predicted LC-MS/MS splash10-0pk9-9300000000-0e17cac8fdf60c125c79 Predicted MS/MS Spectrum - 40V, Negative (Annotated) Predicted LC-MS/MS splash10-001i-9000000000-7b80b7e26cba1ff316af Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (â„«2) Source type Source [M-H]- 142.0898702 predictedDarkChem Lite v0.1.0 [M-H]- 129.2279 predictedDeepCCS 1.0 (2019) [M+H]+ 141.9587702 predictedDarkChem Lite v0.1.0 [M+H]+ 131.62547 predictedDeepCCS 1.0 (2019) [M+Na]+ 141.5814702 predictedDarkChem Lite v0.1.0 [M+Na]+ 138.54225 predictedDeepCCS 1.0 (2019)
Targets
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Use our structured and evidence-based datasets to unlock newinsights and accelerate drug research.
Use our structured and evidence-based datasets to unlock new insights and accelerate drug research.
1. Details11-beta-hydroxysteroid dehydrogenase 1
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Yes
- Actions
- Inhibitor
- General Function
- Controls the reversible conversion of biologically active glucocorticoids such as cortisone to cortisol, and 11-dehydrocorticosterone to corticosterone in the presence of NADP(H) (PubMed:10497248, PubMed:12460758, PubMed:14973125, PubMed:15152005, PubMed:15280030, PubMed:17593962, PubMed:21453287, PubMed:27927697, PubMed:30902677). Participates in the corticosteroid receptor-mediated anti-inflammatory response, as well as metabolic and homeostatic processes (PubMed:10497248, PubMed:12414862, PubMed:15152005, PubMed:21453287). Plays a role in the secretion of aqueous humor in the eye, maintaining a normotensive, intraocular environment (PubMed:11481269). Bidirectional in vitro, predominantly functions as a reductase in vivo, thereby increasing the concentration of active glucocorticoids (PubMed:10497248, PubMed:11481269, PubMed:12414862, PubMed:12460758). It has broad substrate specificity, besides glucocorticoids, it accepts other steroid and sterol substrates (PubMed:15095019, PubMed:15152005, PubMed:17593962, PubMed:21453287). Interconverts 7-oxo- and 7-hydroxy-neurosteroids such as 7-oxopregnenolone and 7beta-hydroxypregnenolone, 7-oxodehydroepiandrosterone (3beta-hydroxy-5-androstene-7,17-dione) and 7beta-hydroxydehydroepiandrosterone (3beta,7beta-dihydroxyandrost-5-en-17-one), among others (PubMed:17593962). Catalyzes the stereo-specific conversion of the major dietary oxysterol, 7-ketocholesterol (7-oxocholesterol), into the more polar 7-beta-hydroxycholesterol metabolite (PubMed:15095019, PubMed:15152005). 7-oxocholesterol is one of the most important oxysterols, it participates in several events such as induction of apoptosis, accumulation in atherosclerotic lesions, lipid peroxidation, and induction of foam cell formation (PubMed:15095019). Mediates the 7-oxo reduction of 7-oxolithocholate mainly to chenodeoxycholate, and to a lesser extent to ursodeoxycholate, both in its free form and when conjugated to glycine or taurine, providing a link between glucocorticoid activation and bile acid metabolism (PubMed:21453287). Catalyzes the synthesis of 7-beta-25-dihydroxycholesterol from 7-oxo-25-hydroxycholesterol in vitro, which acts as a ligand for the G-protein-coupled receptor (GPCR) Epstein-Barr virus-induced gene 2 (EBI2) and may thereby regulate immune cell migration (PubMed:30902677)
- Specific Function
- 11-beta-hydroxysteroid dehydrogenase (NADP+) activity
- Gene Name
- HSD11B1
- Uniprot ID
- P28845
- Uniprot Name
- 11-beta-hydroxysteroid dehydrogenase 1
- Molecular Weight
- 32400.665 Da
References
- Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. [Article]
- Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. [Article]
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
2. DetailsPeptide deformylase, mitochondrial
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Yes
- Actions
- Inhibitor
- General Function
- Removes the formyl group from the N-terminal Met of newly synthesized proteins
- Specific Function
- metal ion binding
- Gene Name
- Uniprot ID
- Q9HBH1
- Uniprot Name
- Peptide deformylase, mitochondrial
- Molecular Weight
- 27013.25 Da
References
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
3. DetailsBeta-lactamase
- Kind
- Protein
- Organism
- Staphylococcus aureus
- Pharmacological action
- Yes
- Actions
- Inhibitor
- General Function
- Not Available
- Specific Function
- beta-lactamase activity
- Gene Name
- blaZ
- Uniprot ID
- P00807
- Uniprot Name
- Beta-lactamase
- Molecular Weight
- 31348.98 Da
References
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
4. DetailsAcetylcholinesterase
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Yes
- Actions
- Inhibitor
- General Function
- Hydrolyzes rapidly the acetylcholine neurotransmitter released into the synaptic cleft allowing to terminate the signal transduction at the neuromuscular junction. Role in neuronal apoptosis
- Specific Function
- acetylcholine binding
- Gene Name
- ACHE
- Uniprot ID
- P22303
- Uniprot Name
- Acetylcholinesterase
- Molecular Weight
- 67795.525 Da
References
- Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. [Article]
- Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. [Article]
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Yes
- Actions
- Inhibitor
- General Function
- Catalyzes the first step in hexosamine metabolism, converting fructose-6P into glucosamine-6P using glutamine as a nitrogen source.
- Specific Function
- carbohydrate derivative binding
- Gene Name
- glmS
- Uniprot ID
- P17169
- Uniprot Name
- Glutamine--fructose-6-phosphate aminotransferase [isomerizing]
- Molecular Weight
- 66893.7 Da
References
- Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. [Article]
- Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. [Article]
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
6. DetailsChymase
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Yes
- Actions
- Inhibitor
- General Function
- Major secreted protease of mast cells with suspected roles in vasoactive peptide generation, extracellular matrix degradation, and regulation of gland secretion
- Specific Function
- endopeptidase activity
- Gene Name
- CMA1
- Uniprot ID
- P23946
- Uniprot Name
- Chymase
- Molecular Weight
- 27324.56 Da
References
- Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. [Article]
- Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. [Article]
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
7. DetailsCholinesterase
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Yes
- Actions
- Inhibitor
- General Function
- Esterase with broad substrate specificity. Contributes to the inactivation of the neurotransmitter acetylcholine. Can degrade neurotoxic organophosphate esters
- Specific Function
- acetylcholinesterase activity
- Gene Name
- BCHE
- Uniprot ID
- P06276
- Uniprot Name
- Cholinesterase
- Molecular Weight
- 68417.575 Da
References
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
8. DetailsDihydrofolate reductase
- Kind
- Protein
- Organism
- Yeast
- Pharmacological action
- Unknown
- General Function
- Key enzyme in folate metabolism. Catalyzes an essential reaction for de novo glycine and purine synthesis, and for DNA precursor synthesis.
- Specific Function
- dihydrofolate reductase activity
- Gene Name
- DFR1
- Uniprot ID
- P22906
- Uniprot Name
- Dihydrofolate reductase
- Molecular Weight
- 22138.295 Da
References
9. DetailsCopper-containing nitrite reductase
- Kind
- Protein
- Organism
- Achromobacter cycloclastes
- Pharmacological action
- Unknown
- General Function
- Not Available
- Specific Function
- copper ion binding
- Gene Name
- nirK
- Uniprot ID
- P25006
- Uniprot Name
- Copper-containing nitrite reductase
- Molecular Weight
- 40771.115 Da
References
10. DetailsGlutathione S-transferase P
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles. Involved in the formation of glutathione conjugates of both prostaglandin A2 (PGA2) and prostaglandin J2 (PGJ2) (PubMed:9084911). Participates in the formation of novel hepoxilin regioisomers (PubMed:21046276). Negatively regulates CDK5 activity via p25/p35 translocation to prevent neurodegeneration
- Specific Function
- dinitrosyl-iron complex binding
- Gene Name
- GSTP1
- Uniprot ID
- P09211
- Uniprot Name
- Glutathione S-transferase P
- Molecular Weight
- 23355.625 Da
References
11. DetailsHydroxylamine reductase
- Kind
- Protein
- Organism
- Desulfovibrio desulfuricans (strain ATCC 27774 / DSM 6949)
- Pharmacological action
- Unknown
- General Function
- Catalyzes the reduction of hydroxylamine to form NH(3) and H(2)O.
- Specific Function
- 4 iron, 4 sulfur cluster binding
- Gene Name
- hcp
- Uniprot ID
- Q01770
- Uniprot Name
- Hydroxylamine reductase
- Molecular Weight
- 58658.78 Da
References
12. DetailsDiaminopimelate decarboxylase
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Specifically catalyzes the decarboxylation of meso-diaminopimelate (meso-DAP) to L-lysine. Is not active against the DD- or LL-isomers of diaminopimelate.
- Specific Function
- diaminopimelate decarboxylase activity
- Gene Name
- lysA
- Uniprot ID
- P00861
- Uniprot Name
- Diaminopimelate decarboxylase
- Molecular Weight
- 46176.975 Da
References
13. DetailsAlpha-xylosidase
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Can catalyze the transfer of alpha-xylosyl residue from alpha-xyloside to xylose, glucose, mannose, fructose, maltose, isomaltose, nigerose, kojibiose, sucrose and trehalose.
- Specific Function
- alpha-D-xyloside xylohydrolase
- Gene Name
- yicI
- Uniprot ID
- P31434
- Uniprot Name
- Alpha-xylosidase
- Molecular Weight
- 88078.905 Da
References
14. DetailsLimonene-1,2-epoxide hydrolase
- Kind
- Protein
- Organism
- Rhodococcus erythropolis
- Pharmacological action
- Unknown
- General Function
- Catalyzes the conversion of limonene-1,2-epoxide to limonene-1,2-diol. Can use both the (-) and (+) isomers of limonene-1,2-epoxide as substrates and also has some activity with 1-methylcyclohexene oxide, cyclohexene oxide and indene oxide as substrates.
- Specific Function
- limonene-1,2-epoxide hydrolase activity
- Gene Name
- limA
- Uniprot ID
- Q9ZAG3
- Uniprot Name
- Limonene-1,2-epoxide hydrolase
- Molecular Weight
- 16520.47 Da
References
15. DetailsMannan endo-1,4-beta-mannosidase
- Kind
- Protein
- Organism
- Cellvibrio japonicus (strain Ueda107)
- Pharmacological action
- Unknown
- General Function
- Catalyzes the endo hydrolysis of beta-1,4-linked mannan and galactomannan, but displays little activity towards other polysaccharides located in the plant cell wall (PubMed:11382747). Preferentially hydrolyzes the larger oligosaccharides and has greater activity against non-substituted polysaccharides (PubMed:7848261, PubMed:8973192). It displays tight specificity for mannose at both the -2 and the -1 subsites (PubMed:19441796). Appears to act in synergy with alpha-galactosidase (AgaA) to elicit hydrolysis of galactomannan (PubMed:11064195).
- Specific Function
- mannan endo-1,4-beta-mannosidase activity
- Gene Name
- manA
- Uniprot ID
- P49424
- Uniprot Name
- Mannan endo-1,4-beta-mannosidase
- Molecular Weight
- 47486.99 Da
References
16. DetailsBeta-1,4-galactosyltransferase 1
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- The Golgi complex form catalyzes the production of lactose in the lactating mammary gland and could also be responsible for the synthesis of complex-type N-linked oligosaccharides in many glycoproteins as well as the carbohydrate moieties of glycolipids
- Specific Function
- alpha-tubulin binding
- Gene Name
- B4GALT1
- Uniprot ID
- P15291
- Uniprot Name
- Beta-1,4-galactosyltransferase 1
- Molecular Weight
- 43919.895 Da
References
- Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. [Article]
- Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. [Article]
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
- Kind
- Protein
- Organism
- Abelson murine leukemia virus
- Pharmacological action
- Unknown
- General Function
- Not Available
- Specific Function
- ATP binding
- Gene Name
- ABL
- Uniprot ID
- P00521
- Uniprot Name
- Tyrosine-protein kinase transforming protein Abl
- Molecular Weight
- 81871.395 Da
References
18. DetailsBifunctional protein GlmU
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Catalyzes the last two sequential reactions in the de novo biosynthetic pathway for UDP-N-acetylglucosamine (UDP-GlcNAc). The C-terminal domain catalyzes the transfer of acetyl group from acetyl coenzyme A to glucosamine-1-phosphate (GlcN-1-P) to produce N-acetylglucosamine-1-phosphate (GlcNAc-1-P), which is converted into UDP-GlcNAc by the transfer of uridine 5-monophosphate (from uridine 5-triphosphate), a reaction catalyzed by the N-terminal domain.
- Specific Function
- glucosamine-1-phosphate N-acetyltransferase activity
- Gene Name
- glmU
- Uniprot ID
- P0ACC7
- Uniprot Name
- Bifunctional protein GlmU
- Molecular Weight
- 49189.765 Da
References
19. DetailsThiol:disulfide interchange protein DsbC
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Acts as a disulfide isomerase, interacting with incorrectly folded proteins to correct non-native disulfide bonds. DsbG and DsbC are part of a periplasmic reducing system that controls the level of cysteine sulfenylation, and provides reducing equivalents to rescue oxidatively damaged secreted proteins. Acts by transferring its disulfide bond to other proteins and is reduced in the process. DsbC is reoxidized by DsbD.
- Specific Function
- protein disulfide isomerase activity
- Gene Name
- dsbC
- Uniprot ID
- P0AEG6
- Uniprot Name
- Thiol:disulfide interchange protein DsbC
- Molecular Weight
- 25621.495 Da
References
20. DetailsGlyceraldehyde-3-phosphate dehydrogenase A
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Catalyzes the oxidative phosphorylation of glyceraldehyde 3-phosphate (G3P) to 1,3-bisphosphoglycerate (BPG) using the cofactor NAD. The first reaction step involves the formation of a hemiacetal intermediate between G3P and a cysteine residue, and this hemiacetal intermediate is then oxidized to a thioester, with concomitant reduction of NAD to NADH. The reduced NADH is then exchanged with the second NAD, and the thioester is attacked by a nucleophilic inorganic phosphate to produce BPG.
- Specific Function
- glyceraldehyde-3-phosphate dehydrogenase (NAD+) (phosphorylating) activity
- Gene Name
- gapA
- Uniprot ID
- P0A9B2
- Uniprot Name
- Glyceraldehyde-3-phosphate dehydrogenase A
- Molecular Weight
- 35532.24 Da
References
21. Details(S)-mandelate dehydrogenase
- Kind
- Protein
- Organism
- Pseudomonas putida
- Pharmacological action
- Unknown
- General Function
- Catalyzes the dehydrogenation of (S)-mandelate to phenylglyoxylate (benzoylformate) (PubMed:10493804, PubMed:19465768). Is likely involved in the utilization of mandelate as a sole source of carbon and energy for growth (Probable). Active in vitro with the artificial electron acceptors 2,6-dichlorophenolindophenol (DCPIP) or ferricyanide, but in vivo most likely transfer the electron pair from the reduced flavin to a component of the electron transport chain in the membrane, possibly a quinone (PubMed:10493804, PubMed:19465768). Shows very low activity with oxygen as the electron acceptor, and also with 3-indolelactate and medium chain 2-hydroxyacids as substrates (PubMed:10493804, PubMed:19465768).
- Specific Function
- (S)-mandelate dehydrogenase activity
- Gene Name
- mdlB
- Uniprot ID
- P20932
- Uniprot Name
- (S)-mandelate dehydrogenase
- Molecular Weight
- 43436.53 Da
22. DetailsCopper-containing nitrite reductase
- Kind
- Protein
- Organism
- Alcaligenes xylosoxydans xylosoxydans
- Pharmacological action
- Unknown
- General Function
- Not Available
- Specific Function
- copper ion binding
- Gene Name
- nir
- Uniprot ID
- O68601
- Uniprot Name
- Copper-containing nitrite reductase
- Molecular Weight
- 38939.295 Da
23. Details33 kDa chaperonin
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Redox regulated molecular chaperone. Protects both thermally unfolding and oxidatively damaged proteins from irreversible aggregation. Plays an important role in the bacterial defense system toward oxidative stress.
- Specific Function
- identical protein binding
- Gene Name
- hslO
- Uniprot ID
- P0A6Y5
- Uniprot Name
- 33 kDa chaperonin
- Molecular Weight
- 32534.245 Da
24. DetailsFree methionine-R-sulfoxide reductase
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Catalyzes the reversible oxidation-reduction of the R-enantiomer of free methionine sulfoxide to methionine. Specific for free L-methionine-(R)-S-oxide.
- Specific Function
- L-methionine-(R)-S-oxide reductase activity
- Gene Name
- msrC
- Uniprot ID
- P76270
- Uniprot Name
- Free methionine-R-sulfoxide reductase
- Molecular Weight
- 18121.45 Da
25. DetailsOrnithine cyclodeaminase
- Kind
- Protein
- Organism
- Pseudomonas putida (strain KT2440)
- Pharmacological action
- Unknown
- General Function
- Catalyzes the conversion of L-ornithine into L-proline with release of ammonia. Is likely involved in the L-ornithine degradation pathway that allows P.putida to utilize this compound as sole carbon and nitrogen source.
- Specific Function
- nucleotide binding
- Gene Name
- Not Available
- Uniprot ID
- Q88H32
- Uniprot Name
- Ornithine cyclodeaminase
- Molecular Weight
- 38424.515 Da
26. DetailsDihydropteridine reductase
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- Catalyzes the conversion of quinonoid dihydrobiopterin into tetrahydrobiopterin
- Specific Function
- 6,7-dihydropteridine reductase activity
- Gene Name
- QDPR
- Uniprot ID
- P09417
- Uniprot Name
- Dihydropteridine reductase
- Molecular Weight
- 25789.295 Da
References
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
27. DetailsArgininosuccinate lyase
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- Catalyzes the reversible cleavage of L-argininosuccinate to fumarate and L-arginine, an intermediate step reaction in the urea cycle mostly providing for hepatic nitrogen detoxification into excretable urea as well as de novo L-arginine synthesis in nonhepatic tissues (PubMed:11747432, PubMed:11747433, PubMed:22081021, PubMed:2263616, PubMed:9045711). Essential regulator of intracellular and extracellular L-arginine pools. As part of citrulline-nitric oxide cycle, forms tissue-specific multiprotein complexes with argininosuccinate synthase ASS1, transport protein SLC7A1 and nitric oxide synthase NOS1, NOS2 or NOS3, allowing for cell-autonomous L-arginine synthesis while channeling extracellular L-arginine to nitric oxide synthesis pathway (PubMed:22081021)
- Specific Function
- argininosuccinate lyase activity
- Gene Name
- ASL
- Uniprot ID
- P04424
- Uniprot Name
- Argininosuccinate lyase
- Molecular Weight
- 51657.505 Da
References
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
28. DetailsO-acetyl-ADP-ribose deacetylase
- Kind
- Protein
- Organism
- Escherichia coli (strain K12)
- Pharmacological action
- Unknown
- General Function
- Deacetylates O-acetyl-ADP ribose to yield ADP-ribose and free acetate (PubMed:21257746, PubMed:26481419). Down-regulates ribonuclease 3 (RNase III) activity. Acts by interacting directly with the region of the ribonuclease that is required for dimerization/activation (PubMed:19141481). Overexpression inhibits biofilm formation via an RNase III-independent pathway. This inhibition is RpoS-dependent (PubMed:24267348, PubMed:28582517). Overexpression also results in increased susceptibility to apramycin (PubMed:28034758, PubMed:28582517).
- Specific Function
- endoribonuclease inhibitor activity
- Gene Name
- ymdB
- Uniprot ID
- P0A8D6
- Uniprot Name
- O-acetyl-ADP-ribose deacetylase
- Molecular Weight
- 18880.25 Da
29. DetailsADP-ribosylation factor-like protein 3
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- Small GTP-binding protein which cycles between an inactive GDP-bound and an active GTP-bound form, and the rate of cycling is regulated by guanine nucleotide exchange factors (GEF) and GTPase-activating proteins (GAP) (PubMed:16525022, PubMed:18588884). Required for normal cytokinesis and cilia signaling (PubMed:22085962). Requires assistance from GTPase-activating proteins (GAPs) like RP2 and PDE6D, in order to cycle between inactive GDP-bound and active GTP-bound forms. Required for targeting proteins to the cilium, including myristoylated NPHP3 and prenylated INPP5E (PubMed:30269812). Targets NPHP3 to the ciliary membrane by releasing myristoylated NPHP3 from UNC119B cargo adapter into the cilium (PubMed:22085962). Required for PKD1:PKD2 complex targeting from the trans-Golgi network to the cilium (By similarity)
- Specific Function
- GDP binding
- Gene Name
- ARL3
- Uniprot ID
- P36405
- Uniprot Name
- ADP-ribosylation factor-like protein 3
- Molecular Weight
- 20455.335 Da
References
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
30. DetailsBeta-lactamase
- Kind
- Protein
- Organism
- Proteus vulgaris
- Pharmacological action
- Unknown
- General Function
- Hydrolyzes broad-spectrum beta-lactam antibiotics. Active against cephalosporins such as cefuroxime and cefotaxime.
- Specific Function
- beta-lactamase activity
- Gene Name
- blaB
- Uniprot ID
- P52664
- Uniprot Name
- Beta-lactamase
- Molecular Weight
- 32991.385 Da
- Kind
- Protein
- Organism
- Haemophilus influenzae (strain ATCC 51907 / DSM 11121 / KW20 / Rd)
- Pharmacological action
- Unknown
- General Function
- Catalyzes the hydrolysis of 3-deoxy-D-manno-octulosonate 8-phosphate (KDO 8-P) to 3-deoxy-D-manno-octulosonate (KDO) and inorganic phosphate.
- Specific Function
- 3-deoxy-manno-octulosonate-8-phosphatase activity
- Gene Name
- Not Available
- Uniprot ID
- P45314
- Uniprot Name
- 3-deoxy-D-manno-octulosonate 8-phosphate phosphatase KdsC
- Molecular Weight
- 19432.135 Da
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- Polycomb group (PcG) protein that specifically recognizes and binds mono- and dimethyllysine residues on target proteins, therey acting as a 'reader' of a network of post-translational modifications. PcG proteins maintain the transcriptionally repressive state of genes: acts as a chromatin compaction factor by recognizing and binding mono- and dimethylated histone H1b/H1-4 at 'Lys-26' (H1bK26me1 and H1bK26me2) and histone H4 at 'Lys-20' (H4K20me1 and H4K20me2), leading to condense chromatin and repress transcription. Recognizes and binds p53/TP53 monomethylated at 'Lys-382', leading to repress p53/TP53-target genes. Also recognizes and binds RB1/RB monomethylated at 'Lys-860'. Participates in the ETV6-mediated repression. Probably plays a role in cell proliferation. Overexpression induces multinucleated cells, suggesting that it is required to accomplish normal mitosis
- Specific Function
- chromatin binding
- Gene Name
- L3MBTL1
- Uniprot ID
- Q9Y468
- Uniprot Name
- Lethal(3)malignant brain tumor-like protein 1
- Molecular Weight
- 92296.365 Da
33. DetailsRibonuclease Z
- Kind
- Protein
- Organism
- Bacillus subtilis (strain 168)
- Pharmacological action
- Unknown
- General Function
- Zinc phosphodiesterase, which displays some tRNA 3'-processing endonuclease activity. Probably involved in tRNA maturation, by removing a 3'-trailer from precursor tRNA.
- Specific Function
- 3'-tRNA processing endoribonuclease activity
- Gene Name
- rnz
- Uniprot ID
- P54548
- Uniprot Name
- Ribonuclease Z
- Molecular Weight
- 34022.58 Da
34. DetailsPeroxiredoxin-6
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- Thiol-specific peroxidase that catalyzes the reduction of hydrogen peroxide and organic hydroperoxides to water and alcohols, respectively (PubMed:10893423, PubMed:9497358). Can reduce H(2)O(2) and short chain organic, fatty acid, and phospholipid hydroperoxides (PubMed:10893423). Also has phospholipase activity, can therefore either reduce the oxidized sn-2 fatty acyl group of phospholipids (peroxidase activity) or hydrolyze the sn-2 ester bond of phospholipids (phospholipase activity) (PubMed:10893423, PubMed:26830860). These activities are dependent on binding to phospholipids at acidic pH and to oxidized phospholipds at cytosolic pH (PubMed:10893423). Plays a role in cell protection against oxidative stress by detoxifying peroxides and in phospholipid homeostasis (PubMed:10893423). Exhibits acyl-CoA-dependent lysophospholipid acyltransferase which mediates the conversion of lysophosphatidylcholine (1-acyl-sn-glycero-3-phosphocholine or LPC) into phosphatidylcholine (1,2-diacyl-sn-glycero-3-phosphocholine or PC) (PubMed:26830860). Shows a clear preference for LPC as the lysophospholipid and for palmitoyl CoA as the fatty acyl substrate (PubMed:26830860)
- Specific Function
- 1-acylglycerophosphocholine O-acyltransferase activity
- Gene Name
- PRDX6
- Uniprot ID
- P30041
- Uniprot Name
- Peroxiredoxin-6
- Molecular Weight
- 25034.715 Da
References
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
35. DetailsHypothetical gliding protein
- Kind
- Protein
- Organism
- Thermus thermophilus
- Pharmacological action
- Unknown
- General Function
- Not Available
- Specific Function
- guanyl-nucleotide exchange factor activity
- Gene Name
- mglB
- Uniprot ID
- Q9X9L0
- Uniprot Name
- Hypothetical gliding protein
- Molecular Weight
- 17774.16 Da
36. DetailsProlyl endopeptidase Pep
- Kind
- Protein
- Organism
- Myxococcus xanthus
- Pharmacological action
- Unknown
- General Function
- Not Available
- Specific Function
- oligopeptidase activity
- Gene Name
- pep
- Uniprot ID
- Q9X5N2
- Uniprot Name
- Prolyl endopeptidase Pep
- Molecular Weight
- 76847.12 Da
37. DetailsPulmonary surfactant-associated protein A1
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- In presence of calcium ions, it binds to surfactant phospholipids and contributes to lower the surface tension at the air-liquid interface in the alveoli of the mammalian lung and is essential for normal respiration. Enhances the expression of MYO18A/SP-R210 on alveolar macrophages (By similarity)
- Specific Function
- carbohydrate binding
- Gene Name
- SFTPA1
- Uniprot ID
- Q8IWL2
- Uniprot Name
- Pulmonary surfactant-associated protein A1
- Molecular Weight
- 26242.275 Da
References
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
38. DetailsManganese catalase
- Kind
- Protein
- Organism
- Lactobacillus plantarum
- Pharmacological action
- Unknown
- General Function
- Catalyzes the decomposition of hydrogen peroxide into water and oxygen.
- Specific Function
- catalase activity
- Gene Name
- Not Available
- Uniprot ID
- P60355
- Uniprot Name
- Manganese catalase
- Molecular Weight
- 29743.225 Da
39. DetailsChorismate mutase AroH
- Kind
- Protein
- Organism
- Thermus thermophilus
- Pharmacological action
- Unknown
- General Function
- Catalyzes the Claisen rearrangement of chorismate to prephenate. Probably involved in the aromatic amino acid biosynthesis.
- Specific Function
- chorismate mutase activity
- Gene Name
- aroH
- Uniprot ID
- Q84FH6
- Uniprot Name
- Chorismate mutase AroH
- Molecular Weight
- 13649.555 Da
40. DetailsBiflaviolin synthase CYP158A2
- Kind
- Protein
- Organism
- Streptomyces coelicolor (strain ATCC BAA-471 / A3(2) / M145)
- Pharmacological action
- Unknown
- General Function
- Catalyzes oxidative C-C coupling reaction to polymerize flaviolin and form highly conjugated pigments which protect the soil bacterium from deleterious effects of UV irradiation (three isomers of biflaviolin and one triflaviolin).
- Specific Function
- heme binding
- Gene Name
- cyp158a2
- Uniprot ID
- Q9FCA6
- Uniprot Name
- Biflaviolin synthase CYP158A2
- Molecular Weight
- 44354.085 Da
41. DetailsInterferon-inducible GTPase 5
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Unknown
- General Function
- Required for sperm motility and therefore male fertility, via positive regulation of spermatozoa fibrous sheath formation
- Specific Function
- GTP binding
- Gene Name
- IRGC
- Uniprot ID
- Q6NXR0
- Uniprot Name
- Interferon-inducible GTPase 5
- Molecular Weight
- 50287.62 Da
References
- Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. [Article]
Drug created at June 13, 2005 13:24 / Updated at August 26, 2024 19:22