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name Structure Reference Source Properties Activities Metabolism

Miglitol

AlkaPlorer ID: AK003023

Synonym: None

IUPAC Name: (2R,3R,4R,5S)-1-(2-hydroxyethyl)-2-(hydroxymethyl)piperidine-3,4,5-triol

Structure

SMILES: OCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO

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InChI: InChI=1S/C8H17NO5/c10-2-1-9-3-6(12)8(14)7(13)5(9)4-11/h5-8,10-14H,1-4H2/t5-,6+,7-,8-/m1/s1

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InChIKey: IBAQFPQHRJAVAV-ULAWRXDQSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Hintonia latiflora Hintonia Rubiaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 207.226

TPSA？: 104.39

MolLogP？: -3.262099999999999

Number of H-Donors: 5

Number of H-Acceptors: 6

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Acinetobacter baumannii Acinetobacter baumannii Inhibition 27.09 % 10.6019/CHEMBL4513141
Aspergillus niger Alpha-glucosidase IC50 57140.0 nM 10.1016/j.bmcl.2017.10.025
Bos taurus Beta-galactosidase IC50 200000.0 nM 10.1021/acs.jmedchem.5b00951
Bos taurus Beta-galactosidase Ki 100000.0 nM 10.1021/acs.jmedchem.5b00951
Canavalia ensiformis Alpha-mannosidase IC50 75880.0 nM 10.1016/j.bmcl.2017.10.025
Canavalia ensiformis Alpha-mannosidase Inhibition 50.0 % 10.1021/acs.jmedchem.5b00951
Canavalia ensiformis Alpha-mannosidase Inhibition nan % 10.1016/j.bmc.2017.07.026
Canavalia ensiformis Alpha-mannosidase Kd 105130.0 nM 10.1021/acs.jmedchem.1c00036
Canavalia ensiformis Alpha-mannosidase Ki 105130.0 nM 10.1016/j.ejmech.2022.114621
Candida albicans Candida albicans Inhibition 2.16 % 10.6019/CHEMBL4513141
Coffea arabica Alpha-galactosidase Inhibition nan % 10.1016/j.bmc.2017.07.026
Cryptococcus neoformans Cryptococcus neoformans Inhibition 1.09 % 10.6019/CHEMBL4513141
Escherichia coli Alpha-galactosidase Inhibition nan % 10.1016/j.bmcl.2017.10.025
Escherichia coli Beta-galactosidase EC50 40000.0 nM None
Escherichia coli Escherichia coli Inhibition 5.82 % 10.6019/CHEMBL4513141
Homo sapiens Acetylcholinesterase AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Adenosine A3 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2a adrenergic receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Androgen Receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-glucocerebrosidase IC50 84000.0 nM 10.1016/j.bmc.2008.06.026
Homo sapiens Bile salt export pump AC50 300000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Bile salt export pump IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Canalicular multispecific organic anion transporter 1 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Canalicular multispecific organic anion transporter 2 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Ceramide glucosyltransferase IC50 1000000.0 nM 10.1021/jm901281m
Homo sapiens Cyclooxygenase-1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D1 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D3 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine transporter AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Epidermal growth factor receptor erbB1 IC50 nan None 10.1016/j.bmcl.2017.08.035
Homo sapiens Epidermal growth factor receptor erbB1 Inhibition nan % 10.1016/j.bmcl.2017.08.035
Homo sapiens Estrogen receptor alpha AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Gamma-aminobutyric acid receptor subunit alpha-1/alpha-2/beta-2/gamma-2 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens HERG AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histamine H3 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Homo sapiens CL 0.0 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL 1.7 mL.min-1.kg-1 10.1021/jm900403j
Homo sapiens Homo sapiens CL 1.7 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL_renal 1.7 mL.min-1.kg-1 10.1021/jm900403j
Homo sapiens Homo sapiens CL_renal 1.7 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens DILI_Concern nan None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens DILI_severity_class 0.0 None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens Fa 0.59 None 10.1021/jm901371v
Homo sapiens Homo sapiens F_fraction 0.59 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fg 1.0 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fh 1.0 None 10.1021/jm901371v
Homo sapiens Homo sapiens Vdss 0.28 L.kg-1 10.1021/jm901371v
Homo sapiens Lactase-phlorizin hydrolase IC50 50000.0 nM 10.1021/jm901281m
Homo sapiens Lysosomal alpha-glucosidase IC50 350.0 nM 10.1016/j.bmc.2008.06.026
Homo sapiens Lysosomal alpha-glucosidase IC50 1000.0 nM 10.1016/j.bmc.2008.06.026
Homo sapiens Lysosomal alpha-glucosidase IC50 2000.0 nM 10.1021/jm901281m
Homo sapiens Lysosomal alpha-glucosidase Inhibition nan % 10.1021/jm301304e
Homo sapiens Lysosomal alpha-glucosidase Potency 2238.7 nM None
Homo sapiens Lysosomal alpha-glucosidase Potency 3548.1 nM None
Homo sapiens Lysosomal alpha-mannosidase IC50 379000.0 nM 10.1016/j.bmc.2014.09.034
Homo sapiens Maltase-glucoamylase IC50 3700.0 nM 10.1016/j.bmc.2016.06.013
Homo sapiens Maltase-glucoamylase IC50 3700.0 nM 10.1016/j.bmcl.2020.127751
Homo sapiens Maltase-glucoamylase IC50 6000.0 nM 10.1021/jm901281m
Homo sapiens Maltase-glucoamylase IC50 154300.0 nM 10.1016/j.bmcl.2022.129069
Homo sapiens Maltase-glucoamylase Ki 1000.0 nM 10.1016/j.bmc.2010.09.059
Homo sapiens Monoamine oxidase A AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Multidrug resistance-associated protein 4 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Mu opioid receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Muscarinic acetylcholine receptor M1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Muscarinic acetylcholine receptor M2 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Norepinephrine transporter AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Phosphodiesterase 3A AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Phosphodiesterase 4A AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Progesterone receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 1a (5-HT1a) receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 2b (5-HT2b) receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin transporter AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Solute carrier organic anion transporter family member 1B1 Inhibition 99.55 % 10.1124/mol.112.084152
Homo sapiens Solute carrier organic anion transporter family member 1B3 Inhibition 80.3 % 10.1124/mol.112.084152
Homo sapiens Sucrase-isomaltase IC50 500.0 nM 10.1021/jm901281m
Homo sapiens Thrombin AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Thromboxane A2 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Type-1 angiotensin II receptor IC50 40000.0 nM None
Homo sapiens Vascular endothelial growth factor receptor 2 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Klebsiella pneumoniae Klebsiella pneumoniae Inhibition 11.67 % 10.6019/CHEMBL4513141
Mus musculus Mus musculus Activity 27.3 % 10.1021/acs.jmedchem.1c00036
Mus musculus Mus musculus Activity 36.6 % 10.1021/acs.jmedchem.1c00036
Mus musculus Mus musculus Activity 40.4 % 10.1021/acs.jmedchem.1c00036
Mus musculus Mus musculus Activity 40.5 % 10.1021/jm301304e
Mus musculus Mus musculus Activity 58.7 % 10.1021/jm301304e
Mus musculus Mus musculus Activity 233.28 mg/dl 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Activity 273.6 mg/dl 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Activity 287.55 mg/dl 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Activity nan None 10.1021/acs.jmedchem.1c00036
Mus musculus Mus musculus Activity nan None 10.1021/jm301304e
Mus musculus Mus musculus Activity nan None 10.1021/jm901281m
Mus musculus Mus musculus Inhibition 21.96 % 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Inhibition 23.06 % 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Inhibition 27.31 % 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Inhibition 30.02 % 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Inhibition 39.23 % 10.1016/j.ejmech.2022.114621
Mus musculus Mus musculus Inhibition 40.98 % 10.1016/j.ejmech.2022.114621
Oryctolagus cuniculus Glycogen debranching enzyme IC50 390.0 nM 10.1016/j.bmc.2008.06.026
Pseudomonas aeruginosa Pseudomonas aeruginosa Inhibition 23.8 % 10.6019/CHEMBL4513141
Rattus norvegicus Acidic alpha-glucosidase IC50 590.0 nM 10.1016/j.bmcl.2010.11.112
Rattus norvegicus Acidic alpha-glucosidase IC50 1300.0 nM 10.1016/j.bmc.2008.06.026
Rattus norvegicus Acidic alpha-glucosidase IC50 1300.0 nM 10.1016/j.bmcl.2014.06.001
Rattus norvegicus Acidic alpha-glucosidase IC50 1300.0 nM 10.1021/jm301304e
Rattus norvegicus Acidic alpha-glucosidase Ki 460.0 nM 10.1021/jm301304e
Rattus norvegicus Lactase-glycosylceramidase Inhibition 50.0 % 10.1016/j.bmcl.2010.11.112
Rattus norvegicus Plasma Fu 1.0 None 10.1021/jm901371v
Rattus norvegicus Sucrase-isomaltase IC50 110.0 nM 10.1016/j.bmc.2008.06.026
Rattus norvegicus Sucrase-isomaltase IC50 430.0 nM 10.1016/j.bmc.2016.06.013
Rattus norvegicus Sucrase-isomaltase IC50 1000.0 nM 10.1016/j.bmcl.2010.11.112
Rattus norvegicus Sucrase-isomaltase IC50 1000.0 nM 10.1016/j.bmcl.2014.06.001
Rattus norvegicus Sucrase-isomaltase IC50 1000.0 nM 10.1021/jm301304e
Rattus norvegicus Sucrase-isomaltase IC50 1200.0 nM 10.1016/j.bmc.2008.06.026
Rattus norvegicus Sucrase-isomaltase IC50 4600.0 nM 10.1016/j.bmc.2016.06.013
Rattus norvegicus Sucrase-isomaltase IC50 39000.0 nM 10.1016/j.bmcl.2010.11.112
Rattus norvegicus Sucrase-isomaltase IC50 39000.0 nM 10.1016/j.bmcl.2014.06.001
Rattus norvegicus Sucrase-isomaltase IC50 39000.0 nM 10.1021/jm301304e
Saccharomyces cerevisiae Alpha-glucosidase MAL62 Inhibition 50.0 % 10.1021/np010360f
Saccharomyces cerevisiae S288c Oligo-1,6-glucosidase IC50 9900000.0 nM 10.1016/j.bmcl.2009.08.012
Severe acute respiratory syndrome coronavirus 2 Replicase polyprotein 1ab Inhibition 9.83 % 10.6019/CHEMBL4495564
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Hit score 0.2289 None 10.1101/2020.04.21.054387
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 IC50 19952.62 nM 10.6019/CHEMBL4651402
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 IC50 20000.0 nM 10.6019/CHEMBL4651402
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition 0.15 % 10.6019/CHEMBL4495565
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition index 0.0664 None 10.1101/2020.04.03.023846
Staphylococcus aureus Staphylococcus aureus Inhibition 16.69 % 10.6019/CHEMBL4513141
Sus scrofa Uncharacterized protein IC50 700000.0 nM 10.1021/np010360f
None ADMET CL 1.7 mL.min-1.kg-1 10.1124/dmd.108.020479
None ADMET MRT 2.7 hr 10.1124/dmd.108.020479
None ADMET T1/2 2.3 hr 10.1124/dmd.108.020479
None ADMET Vdss 0.28 L.kg-1 10.1124/dmd.108.020479
None Hepatotoxicity HepSE_bilirubinemia 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_cholecystitis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_cholelithiasis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_cirrhosis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_Combined Scores 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_elevated liver function tests 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatic failure 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatic necrosis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatitis 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_hepatomegaly 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_jaundice 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver disease 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver fatty 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver function tests abnormal 0.0 None 10.1371/journal.pcbi.1002310
None NON-PROTEIN TARGET Fu 1.0 None 10.1124/dmd.108.020479
None Unchecked Ac50 1.585 uM None
None Unchecked Ac50 1.995 uM None
None Unchecked Ac50 14.13 uM None
None Unchecked Ac50 17.78 uM None
None Unchecked Ac50 31.62 uM None
None Unchecked AC50 1584.9 nM None
None Unchecked AC50 1995.3 nM None
None Unchecked AC50 14130.0 nM None
None Unchecked AC50 17782.8 nM None
None Unchecked AC50 31622.8 nM None
None Unchecked IC50 50.0 nM 10.1016/j.bmc.2017.07.026
None Unchecked IC50 59.76 ug.mL-1 10.1016/j.bmc.2019.115148
None Unchecked IC50 99.0 nM 10.1016/j.bmc.2016.11.053
None Unchecked IC50 100.0 nM 10.1021/acs.jmedchem.5b00951
None Unchecked IC50 590.0 nM 10.1016/j.bmc.2016.11.053
None Unchecked IC50 1300.0 nM 10.1021/jm301304e
None Unchecked IC50 2430.0 nM 10.1016/j.bmcl.2017.08.035
None Unchecked IC50 8200.0 nM 10.1016/j.bmc.2016.06.013
None Unchecked IC50 164000.0 nM 10.1016/j.bmc.2016.11.053
None Unchecked IC50 171000.0 nM 10.1016/j.bmc.2014.09.034
None Unchecked IC50 200000.0 nM 10.1021/jm901281m
None Unchecked IC50 201360.0 nM 10.1016/j.bmcl.2017.10.025
None Unchecked IC50 342000.0 nM 10.1021/acs.jmedchem.5b00951
None Unchecked IC50 378000.0 nM 10.1016/j.bmc.2016.11.053
None Unchecked IC50 462200.0 nM 10.1016/j.bmcl.2017.04.078
None Unchecked IC50 462200.0 nM 10.1016/j.ejmech.2018.02.072
None Unchecked IC50 462200.0 nM 10.1039/C7MD00162B
None Unchecked IC50 1850000.0 nM 10.1016/j.bmc.2014.09.034
None Unchecked Inhibition 50.0 % 10.1016/j.bmc.2008.06.026
None Unchecked Inhibition 50.0 % 10.1016/j.bmcl.2010.11.112
None Unchecked Inhibition 50.0 % 10.1021/acs.jmedchem.5b00951
None Unchecked Inhibition 50.0 % 10.1021/np010360f
None Unchecked Inhibition nan % 10.1016/j.bmc.2017.07.026
None Unchecked Inhibition nan % 10.1016/j.ejmech.2022.114621
None Unchecked Kd 20640.0 nM 10.1021/acs.jmedchem.1c00036
None Unchecked Kd nan None 10.1021/acs.jmedchem.1c00036
None Unchecked Ki 28.0 nM 10.1016/j.bmc.2017.07.026
None Unchecked Ki 60.0 nM 10.1021/acs.jmedchem.5b00951
None Unchecked Ki 130.0 nM 10.1016/j.bmc.2011.05.033
None Unchecked Ki 148.0 nM 10.1016/j.bmc.2011.05.033
None Unchecked Ki 180.0 nM 10.1016/j.ejmech.2022.114621
None Unchecked Ki 211.0 nM 10.1016/j.bmc.2011.05.033
None Unchecked Ki 230.0 nM 10.1016/j.bmc.2011.05.033
None Unchecked Ki 1000.0 nM 10.1016/j.bmc.2011.05.033
None Unchecked Ki 20840.0 nM 10.1016/j.ejmech.2022.114621
None Unchecked Ki 32000.0 nM 10.1021/acs.jmedchem.5b00951
None Unchecked Ratio Ki 4.0 None 10.1016/j.bmc.2011.05.033

Metabolism Information