Navigation

name Structure Reference Source Properties Activities Metabolism

None

AlkaPlorer ID: AK323222

Synonym: None

IUPAC Name: 5-[[4-[(1-methylcyclohexyl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione

Structure

SMILES: CC1(COC2=CC=C(CC3SC(=O)N=C3O)C=C2)CCCCC1

copy

InChI: InChI=1S/C18H23NO3S/c1-18(9-3-2-4-10-18)12-22-14-7-5-13(6-8-14)11-15-16(20)19-17(21)23-15/h5-8,15H,2-4,9-12H2,1H3,(H,19,20,21)

copy

InChIKey: YZFWTZACSRHJQD-UHFFFAOYSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Chamaemelum nobile Chamaemelum Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 333.4530000000002

TPSA？: 58.89

MolLogP？: 4.770200000000004

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bos taurus Aldose reductase Inhibition 9.0 % 10.1021/jm00102a016
Bos taurus Aldose reductase Inhibition nan % 10.1021/jm00102a016
Bos taurus Progesterone receptor IC50 29118.0 nM None
Bos taurus Progesterone receptor Ki 3798.0 nM None
Cavia porcellus Leukotriene C4 synthase IC50 nan None None
Cavia porcellus Leukotriene C4 synthase Ki nan None None
Cavia porcellus Serotonin 4 (5-HT4) receptor IC50 nan None None
Cavia porcellus Serotonin 4 (5-HT4) receptor Ki nan None None
Equus caballus Ferritin light chain Potency 14125.4 nM None
Equus caballus Ferritin light chain Potency 35481.3 nM None
Hepatitis B virus Hepatitis B virus IC50 5000.0 nM 10.1021/acs.jmedchem.2c01097
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] IC50 2700.0 nM 10.1016/j.bmcl.2013.11.081
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] IC50 2700.0 nM 10.1016/j.ejmech.2017.02.031
Homo sapiens Acetylcholinesterase IC50 15026.0 nM None
Homo sapiens Acetylcholinesterase Ki nan None None
Homo sapiens Adenosine A1 receptor IC50 nan None None
Homo sapiens Adenosine A1 receptor Ki nan None None
Homo sapiens Adenosine A2a receptor IC50 nan None None
Homo sapiens Adenosine A2a receptor Ki nan None None
Homo sapiens Adenosine A3 receptor IC50 3047.0 nM None
Homo sapiens Adenosine A3 receptor Ki 1722.0 nM None
Homo sapiens Alpha-1d adrenergic receptor IC50 nan None None
Homo sapiens Alpha-1d adrenergic receptor Ki nan None None
Homo sapiens Alpha-2a adrenergic receptor IC50 16551.0 nM None
Homo sapiens Alpha-2a adrenergic receptor Ki 6207.0 nM None
Homo sapiens Alpha-2b adrenergic receptor IC50 13258.0 nM None
Homo sapiens Alpha-2b adrenergic receptor Ki 6053.0 nM None
Homo sapiens Alpha-2c adrenergic receptor IC50 nan None None
Homo sapiens Alpha-2c adrenergic receptor Ki nan None None
Homo sapiens AMP-activated protein kinase, AMPK Activity nan None 10.1021/jm901773d
Homo sapiens Androgen Receptor Potency 39810.7 nM None
Homo sapiens Angiotensin II type 2 (AT-2) receptor IC50 nan None None
Homo sapiens Angiotensin II type 2 (AT-2) receptor Ki nan None None
Homo sapiens Aryl hydrocarbon receptor Potency 56234.1 nM None
Homo sapiens ATP-dependent DNA helicase Q1 Potency 39810.7 nM None
Homo sapiens Beta-1 adrenergic receptor IC50 nan None None
Homo sapiens Beta-1 adrenergic receptor Ki nan None None
Homo sapiens Beta-2 adrenergic receptor IC50 nan None None
Homo sapiens Beta-2 adrenergic receptor Ki nan None None
Homo sapiens Beta-3 adrenergic receptor IC50 17871.0 nM None
Homo sapiens Beta-3 adrenergic receptor Ki 13403.0 nM None
Homo sapiens Bile acid receptor FXR Potency 35481.3 nM None
Homo sapiens Bile salt export pump IC50 37800.0 nM 10.1093/toxsci/kfq269
Homo sapiens Bile salt export pump IC50 37800.0 nM 10.1093/toxsci/kft176
Homo sapiens Bloom syndrome protein Potency 35481.3 nM None
Homo sapiens Bradykinin B2 receptor IC50 nan None None
Homo sapiens Bradykinin B2 receptor Ki nan None None
Homo sapiens Calcitonin receptor IC50 nan None None
Homo sapiens Calcitonin receptor Ki nan None None
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 Cannabinoid CB1 receptor IC50 nan None None
Homo sapiens Cannabinoid CB1 receptor Ki nan None None
Homo sapiens Carbonic anhydrase II IC50 86.0 nM None
Homo sapiens Carbonic anhydrase II Ki nan None None
Homo sapiens Caspase-1 IC50 nan None None
Homo sapiens Caspase-1 Ki nan None None
Homo sapiens Cathepsin G IC50 nan None None
Homo sapiens Cathepsin G Ki nan None None
Homo sapiens C-C chemokine receptor type 2 IC50 nan None None
Homo sapiens C-C chemokine receptor type 2 Ki nan None None
Homo sapiens C-C chemokine receptor type 4 IC50 nan None None
Homo sapiens C-C chemokine receptor type 4 Ki nan None None
Homo sapiens C-C chemokine receptor type 5 IC50 nan None None
Homo sapiens C-C chemokine receptor type 5 Ki nan None None
Homo sapiens CDGSH iron-sulfur domain-containing protein 1 IC50 nan None 10.1016/j.bmcl.2016.09.009
Homo sapiens CDGSH iron-sulfur domain-containing protein 1 Ki nan None 10.1016/j.bmcl.2016.09.009
Homo sapiens Cellular tumor antigen p53 Potency 56234.1 nM None
Homo sapiens Cholecystokinin A receptor IC50 nan None None
Homo sapiens Cholecystokinin A receptor Ki nan None None
Homo sapiens Cyclooxygenase-1 IC50 nan None None
Homo sapiens Cyclooxygenase-1 Ki nan None None
Homo sapiens Cyclooxygenase-2 IC50 nan None None
Homo sapiens Cyclooxygenase-2 Ki nan None None
Homo sapiens Cysteinyl leukotriene receptor 1 IC50 nan None None
Homo sapiens Cysteinyl leukotriene receptor 1 Ki nan None None
Homo sapiens Cytochrome P450 1A2 IC50 nan None None
Homo sapiens Cytochrome P450 1A2 Ki nan None None
Homo sapiens Cytochrome P450 2A6 IC50 nan None None
Homo sapiens Cytochrome P450 2A6 Ki nan None None
Homo sapiens Cytochrome P450 2C19 IC50 nan None None
Homo sapiens Cytochrome P450 2C19 Ki nan None None
Homo sapiens Cytochrome P450 2C9 IC50 nan None None
Homo sapiens Cytochrome P450 2C9 Ki nan None None
Homo sapiens Cytochrome P450 2D6 IC50 nan None None
Homo sapiens Cytochrome P450 2D6 Ki nan None None
Homo sapiens Cytochrome P450 2E1 IC50 nan None None
Homo sapiens Cytochrome P450 2E1 Ki nan None None
Homo sapiens Cytochrome P450 3A4 IC50 nan None None
Homo sapiens Cytochrome P450 3A4 Ki nan None None
Homo sapiens Delta opioid receptor IC50 26894.0 nM None
Homo sapiens Delta opioid receptor Ki 9481.0 nM None
Homo sapiens Dopamine D1 receptor IC50 19785.0 nM None
Homo sapiens Dopamine D1 receptor Ki 9893.0 nM None
Homo sapiens Dopamine D2 receptor IC50 nan None None
Homo sapiens Dopamine D2 receptor Ki nan None None
Homo sapiens Dopamine D3 receptor IC50 26704.0 nM None
Homo sapiens Dopamine D3 receptor Ki 9069.0 nM None
Homo sapiens Dopamine D4 receptor IC50 nan None None
Homo sapiens Dopamine D4 receptor Ki nan None None
Homo sapiens Dopamine transporter IC50 nan None None
Homo sapiens Dopamine transporter Ki nan None None
Homo sapiens EA.hy 926 Activity nan None 10.1016/j.bmc.2008.10.083
Homo sapiens Endothelin receptor ET-A IC50 nan None None
Homo sapiens Endothelin receptor ET-A Ki nan None None
Homo sapiens Epidermal growth factor receptor erbB1 IC50 4655.0 nM None
Homo sapiens Epidermal growth factor receptor erbB1 Ki nan None None
Homo sapiens Estrogen receptor alpha IC50 nan None None
Homo sapiens Estrogen receptor alpha Ki nan None None
Homo sapiens Estrogen receptor alpha Potency 35481.3 nM None
Homo sapiens Estrogen receptor alpha Potency 44668.4 nM None
Homo sapiens Estrogen receptor beta IC50 nan None None
Homo sapiens Estrogen receptor beta Ki nan None None
Homo sapiens Geminin Potency 8414.4 nM None
Homo sapiens Glucocorticoid receptor IC50 nan None None
Homo sapiens Glucocorticoid receptor Ki nan None None
Homo sapiens Glucocorticoid receptor Potency 44668.4 nM None
Homo sapiens Glucocorticoid receptor Potency 50118.7 nM None
Homo sapiens HERG IC50 nan None None
Homo sapiens HERG Ki nan None None
Homo sapiens Histamine H1 receptor IC50 nan None None
Homo sapiens Histamine H1 receptor Ki nan None None
Homo sapiens Histamine H2 receptor IC50 nan None None
Homo sapiens Histamine H2 receptor Ki nan None None
Homo sapiens Histone acetyltransferase GCN5 Potency 25118.9 nM None
Homo sapiens Histone acetyltransferase GCN5 Potency 31622.8 nM None
Homo sapiens Histone deacetylase 6 Inhibition -53.56 % 10.6019/CHEMBL4808148
Homo sapiens Histone deacetylase 6 Inhibition 1.94 % 10.6019/CHEMBL4808148
Homo sapiens HMG-CoA reductase IC50 nan None None
Homo sapiens HMG-CoA reductase Ki nan None None
Homo sapiens Interleukin-8 receptor A IC50 nan None None
Homo sapiens Interleukin-8 receptor A Ki nan None None
Homo sapiens Interleukin-8 receptor B IC50 nan None None
Homo sapiens Interleukin-8 receptor B Ki nan None None
Homo sapiens Kappa opioid receptor IC50 nan None None
Homo sapiens Kappa opioid receptor Ki nan None None
Homo sapiens Leukocyte common antigen IC50 nan None None
Homo sapiens Leukocyte common antigen Ki nan None None
Homo sapiens Leukocyte elastase IC50 nan None None
Homo sapiens Leukocyte elastase Ki nan None None
Homo sapiens LNCaP Activity nan None 10.1021/jm300015m
Homo sapiens LNCaP Activity nan None 10.1021/jm701212m
Homo sapiens LNCaP IC50 60000.0 nM 10.1021/jm300015m
Homo sapiens MAP kinase ERK1 IC50 nan None None
Homo sapiens MAP kinase ERK1 Ki nan None None
Homo sapiens MAP kinase ERK2 IC50 nan None None
Homo sapiens MAP kinase ERK2 Ki nan None None
Homo sapiens MAP kinase p38 alpha IC50 nan None None
Homo sapiens MAP kinase p38 alpha Ki nan None None
Homo sapiens Matrix metalloproteinase-1 IC50 nan None None
Homo sapiens Matrix metalloproteinase-1 Ki nan None None
Homo sapiens Matrix metalloproteinase 9 IC50 nan None None
Homo sapiens Matrix metalloproteinase 9 Ki nan None None
Homo sapiens Melanocortin receptor 3 IC50 nan None None
Homo sapiens Melanocortin receptor 3 Ki nan None None
Homo sapiens Melanocortin receptor 4 IC50 nan None None
Homo sapiens Melanocortin receptor 4 Ki nan None None
Homo sapiens Melanocortin receptor 5 IC50 28621.0 nM None
Homo sapiens Melanocortin receptor 5 Ki 26848.0 nM None
Homo sapiens Menin/Histone-lysine N-methyltransferase MLL Potency 17782.8 nM None
Homo sapiens Monoamine oxidase A IC50 29193.0 nM None
Homo sapiens Monoamine oxidase A Ki nan None None
Homo sapiens Monoamine oxidase B IC50 225.0 nM 10.1016/j.bmcl.2010.06.128
Homo sapiens Monoamine oxidase B IC50 225.0 nM 10.1016/j.bmcl.2022.128994
Homo sapiens Multidrug resistance-associated protein 4 IC50 133000.0 nM 10.1093/toxsci/kft176
Homo sapiens Mu opioid receptor IC50 nan None None
Homo sapiens Mu opioid receptor Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M1 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M1 Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M2 IC50 21107.0 nM None
Homo sapiens Muscarinic acetylcholine receptor M2 Ki 7505.0 nM None
Homo sapiens Muscarinic acetylcholine receptor M3 IC50 14947.0 nM None
Homo sapiens Muscarinic acetylcholine receptor M3 Ki 3168.0 nM None
Homo sapiens Muscarinic acetylcholine receptor M4 IC50 16224.0 nM None
Homo sapiens Muscarinic acetylcholine receptor M4 Ki 2263.0 nM None
Homo sapiens Muscarinic acetylcholine receptor M5 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M5 Ki nan None None
Homo sapiens Neurokinin 1 receptor IC50 nan None None
Homo sapiens Neurokinin 1 receptor Ki nan None None
Homo sapiens Neurokinin 2 receptor IC50 12576.0 nM None
Homo sapiens Neurokinin 2 receptor Ki 4192.0 nM None
Homo sapiens Neuropeptide Y receptor type 1 IC50 nan None None
Homo sapiens Neuropeptide Y receptor type 1 Ki nan None None
Homo sapiens Neuropeptide Y receptor type 2 IC50 nan None None
Homo sapiens Neuropeptide Y receptor type 2 Ki nan None None
Homo sapiens Norepinephrine transporter IC50 2220.0 nM None
Homo sapiens Norepinephrine transporter Ki 2201.0 nM None
Homo sapiens Nuclear factor erythroid 2-related factor 2 Potency 9688.5 nM None
Homo sapiens Nuclear factor erythroid 2-related factor 2 Potency 76958.8 nM None
Homo sapiens PC-3 FC 0.934 None 10.1038/nchembio790
Homo sapiens Peroxisome proliferator-activated receptor alpha Activity nan None 10.1016/j.bmcl.2013.03.024
Homo sapiens Peroxisome proliferator-activated receptor alpha Potency 44668.4 nM None
Homo sapiens Peroxisome proliferator-activated receptor delta Activity nan None 10.1016/j.bmcl.2013.03.024
Homo sapiens Peroxisome proliferator-activated receptor delta Potency 17782.8 nM None
Homo sapiens Peroxisome proliferator-activated receptor delta Potency 44668.4 nM None
Homo sapiens Peroxisome proliferator-activated receptor gamma Activity 2.5 None 10.1021/jm701212m
Homo sapiens Peroxisome proliferator-activated receptor gamma Activity nan None 10.1016/j.bmcl.2013.03.024
Homo sapiens Peroxisome proliferator-activated receptor gamma Activity nan None 10.1021/jm901773d
Homo sapiens Peroxisome proliferator-activated receptor gamma Activity nan None 10.1021/np050397q
Homo sapiens Peroxisome proliferator-activated receptor gamma EC50 3000.0 nM 10.1007/s00044-010-9428-9
Homo sapiens Peroxisome proliferator-activated receptor gamma EC50 14900.0 nM 10.1021/np010440j
Homo sapiens Peroxisome proliferator-activated receptor gamma EC50 22908.68 nM 10.1021/jm9804127
Homo sapiens Peroxisome proliferator-activated receptor gamma FC 3.65 None 10.1021/np400780n
Homo sapiens Peroxisome proliferator-activated receptor gamma FC 15.0 None 10.1021/np010440j
Homo sapiens Peroxisome proliferator-activated receptor gamma IC50 5000.0 nM 10.1016/j.bmc.2018.10.033
Homo sapiens Peroxisome proliferator-activated receptor gamma Ki 3090.3 nM 10.1021/jm9804127
Homo sapiens Peroxisome proliferator-activated receptor gamma Potency 7079.5 nM None
Homo sapiens Phosphodiesterase 5A IC50 nan None None
Homo sapiens Phosphodiesterase 5A Ki nan None None
Homo sapiens Platelet activating factor receptor IC50 nan None None
Homo sapiens Platelet activating factor receptor Ki nan None None
Homo sapiens Pregnane X receptor EC50 4500.0 nM 10.1124/dmd.110.035105
Homo sapiens Pregnane X receptor EC50 10000.0 nM 10.1124/dmd.110.035105
Homo sapiens Pregnane X receptor EC50 14100.0 nM 10.1124/dmd.110.035105
Homo sapiens Pregnane X receptor Efficacy 84.1 % 10.1124/dmd.110.035105
Homo sapiens Pregnane X receptor Efficacy 96.1 % 10.1124/dmd.110.035105
Homo sapiens Pregnane X receptor Efficacy 108.0 % 10.1124/dmd.110.035105
Homo sapiens Protein kinase C alpha IC50 nan None None
Homo sapiens Protein kinase C alpha Ki nan None None
Homo sapiens Receptor protein-tyrosine kinase erbB-2 IC50 nan None None
Homo sapiens Receptor protein-tyrosine kinase erbB-2 Ki nan None None
Homo sapiens Regulator of G-protein signaling 4 Potency 188.9 nM None
Homo sapiens Retinoid X receptor alpha Potency 25118.9 nM None
Homo sapiens Ribosomal protein S6 kinase 1 Activity nan None 10.1021/jm901773d
Homo sapiens Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform IC50 nan None None
Homo sapiens Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform Ki nan None None
Homo sapiens Serotonin 2a (5-HT2a) receptor IC50 nan None None
Homo sapiens Serotonin 2a (5-HT2a) receptor Ki nan None None
Homo sapiens Serotonin 2b (5-HT2b) receptor IC50 nan None None
Homo sapiens Serotonin 2b (5-HT2b) receptor Ki nan None None
Homo sapiens Serotonin 2c (5-HT2c) receptor IC50 nan None None
Homo sapiens Serotonin 2c (5-HT2c) receptor Ki nan None None
Homo sapiens Serotonin 6 (5-HT6) receptor IC50 nan None None
Homo sapiens Serotonin 6 (5-HT6) receptor Ki nan None None
Homo sapiens Serotonin transporter IC50 14948.0 nM None
Homo sapiens Serotonin transporter Ki 7941.0 nM None
Homo sapiens Sigma opioid receptor IC50 nan None None
Homo sapiens Sigma opioid receptor Ki nan None None
Homo sapiens Signal transducer and activator of transcription 3 Activity nan None 10.1021/jm901773d
Homo sapiens THP-1 Activity nan None 10.1021/jm901773d
Homo sapiens Thromboxane-A synthase IC50 nan None None
Homo sapiens Thromboxane-A synthase Ki nan None None
Homo sapiens Tyrosine-protein kinase FYN IC50 nan None None
Homo sapiens Tyrosine-protein kinase FYN Ki nan None None
Homo sapiens Tyrosine-protein kinase LCK IC50 nan None None
Homo sapiens Tyrosine-protein kinase LCK Ki nan None None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 31.6 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 8414.4 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 29855.4 nM None
Homo sapiens Ubiquitin carboxyl-terminal hydrolase 1 Potency 19952.6 nM None
Homo sapiens Vascular endothelial growth factor receptor 1 IC50 nan None None
Homo sapiens Vascular endothelial growth factor receptor 1 Ki nan None None
Homo sapiens Vasoactive intestinal polypeptide receptor 1 IC50 nan None None
Homo sapiens Vasoactive intestinal polypeptide receptor 1 Ki nan None None
Homo sapiens Vasopressin V1a receptor IC50 nan None None
Homo sapiens Vasopressin V1a receptor Ki nan None None
Mus musculus 3T3-L1 Effect 151.3 % 10.1021/jm00067a023
Mus musculus 3T3-L1 GT fold stimulation 1.49 None 10.1021/jm00105a050
Mus musculus 3T3-L1 GT fold stimulation 1.51 None 10.1021/jm00105a050
Mus musculus Mus musculus Activity 70.0 % 10.1021/jm00083a021
Mus musculus Mus musculus Change -28.0 % 10.1021/jm00004a008
Mus musculus Mus musculus Decrease -35.0 % 10.1021/jm00167a022
Mus musculus Mus musculus Decrease -29.0 % 10.1021/jm00085a002
Mus musculus Mus musculus Decrease -15.0 % 10.1021/jm00085a002
Mus musculus Mus musculus Decrease 7.9 % 10.1021/jm00122a022
Mus musculus Mus musculus Decrease 10.8 % 10.1021/jm00122a022
Mus musculus Mus musculus Decrease 15.0 % 10.1021/jm9706168
Mus musculus Mus musculus Decrease 18.7 % 10.1021/jm00122a022
Mus musculus Mus musculus Decrease 32.0 % 10.1021/jm00102a016
Mus musculus Mus musculus Decrease 32.0 % 10.1021/jm9706168
Mus musculus Mus musculus Decrease 32.0 % 10.1021/jm990476x
Mus musculus Mus musculus Decrease 39.0 % 10.1021/jm9706168
Mus musculus Mus musculus Decrease 43.0 % 10.1021/jm9706168
Mus musculus Mus musculus DOSE 35.7 mg.kg-1 10.1021/jm00122a022
Mus musculus Mus musculus ED25 25.0 mg kg-1 day-1 10.1021/jm00092a012
Mus musculus Mus musculus ED25 25.0 mg kg-1 day-1 10.1021/jm010490l
Mus musculus Mus musculus ED25 31.0 mg kg-1 day-1 10.1021/jm00092a012
Mus musculus Mus musculus Glucose level 189.0 mg dl-1 10.1021/jm00069a006
Mus musculus Mus musculus Glucose normalisation 52.0 % 10.1021/jm00105a050
Mus musculus Mus musculus Glucose normalisation 84.0 % 10.1021/jm00105a050
Mus musculus Mus musculus Inhibition 39.0 % 10.1021/jm990260v
Mus musculus Mus musculus Inhibition 43.0 % 10.1021/jm990260v
Mus musculus Mus musculus MED 3000.0 uM kg-1 10.1021/jm950395a
Mus musculus Mus musculus MED 3000.0 uM.kg/diet 10.1016/S0960-894X(01)80325-5
Mus musculus Mus musculus Normalization 100.0 % 10.1021/jm00088a022
Mus musculus Mus musculus Plasma glucose 107.0 mg dl-1 10.1021/jm00121a003
Mus musculus Mus musculus Plasma glucose 191.0 mg dl-1 10.1021/jm00121a003
Mus musculus Mus musculus Plasma glucose 320.0 mg dl-1 10.1021/jm00121a003
Mus musculus Mus musculus Plasma glucose 348.0 mg dl-1 10.1021/jm00121a003
Mus musculus Mus musculus Plasma glucose level 285.0 mg dl-1 10.1021/jm00167a022
Mus musculus Mus musculus Plasma glucose level 313.0 mg dl-1 10.1021/jm00167a022
Mus musculus Mus musculus Plasma insulin 20.0 ml 10.1021/jm00121a003
Mus musculus Mus musculus Plasma insulin 25.0 ml 10.1021/jm00121a003
Mus musculus Mus musculus Plasma insulin 94.0 ml 10.1021/jm00121a003
Mus musculus Mus musculus Plasma insulin 117.0 ml 10.1021/jm00121a003
Mus musculus Mus musculus Reduction 41.0 % 10.1021/jm00049a017
Mus musculus Mus musculus Reduction nan None 10.1021/jm00049a017
Mus musculus Nitric oxide synthase, inducible IC50 nan None None
Mus musculus Nitric oxide synthase, inducible Ki nan None None
Mus musculus Nuclear receptor ROR-gamma Potency 12589.3 nM None
Mus musculus Nuclear receptor ROR-gamma Potency 35481.3 nM None
Mus musculus Peroxisome proliferator-activated receptor alpha EC50 nan nM 10.1021/jm950395a
Mus musculus Peroxisome proliferator-activated receptor delta EC50 nan nM 10.1021/jm950395a
Mus musculus Peroxisome proliferator-activated receptor gamma Activity nan None 10.1016/j.bmcl.2009.02.004
Mus musculus Peroxisome proliferator-activated receptor gamma Displacement 81.0 % 10.1021/jm950395a
Mus musculus Peroxisome proliferator-activated receptor gamma EC50 3000.0 nM 10.1021/jm950395a
Oryctolagus cuniculus Angiotensin-converting enzyme IC50 nan None None
Oryctolagus cuniculus Angiotensin-converting enzyme Ki nan None None
Oryctolagus cuniculus Arachidonate 15-lipoxygenase IC50 nan None None
Oryctolagus cuniculus Arachidonate 15-lipoxygenase Ki nan None None
Photinus pyralis Luciferin 4-monooxygenase Potency 16136.6 nM None
Rattus norvegicus Aldose reductase IC50 nan None None
Rattus norvegicus Aldose reductase Ki nan None None
Rattus norvegicus Alpha-1a adrenergic receptor IC50 nan None None
Rattus norvegicus Alpha-1a adrenergic receptor Ki nan None None
Rattus norvegicus Alpha-1b adrenergic receptor IC50 nan None None
Rattus norvegicus Alpha-1b adrenergic receptor Ki nan None None
Rattus norvegicus Androgen Receptor IC50 nan None None
Rattus norvegicus Androgen Receptor Ki nan None None
Rattus norvegicus Glycine receptor IC50 nan None None
Rattus norvegicus Glycine receptor Ki nan None None
Rattus norvegicus Insulin receptor IC50 nan None None
Rattus norvegicus Insulin receptor Ki nan None None
Rattus norvegicus Nitric-oxide synthase, brain IC50 nan None None
Rattus norvegicus Nitric-oxide synthase, brain Ki nan None None
Rattus norvegicus Nuclear receptor subfamily 1 group I member 2 Activity nan None 10.1124/dmd.110.035105
Rattus norvegicus PC-12 Activity nan None 10.1016/j.bmcl.2004.02.087
Rattus norvegicus PC-12 IC50 20000.0 nM 10.1016/j.bmcl.2004.02.087
Rattus norvegicus Peripheral myelin protein 22 Potency 18105.6 nM None
Rattus norvegicus Protein-tyrosine phosphatase 1B Inhibition 20.0 % 10.1021/jm990476x
Rattus norvegicus Rattus norvegicus Blood lactate 8.0 mg dl-1 10.1021/jm00167a022
Rattus norvegicus Rattus norvegicus IC50 0.1 ug.mL-1 10.1021/jm00122a022
Rattus norvegicus Rattus norvegicus Inhibition nan % 10.1021/jm00102a016
Rattus norvegicus Rattus norvegicus Plasma glucose level 83.0 mg dl-1 10.1021/jm00167a022
Rattus norvegicus Serotonin 1a (5-HT1a) receptor IC50 nan None None
Rattus norvegicus Serotonin 1a (5-HT1a) receptor Ki nan None None
Rattus norvegicus Serotonin 1b (5-HT1b) receptor IC50 nan None None
Rattus norvegicus Serotonin 1b (5-HT1b) receptor Ki nan None None
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
None Hepatotoxicity DILI positive/negative 1.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity Hepatotoxicity nan None 10.1021/tx1000865
None Hepatotoxicity Hepatotoxicity nan None 10.1124/dmd.110.035113
None Molecular identity unknown Potency 44668.4 nM None
None No relevant target CLogP 3.57 None 10.1016/S0960-894X(01)80325-5
None No relevant target LogP 3.61 None 10.1021/jm00004a008
None No relevant target LogP 5.07 None 10.1016/j.bmcl.2004.02.087
None No relevant target pKa 6.82 None 10.1021/jm00167a022
None No relevant target pKa 7.8 None 10.1021/jm00004a008
None Unchecked 2-DG uptake stimulation 0.68 None 10.1021/jm00105a050
None Unchecked 2-DG uptake stimulation 0.82 None 10.1021/jm00105a050
None Unchecked 2-DG uptake stimulation 1.02 None 10.1021/jm00105a050
None Unchecked Ac50 1.0 uM None
None Unchecked AC50 1000.0 nM None
None Unchecked Activity 31.0 None 10.1021/jm010490l
None Unchecked IC50 78000.0 nM 10.1021/jm300015m
None Unchecked IC50 nan None None
None Unchecked Ki nan None None
None Unchecked Potency 35481.3 nM None

Metabolism Information