hydralazine
AlkaPlorer ID: AK090615
Synonym: None
IUPAC Name: phthalazin-1-ylhydrazine
Structure
SMILES: NN=C1NN=CC2=CC=CC=C12
InChI: InChI=1S/C8H8N4/c9-11-8-7-4-2-1-3-6(7)5-10-12-8/h1-5H,9H2,(H,11,12)
InChIKey: RPTUSVTUFVMDQK-UHFFFAOYSA-N
Reference
Guaianolides and other constituents of Achillea ligustica
PubChem CID: 3637
CAS: 304-20-1
LOTUS: LTS0006915
SuperNatural Ⅲ: SN0331933
COCONUT: CNP0263523
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Achillea pseudopectinata | Achillea | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 160.17999999999998
TPSA？: 67.06
MolLogP？: 0.3372999999999998
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 5011.9 | nM | None |
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 28311.2 | nM | None |
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 74500.0 | nM | None |
| Bos taurus | Lactoperoxidase | IC50 | 1200.0 | nM | 10.1021/acs.jmedchem.7b00285 |
| Bos taurus | Progesterone receptor | IC50 | nan | None | None |
| Bos taurus | Progesterone receptor | Ki | nan | None | None |
| Canis lupus familiaris | Canis familiaris | Activity | -42.0 | mmHg | 10.1021/jm00206a011 |
| Canis lupus familiaris | Canis familiaris | Activity | -21.0 | mmHg | 10.1021/jm00206a011 |
| Canis lupus familiaris | Canis familiaris | Activity | 53.0 | ml/min | 10.1021/jm00192a015 |
| Canis lupus familiaris | Canis familiaris | Activity | 53.0 | ml/min | 10.1021/jm00197a002 |
| Canis lupus familiaris | Canis familiaris | Activity | 53.0 | ml/min | 10.1021/jm00218a007 |
| Canis lupus familiaris | Canis familiaris | Activity | 53.0 | ul min-1 | 10.1021/jm00175a012 |
| Canis lupus familiaris | Canis familiaris | Activity | 66.0 | ml/min | 10.1021/jm00192a015 |
| Canis lupus familiaris | Canis familiaris | Activity | 66.0 | ml/min | 10.1021/jm00197a002 |
| Canis lupus familiaris | Canis familiaris | Activity | 66.0 | ml/min | 10.1021/jm00218a007 |
| Canis lupus familiaris | Canis familiaris | Activity | 66.0 | ul min-1 | 10.1021/jm00175a012 |
| Canis lupus familiaris | Canis familiaris | Activity | 68.0 | ml/min | 10.1021/jm00192a015 |
| Canis lupus familiaris | Canis familiaris | Activity | 78.0 | ml/min | 10.1021/jm00192a015 |
| Canis lupus familiaris | Canis familiaris | Activity | 78.0 | ml/min | 10.1021/jm00197a002 |
| Canis lupus familiaris | Canis familiaris | Activity | 78.0 | ml/min | 10.1021/jm00218a007 |
| Canis lupus familiaris | Canis familiaris | Activity | 78.0 | ul min-1 | 10.1021/jm00175a012 |
| Canis lupus familiaris | Canis familiaris | Activity | nan | None | 10.1021/jm00206a011 |
| Canis lupus familiaris | Canis familiaris | Diuretic activity | 0.65 | None | 10.1021/jm00186a024 |
| Canis lupus familiaris | Canis familiaris | Diuretic activity | 1.03 | None | 10.1021/jm00186a024 |
| Canis lupus familiaris | Canis familiaris | Diuretic activity | 1.43 | None | 10.1021/jm00186a024 |
| Canis lupus familiaris | Canis familiaris | ED50 | nan | None | 10.1021/jm00218a007 |
| Canis lupus familiaris | Canis familiaris | Heart rate | 78.0 | beats min-1 | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Heart rate | 115.0 | beats min-1 | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Heart rate | 118.0 | beats min-1 | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Heart rate | 125.0 | beats min-1 | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Heart rate | 128.0 | beats min-1 | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Heart rate | 132.0 | beats min-1 | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Heart rate | 140.0 | beats min-1 | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Pressure | 135.0 | mmHg | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Pressure | 138.0 | mmHg | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Pressure | 148.0 | mmHg | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Pressure | 188.0 | mmHg | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | Pressure | 190.0 | mmHg | 10.1021/jm00374a024 |
| Canis lupus familiaris | Canis familiaris | TIME | 2.0 | hr | 10.1021/jm00206a011 |
| Canis lupus familiaris | Canis familiaris | TIME | 6.0 | hr | 10.1021/jm00206a011 |
| Cavia porcellus | Cavia porcellus | Activity | 83.0 | mmHg | 10.1021/jm00213a015 |
| Cavia porcellus | Cavia porcellus | Activity | 89.0 | mmHg | 10.1021/jm00213a015 |
| Cavia porcellus | Cavia porcellus | Activity | 94.0 | mmHg | 10.1021/jm00213a015 |
| Cavia porcellus | Cavia porcellus | Inhibition | 0.0 | % | 10.1021/jm00114a010 |
| Cavia porcellus | Cavia porcellus | Inhibition | 20.0 | % | 10.1021/jm00114a010 |
| 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 |
| Giardia intestinalis | Putative fructose-1,6-bisphosphate aldolase | Potency | 12559.4 | nM | None |
| Homo sapiens | Acetylcholinesterase | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Acetylcholinesterase | IC50 | nan | None | 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 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Adenosine A3 receptor | IC50 | nan | None | None |
| Homo sapiens | Adenosine A3 receptor | Ki | nan | None | None |
| Homo sapiens | Aldehyde dehydrogenase 1A1 | Potency | 5011.9 | nM | None |
| Homo sapiens | Aldehyde oxidase | IC50 | 3930.0 | nM | None |
| Homo sapiens | Aldehyde oxidase | Inhibition | 96.0 | % | 10.1124/dmd.112.048546 |
| Homo sapiens | Alpha-1a adrenergic receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Alpha-2a adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Alpha-2a adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Alpha-2b adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Alpha-2b adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Alpha-2c adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Alpha-2c adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Androgen Receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | Aspartate aminotransferase, cytoplasmic | IC50 | 26620.0 | nM | 10.1016/j.bmcl.2022.128883 |
| Homo sapiens | Ataxin-2 | Potency | 446.7 | nM | None |
| Homo sapiens | ATPase family AAA domain-containing protein 5 | Potency | 366.1 | nM | None |
| Homo sapiens | ATPase family AAA domain-containing protein 5 | Potency | 819.6 | 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 | nan | None | None |
| Homo sapiens | Beta-3 adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Bile salt export pump | IC50 | 1000000.0 | nM | 10.1124/dmd.112.047068 |
| 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 | Cannabinoid CB1 receptor | IC50 | nan | None | None |
| Homo sapiens | Cannabinoid CB1 receptor | Ki | nan | None | None |
| Homo sapiens | Carbonic anhydrase II | IC50 | nan | None | 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 | Cellular tumor antigen p53 | Potency | 1584.9 | nM | None |
| Homo sapiens | Cellular tumor antigen p53 | Potency | 2511.9 | nM | None |
| Homo sapiens | Cellular tumor antigen p53 | Potency | 3981.1 | nM | None |
| Homo sapiens | Cerebroside-sulfatase | Potency | 26854.5 | nM | None |
| Homo sapiens | Cholecystokinin A receptor | IC50 | nan | None | None |
| Homo sapiens | Cholecystokinin A receptor | Ki | nan | None | None |
| Homo sapiens | Cyclooxygenase-1 | AC50 | 6184.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Cyclooxygenase-1 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | AC50 | 1000.0 | nM | None |
| Homo sapiens | Cytochrome P450 1A2 | AC50 | 3162.28 | nM | None |
| Homo sapiens | Cytochrome P450 1A2 | Activity | 89.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 1A2 | Activity | 100.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 1A2 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 1A2 | Inhibition | nan | % | 10.1021/tx300075j |
| 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 | AC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2C19 | Activity | 90.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2C19 | Activity | 103.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2C19 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2C19 | Inhibition | nan | % | 10.1021/tx300075j |
| Homo sapiens | Cytochrome P450 2C19 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2C8 | Activity | 95.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2C8 | Activity | 108.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2C9 | AC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2C9 | Activity | 95.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2C9 | Activity | 105.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2C9 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2C9 | Inhibition | nan | % | 10.1021/tx300075j |
| Homo sapiens | Cytochrome P450 2C9 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2D6 | AC50 | 12589.25 | nM | None |
| Homo sapiens | Cytochrome P450 2D6 | AC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2D6 | Activity | 77.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2D6 | Activity | 92.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 2D6 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2D6 | Inhibition | nan | % | 10.1021/tx300075j |
| Homo sapiens | Cytochrome P450 2D6 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2D6 | Potency | 12589.3 | nM | None |
| Homo sapiens | Cytochrome P450 2E1 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2E1 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 3A | Activity | 76.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 3A | Activity | 98.0 | % | 10.1124/dmd.112.045195 |
| Homo sapiens | Cytochrome P450 3A4 | AC50 | 3981.07 | nM | None |
| Homo sapiens | Cytochrome P450 3A4 | AC50 | 12589.25 | nM | None |
| Homo sapiens | Cytochrome P450 3A4 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 3A4 | Inhibition | nan | % | 10.1021/tx300075j |
| Homo sapiens | Cytochrome P450 3A4 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 3A4 | Potency | 3981.1 | nM | None |
| Homo sapiens | Cytochrome P450 3A4 | Potency | 12589.3 | nM | None |
| Homo sapiens | Delta opioid receptor | IC50 | nan | None | None |
| Homo sapiens | Delta opioid receptor | Ki | nan | None | None |
| Homo sapiens | DNA (cytosine-5)-methyltransferase 1 | Inhibition | 86.0 | % | 10.1016/j.bmc.2009.11.050 |
| Homo sapiens | DNA (cytosine-5)-methyltransferase 3B | Inhibition | 109.0 | % | 10.1016/j.bmc.2009.11.050 |
| Homo sapiens | Dopamine D1 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Dopamine D1 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D1 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine D2 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D2 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine D3 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Dopamine D3 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D3 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine D4 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D4 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine transporter | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Dopamine transporter | IC50 | nan | None | None |
| Homo sapiens | Dopamine transporter | Ki | nan | None | None |
| 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 | nan | None | None |
| Homo sapiens | Epidermal growth factor receptor erbB1 | Ki | nan | None | None |
| Homo sapiens | Estrogen receptor alpha | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Estrogen receptor alpha | IC50 | nan | None | None |
| Homo sapiens | Estrogen receptor alpha | Ki | nan | None | None |
| Homo sapiens | Estrogen receptor beta | IC50 | nan | None | None |
| Homo sapiens | Estrogen receptor beta | Ki | nan | None | None |
| 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 | Glucocorticoid receptor | IC50 | nan | None | None |
| Homo sapiens | Glucocorticoid receptor | Ki | nan | None | None |
| Homo sapiens | HEK293 | Potency | 410.8 | nM | None |
| Homo sapiens | HERG | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | Histamine H3 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Histone deacetylase 6 | Inhibition | -52.57 | % | 10.6019/CHEMBL4808148 |
| Homo sapiens | Histone deacetylase 6 | Inhibition | 8.32 | % | 10.6019/CHEMBL4808148 |
| Homo sapiens | Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 | Potency | 7943.3 | nM | None |
| Homo sapiens | HMEC-1 | Activity | nan | None | 10.1021/jm7014793 |
| Homo sapiens | HMG-CoA reductase | IC50 | nan | None | None |
| Homo sapiens | HMG-CoA reductase | Ki | nan | None | None |
| Homo sapiens | Homo sapiens | CL | 85.0 | mL.min-1.kg-1 | 10.1021/jm900403j |
| Homo sapiens | Homo sapiens | CL_renal | 10.8 | mL.min-1.kg-1 | 10.1021/jm900403j |
| Homo sapiens | Homo sapiens | DILI_Concern | nan | None | 10.1016/j.drudis.2016.02.015 |
| Homo sapiens | Homo sapiens | DILI_severity_class | 3.0 | None | 10.1016/j.drudis.2016.02.015 |
| Homo sapiens | Homo sapiens | Drugexcretion | 7.0 | % | 10.1021/jm00192a012 |
| 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 | Liver microsomes | Activity | nan | None | 10.1021/tx300075j |
| Homo sapiens | Liver microsomes | Stability | nan | % | 10.1021/tx300075j |
| Homo sapiens | Lysine-specific demethylase 4D-like | Potency | 12589.3 | nM | None |
| 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 | nan | None | None |
| Homo sapiens | Melanocortin receptor 5 | Ki | nan | None | None |
| Homo sapiens | Monoamine oxidase A | AC50 | 23389.4 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Monoamine oxidase A | IC50 | nan | None | None |
| Homo sapiens | Monoamine oxidase A | Ki | nan | None | None |
| Homo sapiens | Mu opioid receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Mu opioid receptor | IC50 | nan | None | None |
| Homo sapiens | Mu opioid receptor | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M1 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Muscarinic acetylcholine receptor M2 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M2 | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M3 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M3 | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M4 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M4 | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M5 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M5 | Ki | nan | None | None |
| Homo sapiens | Myeloperoxidase | Activity | 6.0 | % | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Myeloperoxidase | Activity | 9.0 | % | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Myeloperoxidase | Activity | 19.0 | % | 10.1021/acsmedchemlett.6b00417 |
| Homo sapiens | Myeloperoxidase | Activity | 76.0 | % | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Myeloperoxidase | Activity | 92.0 | % | 10.1021/acsmedchemlett.6b00417 |
| Homo sapiens | Myeloperoxidase | Activity | nan | None | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Myeloperoxidase | IC50 | 900.0 | nM | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Myeloperoxidase | IC50 | 900.0 | nM | 10.1021/acsmedchemlett.6b00417 |
| Homo sapiens | Myeloperoxidase | IC50 | 2360.0 | nM | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Myeloperoxidase | Inhibition | 61.0 | % | 10.1021/acsmedchemlett.6b00417 |
| Homo sapiens | Myeloperoxidase | Inhibition | nan | % | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Myeloperoxidase | K | 7.1 | 10'5/M/s | 10.1021/acsmedchemlett.6b00417 |
| Homo sapiens | Myeloperoxidase | Kapp | 7.1 | 10'6/M/s | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Neurokinin 1 receptor | IC50 | nan | None | None |
| Homo sapiens | Neurokinin 1 receptor | Ki | nan | None | None |
| Homo sapiens | Neurokinin 2 receptor | IC50 | nan | None | None |
| Homo sapiens | Neurokinin 2 receptor | Ki | nan | None | 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 | NHDF | IC50 | 50000.0 | nM | 10.1021/acs.jmedchem.7b00285 |
| Homo sapiens | Niemann-Pick C1 protein | Potency | 2592.9 | nM | None |
| Homo sapiens | Norepinephrine transporter | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Norepinephrine transporter | IC50 | nan | None | None |
| Homo sapiens | Norepinephrine transporter | Ki | nan | None | None |
| Homo sapiens | Nuclear factor erythroid 2-related factor 2 | Potency | 1158.2 | nM | None |
| Homo sapiens | Peroxisomal acyl-coenzyme A oxidase 1 | IC50 | 420.0 | nM | 10.1021/acsmedchemlett.3c00017 |
| Homo sapiens | Phosphodiesterase 3A | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Phosphodiesterase 4 | Inhibition | 0.0 | % | 10.1021/jm00114a010 |
| Homo sapiens | Phosphodiesterase 4A | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | Prelamin-A/C | Potency | 3162.3 | nM | None |
| Homo sapiens | Progesterone receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Protein kinase C alpha | IC50 | nan | None | None |
| Homo sapiens | Protein kinase C alpha | Ki | nan | None | None |
| Homo sapiens | Pyruvate kinase isozymes M1/M2 | Potency | 7943.3 | nM | None |
| Homo sapiens | Ras-related protein Rab-9A | Potency | 2310.9 | nM | 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 | 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 1a (5-HT1a) receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Serotonin transporter | IC50 | nan | None | None |
| Homo sapiens | Serotonin transporter | Ki | nan | None | None |
| Homo sapiens | Sigma opioid receptor | IC50 | nan | None | None |
| Homo sapiens | Sigma opioid receptor | Ki | nan | None | None |
| Homo sapiens | Solute carrier family 22 member 1 | Inhibition | 6.5 | % | 10.1021/jm8003152 |
| Homo sapiens | Survival motor neuron protein | Potency | 3981.1 | nM | None |
| Homo sapiens | Thrombin | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Thrombopoietin | Potency | 39.8 | nM | None |
| Homo sapiens | Thromboxane A2 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 | Vascular endothelial growth factor receptor 1 | IC50 | nan | None | None |
| Homo sapiens | Vascular endothelial growth factor receptor 1 | Ki | nan | None | None |
| Homo sapiens | Vascular endothelial growth factor receptor 2 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| 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 |
| Leishmania mexicana | Pyruvate kinase | Potency | 1995.3 | nM | None |
| Mus musculus | Monoamine oxidase A | Activity | nan | None | 10.1021/jm800656v |
| Mus musculus | Monoamine oxidase B | Activity | nan | None | 10.1021/jm800656v |
| Mus musculus | Mus musculus | LD50 | 100.0 | mg.kg-1 | 10.1021/jm00192a012 |
| 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 | 14125.4 | nM | None |
| Oryctolagus cuniculus | Angiotensin-converting enzyme | IC50 | nan | None | None |
| Oryctolagus cuniculus | Angiotensin-converting enzyme | Ki | nan | None | None |
| Oryctolagus cuniculus | Arachidonate 15-lipoxygenase | IC50 | 3649.0 | nM | None |
| Oryctolagus cuniculus | Arachidonate 15-lipoxygenase | Ki | nan | None | None |
| Photinus pyralis | Luciferin 4-monooxygenase | Potency | 77.5 | nM | None |
| Photinus pyralis | Luciferin 4-monooxygenase | Potency | 3981.1 | nM | None |
| Photinus pyralis | Luciferin 4-monooxygenase | Potency | 12589.3 | nM | None |
| Plasmodium falciparum | Plasmodium falciparum | Potency | 2557.5 | nM | None |
| Plasmodium falciparum | Plasmodium falciparum | Potency | 9074.3 | 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 | Aorta | EC50 | 1180000.0 | nM | 10.1016/j.ejmech.2014.05.052 |
| Rattus norvegicus | Aorta | EC50 | 1320000.0 | nM | 10.1016/j.ejmech.2014.05.052 |
| Rattus norvegicus | Aorta | Emax | 55.0 | % | 10.1016/j.ejmech.2009.06.006 |
| Rattus norvegicus | Aorta | pD2 | 6.6 | None | 10.1016/j.ejmech.2009.06.006 |
| 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 | Muscarinic acetylcholine receptor M1 | Potency | 28.2 | nM | None |
| Rattus norvegicus | Nitric-oxide synthase, brain | IC50 | nan | None | None |
| Rattus norvegicus | Nitric-oxide synthase, brain | Ki | nan | None | None |
| Rattus norvegicus | Peripheral myelin protein 22 | Potency | 34.6 | nM | None |
| Rattus norvegicus | Rattus norvegicus | Activity | -64.0 | mmHg | 10.1021/jm00206a011 |
| Rattus norvegicus | Rattus norvegicus | Activity | -36.0 | mmHg | 10.1021/jm00206a011 |
| Rattus norvegicus | Rattus norvegicus | Activity | 0.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 5.9 | % | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 6.4 | % | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 10.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 11.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 13.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 14.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 15.0 | mmHg | 10.1021/jm00192a015 |
| Rattus norvegicus | Rattus norvegicus | Activity | 15.0 | mmHg | 10.1021/jm00197a002 |
| Rattus norvegicus | Rattus norvegicus | Activity | 15.0 | mmHg | 10.1021/jm00218a007 |
| Rattus norvegicus | Rattus norvegicus | Activity | 19.0 | g | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 20.2 | g | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 30.0 | % | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 30.0 | mmHg | 10.1021/jm00192a015 |
| Rattus norvegicus | Rattus norvegicus | Activity | 30.0 | mmHg | 10.1021/jm00197a002 |
| Rattus norvegicus | Rattus norvegicus | Activity | 30.0 | mmHg | 10.1021/jm00218a007 |
| Rattus norvegicus | Rattus norvegicus | Activity | 38.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 40.0 | mmHg | 10.1021/jm00192a015 |
| Rattus norvegicus | Rattus norvegicus | Activity | 40.0 | mmHg | 10.1021/jm00197a002 |
| Rattus norvegicus | Rattus norvegicus | Activity | 40.0 | mmHg | 10.1021/jm00218a007 |
| Rattus norvegicus | Rattus norvegicus | Activity | 40.76 | % | 10.1016/j.ejmech.2010.02.003 |
| Rattus norvegicus | Rattus norvegicus | Activity | 41.76 | % | 10.1016/j.bmcl.2010.12.028 |
| Rattus norvegicus | Rattus norvegicus | Activity | 47.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 50.0 | % | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 60.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 83.59 | mmHg | 10.1016/j.ejmech.2018.08.002 |
| Rattus norvegicus | Rattus norvegicus | Activity | 88.0 | mmHg | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 319.0 | g | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 321.0 | g | None |
| Rattus norvegicus | Rattus norvegicus | Activity | 392.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 428.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 432.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 444.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 448.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 468.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 480.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 492.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 496.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | 504.0 | bpm | 10.1021/jm00192a012 |
| Rattus norvegicus | Rattus norvegicus | Activity | nan | None | None |
| Rattus norvegicus | Rattus norvegicus | Activity rating | 0.0 | None | 10.1021/jm00136a006 |
| Rattus norvegicus | Rattus norvegicus | Activity rating | 1.0 | None | 10.1021/jm00136a006 |
| Rattus norvegicus | Rattus norvegicus | Activity rating | 2.0 | None | 10.1021/jm00136a006 |
| Rattus norvegicus | Rattus norvegicus | Activity rating | 3.0 | None | 10.1021/jm00136a006 |
| Rattus norvegicus | Rattus norvegicus | Activity rating | 10.0 | % | 10.1021/jm00357a015 |
| Rattus norvegicus | Rattus norvegicus | Activity rating | 20.0 | % | 10.1021/jm00357a015 |
| Rattus norvegicus | Rattus norvegicus | Activity rating | 30.0 | % | 10.1021/jm00357a015 |
| Rattus norvegicus | Rattus norvegicus | Actvity | 44.0 | mmHg | 10.1021/jm00177a015 |
| Rattus norvegicus | Rattus norvegicus | ALB | 38700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 40200.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 41000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 42000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 43000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 257.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 309.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 333.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 343.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 346.5 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 452.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 36.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 40.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 46.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 50.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 51.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 54.5 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 58.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 59.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 79.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 83.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 89.83 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 103.17 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BASO | 0.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BASOLE | 0.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 1.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 1.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 1.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 1.8 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 2.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 2.2 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 160.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 163.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 165.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 176.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 183.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 210.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | Change | -47.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | -45.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | -44.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | -39.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | -15.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | -5.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | -1.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | 2.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | 8.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | Change | 11.0 | % | 10.1021/jm00349a010 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 98.33 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 99.0 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 99.5 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 100.33 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 101.0 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 613.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 653.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 680.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 725.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 740.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 825.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 207.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 219.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 302.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 318.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 532.5 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 533.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 25670000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 27170000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 29670000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 29830000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 30330000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 32000000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 1.4 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 1.5 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 1.6 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 1.8 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | Decrease | 27.0 | % | 10.1021/jm00136a006 |
| Rattus norvegicus | Rattus norvegicus | Decrease | 27.0 | % | 10.1021/jm00357a015 |
| Rattus norvegicus | Rattus norvegicus | Decrease | 51.0 | % | 10.1021/jm00136a006 |
| Rattus norvegicus | Rattus norvegicus | Decrease | 51.0 | % | 10.1021/jm00357a015 |
| Rattus norvegicus | Rattus norvegicus | Decrease in blood pressure | 22.0 | % | 10.1021/jm00357a017 |
| Rattus norvegicus | Rattus norvegicus | Decrease in blood pressure | 35.3 | mmHg | 10.1021/jm00156a011 |
| Rattus norvegicus | Rattus norvegicus | Decrease in blood pressure | 72.4 | mmHg | 10.1021/jm00156a011 |
| Rattus norvegicus | Rattus norvegicus | Decrease in blood pressure | 75.1 | mmHg | 10.1021/jm00156a011 |
| Rattus norvegicus | Rattus norvegicus | Decrease in blood pressure | nan | None | 10.1021/jm00357a017 |
| Rattus norvegicus | Rattus norvegicus | Delta blood pressure | 30.0 | None | 10.1021/jm00144a017 |
| Rattus norvegicus | Rattus norvegicus | Delta blood pressure | 47.5 | None | 10.1021/jm00144a017 |
| Rattus norvegicus | Rattus norvegicus | Delta blood pressure | 50.0 | None | 10.1021/jm00144a017 |
| Rattus norvegicus | Rattus norvegicus | Delta blood pressure | 61.2 | None | 10.1021/jm00144a017 |
| Rattus norvegicus | Rattus norvegicus | Delta blood pressure | 62.5 | None | 10.1021/jm00144a017 |
| Rattus norvegicus | Rattus norvegicus | Delta blood pressure | 81.2 | None | 10.1021/jm00144a017 |
| Rattus norvegicus | Rattus norvegicus | Delta MAP | -52.0 | % | 10.1021/jm00177a015 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.01 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.02 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.04 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.07 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.11 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.12 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.17 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Diuretic activity | 0.27 | None | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Duration | 8.0 | hr | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Duration | 18.0 | hr | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | ED40 | 1.0 | uM kg-1 | 10.1021/jm00397a013 |
| Rattus norvegicus | Rattus norvegicus | ED50 | 0.6 | umol.kg-1 | 10.1021/jm00397a013 |
| Rattus norvegicus | Rattus norvegicus | ED50 | 10.0 | mg.kg-1 | 10.1021/jm00213a025 |
| Rattus norvegicus | Rattus norvegicus | EOS | 0.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 20.17 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 22.83 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 33.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOSLE | 0.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOSLE | 0.17 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOSLE | 0.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | FC | 1.5 | None | None |
| Rattus norvegicus | Rattus norvegicus | FC | 1.6 | None | None |
| Rattus norvegicus | Rattus norvegicus | FC | 3.0 | None | None |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1313.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1420.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1430.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1526.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1540.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1685.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 31.97 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 32.27 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 33.4 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 33.5 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 34.38 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 36.62 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 128700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 130000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 130700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 133200.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 140700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 8.0 | mmHg | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 8.0 | mmHg | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 15.0 | mmHg | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 15.0 | mmHg | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 21.0 | mmHg | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 21.0 | mmHg | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 28.0 | mmHg | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 28.0 | mmHg | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 38.0 | mmHg | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 38.0 | mmHg | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 42.0 | mmHg | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 42.0 | mmHg | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 54.0 | mmHg | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Increase in blood pressure | 54.0 | mmHg | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Inhibition | 40.0 | % | 10.1021/jm00365a007 |
| Rattus norvegicus | Rattus norvegicus | LD50 | 107.0 | mg.kg-1 | 10.1021/jm00206a011 |
| Rattus norvegicus | Rattus norvegicus | LD50 | 3218700.0 | umol.kg-1 | 10.1021/acs.jmedchem.7b00285 |
| Rattus norvegicus | Rattus norvegicus | LDH | 125.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 151.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 184.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 220.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 304.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 536.5 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 10.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 10.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 11.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 11.17 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 11.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 11.5 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 8493.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 9108.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 12179.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 12202.83 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 12371.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 12743.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 87.67 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 88.5 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 89.5 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 89.67 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 90.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 92.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MAP | 14.0 | mmHg | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | MAP | 15.0 | mmHg | 10.1021/jm00175a012 |
| Rattus norvegicus | Rattus norvegicus | MAP | 30.0 | mmHg | 10.1021/jm00175a012 |
| Rattus norvegicus | Rattus norvegicus | MAP | 37.0 | mmHg | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | MAP | 40.0 | mmHg | 10.1021/jm00175a012 |
| Rattus norvegicus | Rattus norvegicus | MAP | 57.0 | mmHg | 10.1021/jm00186a024 |
| Rattus norvegicus | Rattus norvegicus | Max fall in blood pressure | 32.0 | mmHg | 10.1021/jm00365a007 |
| Rattus norvegicus | Rattus norvegicus | Max fall in blood pressure | 65.0 | mmHg | 10.1021/jm00365a007 |
| Rattus norvegicus | Rattus norvegicus | Max fall in blood pressure | 113.0 | mmHg | 10.1021/jm00365a007 |
| Rattus norvegicus | Rattus norvegicus | MCH | 23.1 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 23.37 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 23.95 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 24.42 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 24.8 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 25.6 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 384300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 387000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 389000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 390000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 402700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 405300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 59.4 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 59.97 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 61.17 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 62.28 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 63.07 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 63.57 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 0.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 152.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 158.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 166.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 293.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 327.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 0.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 1.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 1.17 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 2.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 3.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 7.67 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 8.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 9.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 9.17 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 9.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 10.17 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 792.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 980.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 1062.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 1268.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 1283.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 1292.17 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 104.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 108.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 112.5 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 113.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 114.8 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1193500.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1198000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1213000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1225670.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1239000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1418000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 5.22 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 5.72 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 5.91 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 5.95 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 6.29 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 6.36 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 54000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 54700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 57000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 57300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 57700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 61200.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5030000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5270000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5460000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5590000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5620000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5880000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBCNUC | 0.0 | /100WBC | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBCNUC | 0.17 | /100WBC | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | Reduction | 39.0 | % | 10.1021/jm00400a003 |
| Rattus norvegicus | Rattus norvegicus | Reduction | 39.0 | % | 10.1021/jm00400a004 |
| Rattus norvegicus | Rattus norvegicus | Rise HR | 28.0 | % | 10.1021/jm00357a017 |
| Rattus norvegicus | Rattus norvegicus | Rise HR | nan | None | 10.1021/jm00357a017 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 139.9 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 140.5 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 140.53 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 140.6 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 141.6 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 142.03 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | TIME | 4.0 | hr | 10.1021/jm00197a002 |
| Rattus norvegicus | Rattus norvegicus | TIME | 4.0 | hr | 10.1021/jm00206a011 |
| Rattus norvegicus | Rattus norvegicus | TIME | 4.0 | hr | 10.1021/jm00218a007 |
| Rattus norvegicus | Rattus norvegicus | TIME | 6.0 | hr | 10.1021/jm00197a002 |
| Rattus norvegicus | Rattus norvegicus | TIME | 6.0 | hr | 10.1021/jm00218a007 |
| Rattus norvegicus | Rattus norvegicus | TIME | 7.0 | hr | 10.1021/jm00197a002 |
| Rattus norvegicus | Rattus norvegicus | TIME | 7.0 | hr | 10.1021/jm00218a007 |
| Rattus norvegicus | Rattus norvegicus | TIME | 8.0 | hr | 10.1021/jm00206a011 |
| Rattus norvegicus | Rattus norvegicus | Tissue Severity Score | nan | None | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 11.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 13.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 14.2 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 14.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 16.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 9770.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 9900.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 13630.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 13670.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 13850.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 14130.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| 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 |
| Rattus norvegicus | Thioredoxin reductase 1, cytoplasmic | Potency | 18887.6 | nM | None |
| Severe acute respiratory syndrome coronavirus 2 | Replicase polyprotein 1ab | Inhibition | 13.72 | % | 10.6019/CHEMBL4495564 |
| Severe acute respiratory syndrome coronavirus 2 | Replicase polyprotein 1ab | Inhibition | 14.82 | % | 10.6019/CHEMBL4495564 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | Hit score | 0.1818 | None | 10.1101/2020.04.21.054387 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | Inhibition | 0.18 | % | 10.6019/CHEMBL4495565 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | Inhibition | 0.91 | % | 10.6019/CHEMBL4495565 |
| None | ADMET | CL | 85.0 | mL.min-1.kg-1 | 10.1124/dmd.108.020479 |
| None | ADMET | Cmax | 2500.0 | nM | None |
| None | ADMET | delta logD | -0.61 | None | 10.1021/jm0000564 |
| None | ADMET | F | 20.0 | % | 10.1021/jm0000564 |
| None | ADMET | MRT | 0.29 | hr | 10.1124/dmd.108.020479 |
| None | ADMET | T1/2 | 0.96 | hr | 10.1124/dmd.108.020479 |
| None | ADMET | Vdss | 1.5 | L.kg-1 | 10.1124/dmd.108.020479 |
| None | Hepatotoxicity | Hepatotoxicity | nan | None | 10.1021/tx900326k |
| 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 | 1.0 | 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 | 1.0 | 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 | 0.12 | None | 10.1124/dmd.108.020479 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (acute) | 0.0 | % | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (animal toxicity known) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (benign tumour) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (granulomatous hepatitis) | 6.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (mechanism) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (moderate) | 0.0 | % | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (moderate) | 4.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (time to onset) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Potency | 1.7 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 5951.8 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 11875.4 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 23694.5 | nM | None |
| None | No relevant target | LogD | 0.14 | None | 10.1021/jm0000564 |
| None | No relevant target | pKa | 7.3 | None | 10.1021/jm0000564 |
| None | Phospholipidosis | Phospholipidosis | nan | None | 10.1080/15376510701857262 |
| None | Unchecked | Activity | nan | None | 10.1021/jm00213a015 |
| None | Unchecked | Hepatotoxicity (acute) | 9.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (association with vascular disease) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (choleostasis) | 3.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (chronic liver disease) | 3.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (cirrhosis) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (comment) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (cytolytic) | 6.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (malignant tumour) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (severe hepatitis) | 2.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (steatosis) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (successful reintroduction) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | IC50 | 8150.0 | nM | None |
| None | Unchecked | IC50 | nan | None | None |
| None | Unchecked | Ki | nan | None | None |
| None | Unchecked | Potency | 410.9 | nM | None |
| None | Unchecked | Potency | 12589.3 | nM | None |
| None | Unchecked | Potency | 18348.9 | nM | None |
| None | Unchecked | Ratio IC50 | 1.3 | None | 10.1021/acs.jmedchem.7b00285 |