Compound Detail
CHEMBL420
GUANABENZ 💊 Approved Drug
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💊 Approved Drug
Basic Information
| ChEMBL ID | CHEMBL420 |
| Name | GUANABENZ |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | WDZVGELJXXEGPV-YIXHJXPBSA-N |
| Therapeutic | ✓ Yes |
17
Targets
36
Activities
3
Assay Types
0
PK Parameters
20
Publications
4
Known Names
2
Indications
Molecular Properties
231.1
MW (Da)
1.81
ALogP
2
HBA
3
HBD
74.3
PSA (Ų)
0.41
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1982 |
| Availability | Discontinued |
| Chirality | Achiral |
Indications
Multiple Sclerosis Multiple Sclerosis, Relapsing-Remitting
Activity Summary
IC50 18 meas. best 8.77
Ki 15 meas. best 8.71
EC50 3 meas. best 7.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adrenergic receptor alpha-2 CHEMBL2093864 | IC50 | 8.77 | 8.77 | 1.7 | 1 |
| Unchecked CHEMBL612545 | Ki | 8.71 | 7.3733 | 1.9 | 3 |
| Alpha-2A adrenergic receptor CHEMBL1867 | Ki | 7.82 | 7.82 | 15.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 7.75 | 6.6 | 18.0 | 2 |
| Nischarin CHEMBL3923 | Ki | 7.46 | 7.46 | 34.7 | 2 |
| Alpha-2A adrenergic receptor CHEMBL1867 | IC50 | 7.39 | 7.39 | 41.0 | 1 |
| 5-hydroxytryptamine receptor 2B CHEMBL1833 | Ki | 7.21 | 7.21 | 62.0 | 1 |
| Alpha-2B adrenergic receptor CHEMBL1942 | Ki | 7.17 | 7.17 | 68.0 | 1 |
| Trace amine-associated receptor 1 CHEMBL5857 | EC50 | 7.05 | 7.05 | 90.0 | 1 |
| 5-hydroxytryptamine receptor 2B CHEMBL1833 | IC50 | 7.01 | 7.01 | 97.0 | 1 |
| 5-hydroxytryptamine receptor 2C CHEMBL225 | Ki | 6.97 | 6.97 | 107.0 | 1 |
| 5-hydroxytryptamine receptor 2A CHEMBL224 | Ki | 6.95 | 6.95 | 112.0 | 1 |
| Alpha-2B adrenergic receptor CHEMBL1942 | IC50 | 6.83 | 6.83 | 149.0 | 1 |
| Alpha-1A adrenergic receptor CHEMBL319 | Ki | 6.8 | 6.8 | 158.0 | 1 |
| Alpha-2C adrenergic receptor CHEMBL1916 | Ki | 6.79 | 6.79 | 161.0 | 1 |
| 5-hydroxytryptamine receptor 2C CHEMBL225 | IC50 | 6.69 | 6.69 | 204.0 | 1 |
| Alpha-1D adrenergic receptor CHEMBL223 | Ki | 6.63 | 6.63 | 232.0 | 1 |
| 5-hydroxytryptamine receptor 2A CHEMBL224 | IC50 | 6.41 | 6.41 | 392.0 | 1 |
| Alpha-1A adrenergic receptor CHEMBL319 | IC50 | 6.41 | 6.41 | 391.0 | 1 |
| Adrenergic receptor alpha-1 CHEMBL1907610 | IC50 | 6.35 | 6.35 | 450.0 | 1 |
| Alpha-1D adrenergic receptor CHEMBL223 | IC50 | 6.33 | 6.33 | 472.0 | 1 |
| Alpha-1B adrenergic receptor CHEMBL315 | Ki | 6.12 | 6.12 | 755.0 | 1 |
| Alpha-2C adrenergic receptor CHEMBL1916 | IC50 | 5.96 | 5.96 | 1106.0 | 1 |
| Trace amine-associated receptor 1 CHEMBL5857 | IC50 | 5.93 | 5.93 | 1173.0 | 1 |
| 5-hydroxytryptamine receptor 1A CHEMBL273 | Ki | 5.93 | 5.93 | 1181.0 | 1 |
| Alpha-1B adrenergic receptor CHEMBL315 | IC50 | 5.87 | 5.87 | 1365.0 | 1 |
| Amine oxidase [flavin-containing] A CHEMBL1951 | IC50 | 5.75 | 5.75 | 1787.0 | 1 |
| 5-hydroxytryptamine receptor 1A CHEMBL273 | IC50 | 5.68 | 5.68 | 2068.0 | 1 |
| Solute carrier family 22 member 1 CHEMBL5685 | IC50 | 5.31 | 5.31 | 4850.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.58 | 4.58 | 26000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine