Compound Detail
CHEMBL833
TICLOPIDINE 💊 Approved Drug
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💊 Approved Drug
Basic Information
| ChEMBL ID | CHEMBL833 |
| Name | TICLOPIDINE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | PHWBOXQYWZNQIN-UHFFFAOYSA-N |
| Therapeutic | ✓ Yes |
| Active Moiety | CHEMBL1201394 |
16
Targets
36
Activities
2
Assay Types
6
PK Parameters
20
Publications
3
Known Names
3
Indications
Molecular Properties
263.8
MW (Da)
3.96
ALogP
2
HBA
0
HBD
3.2
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1991 |
| Availability | Prescription |
| Chirality | Achiral |
Indications
Thrombosis Carotid Stenosis Peripheral Arterial Disease
ATC Classification
B01AC05
ticlopidine
Level 1: BLOOD AND BLOOD FORMING ORGANS
Level 2: ANTITHROMBOTIC AGENTS
Activity Summary
IC50 26 meas. best 6.68
Ki 10 meas. best 6.86
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Alpha-2B adrenergic receptor CHEMBL1942 | Ki | 6.86 | 6.86 | 139.0 | 1 |
| Alpha-2A adrenergic receptor CHEMBL1867 | Ki | 6.84 | 6.84 | 143.0 | 1 |
| Alpha-2C adrenergic receptor CHEMBL1916 | Ki | 6.77 | 6.77 | 171.0 | 1 |
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 6.75 | 6.75 | 179.0 | 1 |
| Cytochrome P450 2B6 CHEMBL4729 | Ki | 6.7 | 6.4 | 200.0 | 2 |
| Cytochrome P450 2B6 CHEMBL4729 | IC50 | 6.68 | 5.6867 | 210.0 | 3 |
| Alpha-2B adrenergic receptor CHEMBL1942 | IC50 | 6.52 | 6.52 | 304.0 | 1 |
| Platelet CHEMBL4296519 | IC50 | 6.44 | 6.44 | 360.0 | 1 |
| Alpha-2A adrenergic receptor CHEMBL1867 | IC50 | 6.42 | 6.42 | 382.0 | 1 |
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | IC50 | 6.37 | 6.37 | 426.0 | 1 |
| Cytochrome P450 2C19 CHEMBL3622 | IC50 | 6.17 | 5.5367 | 667.8 | 3 |
| Alpha-2C adrenergic receptor CHEMBL1916 | IC50 | 5.93 | 5.93 | 1175.0 | 1 |
| Unchecked CHEMBL612545 | Ki | 5.83 | 5.765 | 1493.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 5.65 | 5.57 | 2239.0 | 2 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.5 | 5.465 | 3180.0 | 2 |
| Cytochrome P450 2C19 CHEMBL3622 | Ki | 5.48 | 4.77 | 3300.0 | 2 |
| Cytochrome P450 2D6 CHEMBL289 | IC50 | 5.32 | 5.26 | 4800.0 | 2 |
| Cytochrome P450 1A2 CHEMBL3356 | IC50 | 5.07 | 5.07 | 8590.0 | 1 |
| Cytochrome P450 2J2 CHEMBL3491 | IC50 | 4.66 | 4.66 | 21800.0 | 1 |
| Bile salt export pump CHEMBL6020 | IC50 | 4.57 | 4.35 | 26950.0 | 2 |
| Cytochrome P450 2C9 CHEMBL3397 | IC50 | 4.51 | 4.51 | 31100.0 | 1 |
| Cytochrome P450 3A4 CHEMBL340 | IC50 | 4.49 | 4.49 | 32700.0 | 1 |
| Bile salt export pump CHEMBL2073674 | IC50 | 4.31 | 4.31 | 49000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 35.0 | mL.min-1.g-1 | Homo sapiens |
| CL | 56.23 | uL.min-1.(10^6cells)-1 | Homo sapiens |
| CL | 150.0 | uL.min-1.(10^6cells)-1 | Rattus norvegicus |
| CL | 0.000431 | mL.min-1.g-1 | Homo sapiens |
| CL | 0.00203 | mL.min-1.g-1 | Homo sapiens |
| CL | 2.461 | uL/min | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine