Compound Detail
CHEMBL1200986
HALOPERIDOL DECANOATE 💊 Approved Drug
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💊 Approved Drug
Basic Information
| ChEMBL ID | CHEMBL1200986 |
| Name | HALOPERIDOL DECANOATE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | GUTXTARXLVFHDK-UHFFFAOYSA-N |
| Therapeutic | ✓ Yes |
| Active Moiety | CHEMBL54 |
4
Targets
5
Activities
1
Assay Types
0
PK Parameters
10
Publications
6
Known Names
2
Indications
2
Mechanisms
Molecular Properties
530.1
MW (Da)
8.12
ALogP
4
HBA
0
HBD
46.6
PSA (Ų)
0.13
QED
2
Ro5 Violations
15
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1986 |
| Availability | Prescription |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Serotonin 2a (5-HT2a) receptor antagonist | ANTAGONIST | 5-hydroxytryptamine receptor 2A | ✓ | ✓ |
| D2-like dopamine receptor inverse agonist | INVERSE AGONIST | D2-like dopamine receptor | ✓ | ✓ |
Indications
Schizophrenia Delirium
Drug Warnings
Black Box Warning
psychiatric toxicity
Activity Summary
Ki 5 meas. best 9.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL217 | Ki | 9.34 | 9.04 | 0.5 | 2 |
| D(3) dopamine receptor CHEMBL234 | Ki | 8.46 | 8.46 | 3.5 | 1 |
| D(4) dopamine receptor CHEMBL219 | Ki | 8.24 | 8.24 | 5.8 | 1 |
| D(1A) dopamine receptor CHEMBL5067 | Ki | 6.85 | 6.85 | 140.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 0.46 | nM | 9.34 | Displacement of [3H]spiperone from human D2short receptor stably expressed in CH... | 25047579 |
| D(2) dopamine receptor | Ki | = | 1.8 | nM | 8.74 | Displacement of [3H]spiperone from human D2long receptor stably expressed in CHO... | 25047579 |
| D(3) dopamine receptor | Ki | = | 3.5 | nM | 8.46 | Displacement of [3H]spiperone from human D3 receptor stably expressed in CHO cel... | 25047579 |
| D(4) dopamine receptor | Ki | = | 5.8 | nM | 8.24 | Displacement of [3H]spiperone from human D4.4 receptor stably expressed in CHO c... | 25047579 |
| D(1A) dopamine receptor | Ki | = | 140.0 | nM | 6.85 | Displacement of [3H]SCH23390 from porcine striatal membranes D1 receptor by comp... | 25047579 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25047579 | 10.1016/j.bmcl.2014.06.079 | D(2) dopamine receptor | 2 |
| 26948801 | 10.1016/j.drudis.2016.02.015 | Homo sapiens | 2 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 25047579 | 10.1016/j.bmcl.2014.06.079 | D(3) dopamine receptor | 1 |
| 25047579 | 10.1016/j.bmcl.2014.06.079 | D(4) dopamine receptor | 1 |
| 25047579 | 10.1016/j.bmcl.2014.06.079 | D(1A) dopamine receptor | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine