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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL564
CHEMBL564
Compound Name PROMAZINE
ChEMBL Synonyms PROTACTYL | SPARINE | Verophene | PRAZINE | PROMAZINE HYDROCHLORIDE | Promazine Granules | Promazine | Promazine chloride | Tranquazine
Max Phase 4 (Approved)
Trade Names Verophene | PRAZINE | PROTACTYL | Promazine Granules | Tranquazine | PROMAZINE HYDROCHLORIDE | SPARINE
Molecular Formula C17H20N2S

Additional synonyms for CHEMBL564 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CN(C)CCCN1c2ccccc2Sc3ccccc13
Standard InChI InChI=1S/C17H20N2S/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-1 ...
Download InChI
Standard InChI Key ZGUGWUXLJSTTMA-UHFFFAOYSA-N

Sources

  • AstraZeneca Deposited Data
  • British National Formulary
  • Curated Drug Metabolism Pathways
  • DrugMatrix
  • Drugs for Neglected Diseases Initiative (DNDi)
  • Orange Book
  • PubChem BioAssays
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL564

Molecule Features

CHEMBL564 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Y Parenteral:Y Topical:N Black Box:N Availability Type:Discontinued

Mechanism of Action

Mechanism of Action ChEMBL Target References
D2-like dopamine receptor antagonist D2-like dopamine receptor ISBN ISBN
Serotonin 2a (5-HT2a) receptor antagonist Serotonin 2a (5-HT2a) receptor ISBN ISBN

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
Psychotic DisordersD011618EFO:0005407psychosis4ATC

Clinical Data

ClinicalTrials.gov PROMAZINE
The Cochrane Collaboration PROMAZINE

Metabolites for CHEMBL564

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Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Target Predictions

The two tables below display ChEMBL single-protein targets which are predicted to interact with CHEMBL564. A 1uM and 10 uM cut-off have been applied to ChEMBL bioactivity data used to generate the respective models and the yellow coloured rows correspond to genuine predictions, i.e. targets not included in the original training set for this compound.


1uM


ChEMBL_ID Target Name Organism Score
CHEMBL231 Histamine H1 receptor Homo sapiens 1.000
CHEMBL315 Alpha-1b adrenergic receptor Rattus norvegicus 1.000
CHEMBL319 Alpha-1a adrenergic receptor Rattus norvegicus 1.000
CHEMBL1942 Alpha-2b adrenergic receptor Homo sapiens 1.000
CHEMBL1867 Alpha-2a adrenergic receptor Homo sapiens 1.000
CHEMBL1821 Muscarinic acetylcholine receptor M4 Homo sapiens 1.000
CHEMBL2035 Muscarinic acetylcholine receptor M5 Homo sapiens 1.000
CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit Rattus norvegicus 1.000
CHEMBL1916 Alpha-2c adrenergic receptor Homo sapiens 1.000
CHEMBL4701 Histamine H1 receptor Rattus norvegicus 1.000
CHEMBL322 Serotonin 2a (5-HT2a) receptor Rattus norvegicus 1.000
CHEMBL216 Muscarinic acetylcholine receptor M1 Homo sapiens 1.000
CHEMBL225 Serotonin 2c (5-HT2c) receptor Homo sapiens 1.000
CHEMBL1850 Dopamine D5 receptor Homo sapiens 1.000
CHEMBL289 Cytochrome P450 2D6 Homo sapiens 1.000
CHEMBL287 Sigma opioid receptor Homo sapiens 0.999
CHEMBL276 Muscarinic acetylcholine receptor M1 Rattus norvegicus 0.999
CHEMBL324 Serotonin 2c (5-HT2c) receptor Rattus norvegicus 0.998
CHEMBL3155 Serotonin 7 (5-HT7) receptor Homo sapiens 0.998
CHEMBL2367 Peptide deformylase Staphylococcus aureus subsp. aureus Mu50 0.998



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL5131 Trypanothione reductase Trypanosoma cruzi 1.000
CHEMBL231 Histamine H1 receptor Homo sapiens 1.000
CHEMBL315 Alpha-1b adrenergic receptor Rattus norvegicus 1.000
CHEMBL319 Alpha-1a adrenergic receptor Rattus norvegicus 1.000
CHEMBL3459 Serotonin 1b (5-HT1b) receptor Rattus norvegicus 1.000
CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit Rattus norvegicus 1.000
CHEMBL1942 Alpha-2b adrenergic receptor Homo sapiens 1.000
CHEMBL1941 Histamine H2 receptor Homo sapiens 1.000
CHEMBL1916 Alpha-2c adrenergic receptor Homo sapiens 1.000
CHEMBL1867 Alpha-2a adrenergic receptor Homo sapiens 1.000
CHEMBL276 Muscarinic acetylcholine receptor M1 Rattus norvegicus 1.000
CHEMBL322 Serotonin 2a (5-HT2a) receptor Rattus norvegicus 1.000
CHEMBL3805 Voltage-gated L-type calcium channel alpha-1S subunit Homo sapiens 0.999
CHEMBL225 Serotonin 2c (5-HT2c) receptor Homo sapiens 0.999
CHEMBL4892 Alpha-1a adrenergic receptor Bos taurus 0.999
CHEMBL287 Sigma opioid receptor Homo sapiens 0.998
CHEMBL1287628 NADPH oxidase 1 Homo sapiens 0.997
CHEMBL4701 Histamine H1 receptor Rattus norvegicus 0.997
CHEMBL1821 Muscarinic acetylcholine receptor M4 Homo sapiens 0.997
CHEMBL2367 Peptide deformylase Staphylococcus aureus subsp. aureus Mu50 0.997

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
284.4 284.1347 4.24 4 6.48 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 0 0 2 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 9.43 4.69 2.73 2 20 0.83

Structural Alerts

There are no structural alerts for CHEMBL564

Compound Cross References

ATC N - NERVOUS SYSTEM
N05 - PSYCHOLEPTICS
N05A - ANTIPSYCHOTICS
N05AA - Phenothiazines with aliphatic side-chain
N05AA03 - promazine

ChemSpider ChemSpider:ZGUGWUXLJSTTMA-UHFFFAOYSA-N
PubChem SID: 11111651 SID: 11111652 SID: 124881158 SID: 50100325 SID: 50104276 SID: 90341344
Wikipedia Promazine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL564



ACToR 58-40-2
BindingDB 67545
Brenda 7491
ChEBI 8459
DrugBank DB00420
DrugCentral 2284
EPA CompTox Dashboard DTXSID2023517
FDA SRS O9M39HTM5W
Guide to Pharmacology 7281
Human Metabolome Database HMDB0014564
IBM Patent System A594B1B65E3C2C0D1484A33B126EDE84
KEGG Ligand C07379
LINCS LSM-2137
Nikkaji J2.805C
PDBe P2Z
PharmGKB PA451126
PubChem 4926
PubChem: Thomson Pharma 14848900
SureChEMBL SCHEMBL140489
ZINC ZINC000000010402

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/ZGUGWUXLJSTTMA-UHFFFAOYSA-N spacer
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