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Compound Detail

CHEMBL1200759

ANAGRELIDE HYDROCHLORIDE
💊 Approved Drug
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💊 Approved Drug
Cl.O=C1CN2Cc3c(ccc(Cl)c3Cl)N=C2N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1200759
Name ANAGRELIDE HYDROCHLORIDE
Phase Approved
Structure Type MOL
InChI Key TVWRQCIPWUCNMI-UHFFFAOYSA-N
Therapeutic ✓ Yes
Parent Compound CHEMBL760
Active Moiety CHEMBL760

Known Names

Agrelin Agrylin Anagrelide hcl Anagrelide hydrochloride Anagrelide hydrochloride hydrate Anagrelide hydrochloride monohydrate Anagrelide mylan Anagrelide viatris (previously anagrelide mylan) BL-4162A BMY-26538-01 NSC-724577 NSC-759170 +2 more
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
10
Publications
14
Known Names
4
Indications
1
Mechanisms

Molecular Properties

256.1
MW (Da)
1.93
ALogP
3
HBA
1
HBD
44.7
PSA (Ų)
0.77
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 1997
Availability Prescription
Chirality Achiral

Routes of Administration

Oral
USAN Stem -grel-
USAN Year 1979

Extended Properties

Molecular Formula C10H8Cl3N3O
MW 292.55
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.85

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Phosphodiesterase 3 inhibitor INHIBITOR Phosphodiesterase 3 ✓ ✓

Indications

Myeloproliferative Disorders Thrombocythemia, Essential Thrombosis Thrombosis

Activity Summary

EC50 1 meas. best 6.14

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
 EC50 6.14 6.14 722.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked EC50 = 722.0 nM 6.14 PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Confirmation HTS to Identify Inhi... -

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1
- 10.6019/CHEMBL4513141 Candida albicans 1
- 10.6019/CHEMBL4513141 Cryptococcus neoformans 1
- 10.6019/CHEMBL4513141 Escherichia coli 1
- 10.6019/CHEMBL4513141 Klebsiella pneumoniae 1
- 10.6019/CHEMBL4513141 Pseudomonas aeruginosa 1
- 10.6019/CHEMBL4513141 Acinetobacter baumannii 1
- 10.6019/CHEMBL4513141 Staphylococcus aureus 1

Data from ChEMBL 36 via Core Engine