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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1200984
CHEMBL1200984
Compound Name AMLODIPINE MALEATE
ChEMBL Synonyms UK-48340-11 | AMLODIPINE MALEATE | UK-48,340-11 | AMVAZ
Max Phase 4 (Approved)
Trade Names AMVAZ
Molecular Formula C24H29ClN2O9

Additional synonyms for CHEMBL1200984 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCOC(=O)C1=C(COCCN)NC(=C(C1c2ccccc2Cl)C(=O)OC)C.OC(=O)\C=C/C ...
Download SMILES
Standard InChI InChI=1S/C20H25ClN2O5.C4H4O4/c1-4-28-20(25)18-15(11-27-10-9- ...
Download InChI
Standard InChI Key TZNOWAJJWCGILX-BTJKTKAUSA-N

Sources

  • Orange Book
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL1200984

Molecule Features

CHEMBL1200984 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Racemic Mixture Prodrug:N Oral:Y Parenteral:N Topical:N Black Box:N Availability Type:Discontinued

Mechanism of Action

Mechanism of Action ChEMBL Target References
Voltage-gated L-type calcium channel blocker Voltage-gated L-type calcium channel DailyMed

Clinical Data

ClinicalTrials.gov AMLODIPINE MALEATE
The Cochrane Collaboration AMLODIPINE MALEATE

Target Predictions

The two tables below display ChEMBL single-protein targets which are predicted to interact with CHEMBL1200984. 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
CHEMBL4132 Voltage-gated L-type calcium channel alpha-1D subunit Rattus norvegicus 1.000
CHEMBL2830 Voltage-gated L-type calcium channel alpha-1C subunit Oryctolagus cuniculus 1.000
CHEMBL2366456 Voltage-dependent L-type calcium channel subunit alpha-1C Cavia porcellus 1.000
CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit Rattus norvegicus 1.000
CHEMBL1940 Voltage-gated L-type calcium channel alpha-1C subunit Homo sapiens 0.989
CHEMBL1994 Mineralocorticoid receptor Homo sapiens 0.793
CHEMBL4267 TGF-beta receptor type II Homo sapiens 0.466



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL2830 Voltage-gated L-type calcium channel alpha-1C subunit Oryctolagus cuniculus 1.000
CHEMBL2366456 Voltage-dependent L-type calcium channel subunit alpha-1C Cavia porcellus 1.000
CHEMBL4132 Voltage-gated L-type calcium channel alpha-1D subunit Rattus norvegicus 1.000
CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit Rattus norvegicus 1.000
CHEMBL1940 Voltage-gated L-type calcium channel alpha-1C subunit Homo sapiens 1.000
CHEMBL4267 TGF-beta receptor type II Homo sapiens 0.998
CHEMBL1994 Mineralocorticoid receptor Homo sapiens 0.647

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
408.9 408.1452 2.27 8 99.88 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
7 2 0 7 3 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 8.97 3.01 1.5 1 28 0.5

Structural Alerts

There are 4 structural alerts for CHEMBL1200984. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:TZNOWAJJWCGILX-BTJKTKAUSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1200984



ACToR 88150-47-4
eMolecules 19230834
MolPort MolPort-005-935-503
PubChem 6435922
PubChem: Thomson Pharma 14934199
SureChEMBL SCHEMBL121252

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