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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1200803
CHEMBL1200803
Compound Name SOLIFENACIN SUCCINATE
ChEMBL Synonyms SOLIFENACIN SUCCINATE | YM905 | VESICARE | YM67905 | YM-905 | YM-67905
Max Phase 4 (Approved)
Trade Names VESICARE
Molecular Formula C27H32N2O6

Additional synonyms for CHEMBL1200803 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OC(=O)CCC(=O)O.O=C(O[C@H]1CN2CCC1CC2)N3CCc4ccccc4[C@@H]3c5cc ...
Download SMILES
Standard InChI InChI=1S/C23H26N2O2.C4H6O4/c26-23(27-21-16-24-13-10-18(21)11 ...
Download InChI
Standard InChI Key RXZMMZZRUPYENV-VROPFNGYSA-N

Sources

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

Alternate Forms of Compound in ChEMBL


CHEMBL1200803

Molecule Features

CHEMBL1200803 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:Y Parenteral:N Topical:N Black Box:N Availability Type:Prescription-only

Mechanism of Action

Mechanism of Action ChEMBL Target References
Muscarinic acetylcholine receptor M2 antagonist Muscarinic acetylcholine receptor M2 ISBN PubMed PubMed
Muscarinic acetylcholine receptor M3 antagonist Muscarinic acetylcholine receptor M3 ISBN PubMed PubMed

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
URINARY BLADDER, OVERACTIVED053201EFO:1000781OVERACTIVE BLADDER4ClinicalTrials
ClinicalTrials

Clinical Data

ClinicalTrials.gov SOLIFENACIN SUCCINATE
The Cochrane Collaboration SOLIFENACIN SUCCINATE

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 CHEMBL1200803. 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
CHEMBL309 Muscarinic acetylcholine receptor M2 Rattus norvegicus 1.000
CHEMBL320 Muscarinic acetylcholine receptor M3 Rattus norvegicus 1.000
CHEMBL276 Muscarinic acetylcholine receptor M1 Rattus norvegicus 1.000
CHEMBL245 Muscarinic acetylcholine receptor M3 Homo sapiens 1.000
CHEMBL2672 Muscarinic acetylcholine receptor M1 Bos taurus 1.000
CHEMBL211 Muscarinic acetylcholine receptor M2 Homo sapiens 1.000
CHEMBL5011 Transient receptor potential cation channel subfamily M member 8 Rattus norvegicus 1.000
CHEMBL216 Muscarinic acetylcholine receptor M1 Homo sapiens 1.000
CHEMBL6084 Acetylcholine-binding protein Lymnaea stagnalis 0.981
CHEMBL5498 Muscarinic acetylcholine receptor M3 Cavia porcellus 0.974
CHEMBL289 Cytochrome P450 2D6 Homo sapiens 0.480
CHEMBL5462 Baculoviral IAP repeat-containing protein 2 Homo sapiens 0.463
CHEMBL2035 Muscarinic acetylcholine receptor M5 Homo sapiens 0.397
CHEMBL4198 Inhibitor of apoptosis protein 3 Homo sapiens 0.377



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL309 Muscarinic acetylcholine receptor M2 Rattus norvegicus 1.000
CHEMBL320 Muscarinic acetylcholine receptor M3 Rattus norvegicus 1.000
CHEMBL276 Muscarinic acetylcholine receptor M1 Rattus norvegicus 1.000
CHEMBL245 Muscarinic acetylcholine receptor M3 Homo sapiens 1.000
CHEMBL6084 Acetylcholine-binding protein Lymnaea stagnalis 1.000
CHEMBL2672 Muscarinic acetylcholine receptor M1 Bos taurus 1.000
CHEMBL211 Muscarinic acetylcholine receptor M2 Homo sapiens 1.000
CHEMBL216 Muscarinic acetylcholine receptor M1 Homo sapiens 1.000
CHEMBL5011 Transient receptor potential cation channel subfamily M member 8 Rattus norvegicus 1.000
CHEMBL5498 Muscarinic acetylcholine receptor M3 Cavia porcellus 0.920
CHEMBL1821 Muscarinic acetylcholine receptor M4 Homo sapiens 0.818
CHEMBL4198 Inhibitor of apoptosis protein 3 Homo sapiens 0.650
CHEMBL289 Cytochrome P450 2D6 Homo sapiens 0.587
CHEMBL2035 Muscarinic acetylcholine receptor M5 Homo sapiens 0.422
CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit Homo sapiens 0.348
CHEMBL5462 Baculoviral IAP repeat-containing protein 2 Homo sapiens 0.256
CHEMBL2056 Dopamine D1 receptor Homo sapiens 0.253
CHEMBL2125 Vesicular acetylcholine transporter Rattus norvegicus 0.244

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
362.5 362.1994 4.03 3 32.78 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 0 0 4 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 9.03 4.16 2.53 2 27 0.83

Structural Alerts

There are 1 structural alerts for CHEMBL1200803. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:RXZMMZZRUPYENV-VROPFNGYSA-N
DailyMed solifenacin succinate

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1200803



ACToR 242478-38-2
ChEBI 32151
eMolecules 36754570
FDA SRS KKA5DLD701
Human Metabolome Database HMDB15530
MolPort MolPort-035-691-413
PharmGKB PA164783810
PubChem 216457
PubChem: Drugs of the Future 12015109
PubChem: Thomson Pharma 16859664 14785637
Selleck solifenacin-succinate
SureChEMBL SCHEMBL109333

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