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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL529888
CHEMBL529888
Compound Name GLIBORNURIDE
ChEMBL Synonyms GLUTRIL | RO 6-4563 | GLIBORNURIDE
Max Phase 4 (Approved)
Trade Names GLUTRIL
Molecular Formula C18H26N2O4S

Additional synonyms for CHEMBL529888 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)N[C@@H]2[C@H](O)[C@]3(C)CC[C@H]2C3 ...
Download SMILES
Standard InChI InChI=1S/C18H26N2O4S/c1-11-5-7-12(8-6-11)25(23,24)20-16(22)1 ...
Download InChI
Standard InChI Key RMTYNAPTNBJHQI-LLDVTBCESA-N

Sources

  • British National Formulary
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL529888

Molecule Features

CHEMBL529888 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:N Parenteral:N Topical:N Black Box:N Availability Type:Unknown

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
Diabetes MellitusD003920EFO:0000400diabetes mellitus4ATC

Clinical Data

ClinicalTrials.gov GLIBORNURIDE
The Cochrane Collaboration GLIBORNURIDE

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 CHEMBL529888. 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
CHEMBL3559 Steryl-sulfatase Homo sapiens 0.995
CHEMBL4235 11-beta-hydroxysteroid dehydrogenase 1 Homo sapiens 0.559
CHEMBL3510 Carbonic anhydrase XIV Homo sapiens 0.483
CHEMBL205 Carbonic anhydrase II Homo sapiens 0.449
CHEMBL261 Carbonic anhydrase I Homo sapiens 0.317
CHEMBL4789 Carbonic anhydrase VA Homo sapiens 0.287
CHEMBL4681 Aldo-keto-reductase family 1 member C3 Homo sapiens 0.245



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL3559 Steryl-sulfatase Homo sapiens 0.986
CHEMBL4681 Aldo-keto-reductase family 1 member C3 Homo sapiens 0.866
CHEMBL261 Carbonic anhydrase I Homo sapiens 0.808
CHEMBL4235 11-beta-hydroxysteroid dehydrogenase 1 Homo sapiens 0.787
CHEMBL3746 11-beta-hydroxysteroid dehydrogenase 2 Homo sapiens 0.611
CHEMBL205 Carbonic anhydrase II Homo sapiens 0.502
CHEMBL2283 Carbonic anhydrase II Bos taurus 0.390
CHEMBL333 Matrix metalloproteinase-2 Homo sapiens 0.377

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
366.5 366.1613 2.17 3 95.5 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 3 0 6 3 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
5.2 - 2.69 .76 1 25 0.76

Structural Alerts

There are 1 structural alerts for CHEMBL529888. To view alerts please click here.

Compound Cross References

ATC A - ALIMENTARY TRACT AND METABOLISM
A10 - DRUGS USED IN DIABETES
A10B - BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
A10BB - Sulfonylureas
A10BB04 - glibornuride

ChemSpider ChemSpider:RMTYNAPTNBJHQI-LLDVTBCESA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL529888



ACToR 26944-48-9
ChEBI 135545
DrugBank DB08962
DrugCentral 1298
FDA SRS VP83E7434R
IBM Patent System 3BF2DEBF257A963D6C4C63C54F52BA87
PubChem 12818200
SureChEMBL SCHEMBL49695
ZINC ZINC000002012812

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