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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1484857
CHEMBL1484857
Compound Name SUCCINYLSULFATHIAZOLE
ChEMBL Synonyms Succinylsulfathiazole
Max Phase 0
Trade Names
Molecular Formula C13H13N3O5S2

Additional synonyms for CHEMBL1484857 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nccs2
Standard InChI InChI=1S/C13H13N3O5S2/c17-11(5-6-12(18)19)15-9-1-3-10(4-2-9) ...
Download InChI
Standard InChI Key SKVLYVHULOWXTD-UHFFFAOYSA-N

Molecule Features

CHEMBL1484857 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 2 structural alerts for CHEMBL1484857. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL1484857

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 CHEMBL1484857. 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
CHEMBL281 Carbonic anhydrase IV Bos taurus 1.000
CHEMBL261 Carbonic anhydrase I Homo sapiens 1.000
CHEMBL205 Carbonic anhydrase II Homo sapiens 1.000
CHEMBL3594 Carbonic anhydrase IX Homo sapiens 0.998
CHEMBL4296 Sodium channel protein type IX alpha subunit Homo sapiens 0.988
CHEMBL1949 Cyclophilin A Homo sapiens 0.962
CHEMBL2026 Beta-lactamase AmpC Escherichia coli K-12 0.945
CHEMBL2392 DNA polymerase beta Homo sapiens 0.936
CHEMBL1287622 Lethal(3)malignant brain tumor-like protein 1 Homo sapiens 0.871
CHEMBL5514 Huntingtin Homo sapiens 0.759
CHEMBL4789 Carbonic anhydrase VA Homo sapiens 0.696
CHEMBL1293231 Nuclear receptor ROR-gamma Mus musculus 0.540
CHEMBL1947 Thyroid hormone receptor beta-1 Homo sapiens 0.247
CHEMBL6110 Thioredoxin glutathione reductase Schistosoma mansoni 0.241



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL5686 6-phospho-1-fructokinase Trypanosoma brucei 1.000
CHEMBL281 Carbonic anhydrase IV Bos taurus 1.000
CHEMBL205 Carbonic anhydrase II Homo sapiens 0.997
CHEMBL4296 Sodium channel protein type IX alpha subunit Homo sapiens 0.995
CHEMBL261 Carbonic anhydrase I Homo sapiens 0.991
CHEMBL4361 Induced myeloid leukemia cell differentiation protein Mcl-1 Homo sapiens 0.984
CHEMBL2026 Beta-lactamase AmpC Escherichia coli K-12 0.928
CHEMBL3864 Protein-tyrosine phosphatase 2C Homo sapiens 0.926
CHEMBL3594 Carbonic anhydrase IX Homo sapiens 0.893
CHEMBL1075189 Pyruvate kinase isozymes M1/M2 Homo sapiens 0.891
CHEMBL1993 DNA (cytosine-5)-methyltransferase 1 Homo sapiens 0.525
CHEMBL2392 DNA polymerase beta Homo sapiens 0.517
CHEMBL1293313 M17 leucyl aminopeptidase Plasmodium falciparum 3D7 0.462
CHEMBL3687 Arachidonate 12-lipoxygenase Homo sapiens 0.458
CHEMBL1949 Cyclophilin A Homo sapiens 0.428
CHEMBL5514 Huntingtin Homo sapiens 0.322
CHEMBL1293231 Nuclear receptor ROR-gamma Mus musculus 0.320
CHEMBL1293224 Microtubule-associated protein tau Homo sapiens 0.312
CHEMBL3577 Aldehyde dehydrogenase 1A1 Homo sapiens 0.205
CHEMBL1287622 Lethal(3)malignant brain tumor-like protein 1 Homo sapiens 0.203

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
355.4 355.0297 0.28 7 162.07 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 3 0 8 3 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
4.51 1.79 .19 -3.14 2 23 0.65

Compound Cross References

ATC A - ALIMENTARY TRACT AND METABOLISM
A07 - ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE
A07A - INTESTINAL ANTIINFECTIVES
A07AB - Sulfonamides
A07AB04 - succinylsulfathiazole

ChemSpider ChemSpider:SKVLYVHULOWXTD-UHFFFAOYSA-N
PubChem SID: 11112259 SID: 144203951 SID: 170465721 SID: 855781

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1484857



ACToR 116-43-8
ChEBI 9309
eMolecules 478288
FDA SRS RSS8647O4S
IBM Patent System 30F5947A9B539B31AAF798FD1AEF4DE1
KEGG Ligand C11745
LINCS LSM-5210
Mcule MCULE-7766194789
MolPort MolPort-000-421-568
Nikkaji J5.280I
PubChem 5315
PubChem: Thomson Pharma 14901089
SureChEMBL SCHEMBL151873

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