Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL375492

AMITHIOZONE
🧪 Phase II
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
🧪 Phase II
CC(=O)Nc1ccc(/C=N/NC(N)=S)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL375492
Name AMITHIOZONE
Phase Phase II
Structure Type MOL
InChI Key SRVJKTDHMYAMHA-WUXMJOGZSA-N
Active Moiety CHEMBL6068325

Known Names

Amithiozone Citazone NSC-3550 SQ-2321 TB I-698 Thiacetazone Thibone Thioacetazone Thioacetazonum Thiocarbazil Thioparamizone Tioacetazona
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
12
Known Names
2
Indications

Molecular Properties

236.3
MW (Da)
0.81
ALogP
3
HBA
3
HBD
79.5
PSA (Ų)
0.41
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product Prodrug

Extended Properties

Molecular Formula C10H12N4OS
MW 236.30
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -2.17

Indications

Mycobacterium avium-intracellulare Infection Tuberculosis

ATC Classification

J04AK07
thioacetazone
Level 1: ANTIINFECTIVES FOR SYSTEMIC USE
Level 2: ANTIMYCOBACTERIALS

Activity Summary

IC50 1 meas. best 4.85

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosinase
CHEMBL3318
 IC50 4.85 4.85 14000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Tyrosinase IC50 = 14000.0 nM 4.85 Inhibition of mushroom tyrosinase 32283298

Literature References

PubMed DOI Target Context # Activities
15646539 10.1016/s0399-8320(04)95062-2 Unchecked 11
15646539 10.1016/s0399-8320(04)95062-2 NON-PROTEIN TARGET 8
17220416 10.1128/aac.01063-06 Mycobacterium tuberculosis 5
17210775 10.1128/aac.00055-06 Mycobacterium tuberculosis 4
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
17220416 10.1128/aac.01063-06 NON-PROTEIN TARGET 2
19397322 10.1021/jm800861c NON-PROTEIN TARGET 2
18834112 10.1021/jm800656v Amine oxidase [flavin-containing] A 2
18834112 10.1021/jm800656v Amine oxidase [flavin-containing] B 2
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 2
37468498 10.1038/s41467-023-40064-9 D(1A) dopamine receptor 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
23956101 10.1093/toxsci/kft176 ATP-binding cassette sub-family C member 2 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent dopamine transporter 1
28628823 10.1016/j.ejmech.2017.06.005 Mycobacterium tuberculosis 1
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 1
32259446 10.1021/acs.jmedchem.9b02075 Mycobacterium avium 1
23956101 10.1093/toxsci/kft176 ATP-binding cassette sub-family C member 4 1
23956101 10.1093/toxsci/kft176 ATP-binding cassette sub-family C member 3 1
23956101 10.1093/toxsci/kft176 Bile salt export pump 1

Data from ChEMBL 36 via Core Engine