Compound Detail
CHEMBL513261
SULFOMETURON METHYL Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL513261 |
| Name | SULFOMETURON METHYL |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZDXMLEQEMNLCQG-UHFFFAOYSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
13
Publications
0
Known Names
Molecular Properties
364.4
MW (Da)
1.39
ALogP
7
HBA
2
HBD
127.3
PSA (Ų)
0.78
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.12
Ki 2 meas. best 7.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Acetolactate synthase catalytic subunit, mitochondrial CHEMBL1075095 | Ki | 7.29 | 7.29 | 50.8 | 1 |
| Unchecked CHEMBL612545 | Ki | 6.2 | 6.2 | 634.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 6.12 | 5.72 | 758.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Acetolactate synthase catalytic subunit, mitochondrial | Ki | = | 50.8 | nM | 7.29 | Inhibition of Saccharomyces cerevisiae acetohydroxyacid synthase by colorimetric... | 23237384 |
| Unchecked | Ki | = | 634.0 | nM | 6.2 | Inhibition of Candida albicans acetohydroxyacid synthase catalytic domain expres... | 23237384 |
| Unchecked | IC50 | = | 758.58 | nM | 6.12 | Inhibition of Mycobacterium tuberculosis acetohydroxy acid synthase after 60 min... | 24703230 |
| Unchecked | IC50 | = | 4790.0 | nM | 5.32 | Inhibition of Mycobacterium tuberculosis AHAS catalytic subunit assessed as inhi... | 25771108 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25771108 | 10.1016/j.ejmech.2015.03.014 | Mycobacterium tuberculosis | 24 |
| 24703230 | 10.1016/j.bmcl.2014.02.054 | Mycobacterium tuberculosis | 2 |
| 15917508 | 10.1128/aac.49.6.2153-2163.2005 | Mycobacterium tuberculosis | 1 |
| 22326144 | 10.1016/j.ejmech.2012.01.011 | Mycobacterium tuberculosis | 1 |
| 16407096 | 10.1073/pnas.0508701103 | Acetolactate synthase catalytic subunit, mitochondrial | 1 |
| 16407096 | 10.1073/pnas.0508701103 | Unchecked | 1 |
| 23237384 | 10.1021/jm301501k | Cryptococcus neoformans | 1 |
| 23237384 | 10.1021/jm301501k | Saccharomyces cerevisiae | 1 |
| 23237384 | 10.1021/jm301501k | Candida albicans | 1 |
| 23237384 | 10.1021/jm301501k | Acetolactate synthase catalytic subunit, mitochondrial | 1 |
| 23237384 | 10.1021/jm301501k | Unchecked | 1 |
| 24703230 | 10.1016/j.bmcl.2014.02.054 | Unchecked | 1 |
| 25771108 | 10.1016/j.ejmech.2015.03.014 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine