Assay Detail
Binding
CHEMBL5531642
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of Staphylococcus aureus DHFR expressed in Escherichia coli BL21 (DE3) using DHF as substrate preincubated for 10 mins followed by substrate addition measured for 10 mins in presence of NADPH by spectrophotometry
27
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Staphylococcus aureus |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Design, Synthesis, and Biological Evaluation of 5-(5-Iodo-2-isopropyl-4-methoxyphenoxy)pyrimidine-2,4-diamine (AF-353) Derivatives as Novel DHFR Inhibitors against <i>Staphylococcus aureus</i>.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 27 | 7.62 | 9.01 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5563206 | — | — | 1 | 9.01 |
| CHEMBL5562750 | — | — | 1 | 8.74 |
| CHEMBL5569444 | — | — | 1 | 8.35 |
| CHEMBL5575458 | — | — | 1 | 8.11 |
| CHEMBL5569040 | — | — | 1 | 8.08 |
| CHEMBL5572153 | — | — | 1 | 8.08 |
| CHEMBL5562500 | — | — | 1 | 7.99 |
| CHEMBL5564319 | — | — | 1 | 7.81 |
| CHEMBL5566054 | — | — | 1 | 7.80 |
| CHEMBL5550068 | — | — | 1 | 7.72 |
| CHEMBL5574252 | — | — | 1 | 7.62 |
| CHEMBL502618 | — | — | 1 | 7.61 |
| CHEMBL22 | TRIMETHOPRIM | 4.0 | 1 | 7.58 |
| CHEMBL5575103 | — | — | 1 | 7.55 |
| CHEMBL526307 | — | — | 1 | 7.48 |
| CHEMBL5575570 | — | — | 1 | 7.46 |
| CHEMBL5589963 | — | — | 1 | 7.43 |
| CHEMBL5572967 | — | — | 1 | 7.42 |
| CHEMBL5563617 | — | — | 1 | 7.41 |
| CHEMBL5565406 | — | — | 1 | 7.38 |
| CHEMBL5590270 | — | — | 1 | 7.35 |
| CHEMBL5564050 | — | — | 1 | 7.22 |
| CHEMBL5556334 | — | — | 1 | 7.18 |
| CHEMBL5569247 | — | — | 1 | 7.16 |
| CHEMBL5565112 | — | — | 1 | 6.85 |
| CHEMBL5569505 | — | — | 1 | 6.83 |
| CHEMBL5572687 | — | — | 1 | 6.62 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5563206 | — | IC50 | = | 0.97 | nM | 9.01 |
| CHEMBL5562750 | — | IC50 | = | 1.81 | nM | 8.74 |
| CHEMBL5569444 | — | IC50 | = | 4.44 | nM | 8.35 |
| CHEMBL5575458 | — | IC50 | = | 7.69 | nM | 8.11 |
| CHEMBL5569040 | — | IC50 | = | 8.29 | nM | 8.08 |
| CHEMBL5572153 | — | IC50 | = | 8.36 | nM | 8.08 |
| CHEMBL5562500 | — | IC50 | = | 10.16 | nM | 7.99 |
| CHEMBL5564319 | — | IC50 | = | 15.45 | nM | 7.81 |
| CHEMBL5566054 | — | IC50 | = | 15.9 | nM | 7.80 |
| CHEMBL5550068 | — | IC50 | = | 19.06 | nM | 7.72 |
| CHEMBL5574252 | — | IC50 | = | 24.2 | nM | 7.62 |
| CHEMBL502618 | — | IC50 | = | 24.71 | nM | 7.61 |
| CHEMBL22 | TRIMETHOPRIM | IC50 | = | 26.46 | nM | 7.58 |
| CHEMBL5575103 | — | IC50 | = | 27.84 | nM | 7.55 |
| CHEMBL526307 | — | IC50 | = | 32.87 | nM | 7.48 |
| CHEMBL5575570 | — | IC50 | = | 34.84 | nM | 7.46 |
| CHEMBL5589963 | — | IC50 | = | 36.7 | nM | 7.43 |
| CHEMBL5572967 | — | IC50 | = | 37.89 | nM | 7.42 |
| CHEMBL5563617 | — | IC50 | = | 38.66 | nM | 7.41 |
| CHEMBL5565406 | — | IC50 | = | 41.8 | nM | 7.38 |
| CHEMBL5590270 | — | IC50 | = | 45.03 | nM | 7.35 |
| CHEMBL5564050 | — | IC50 | = | 60.23 | nM | 7.22 |
| CHEMBL5556334 | — | IC50 | = | 66.62 | nM | 7.18 |
| CHEMBL5569247 | — | IC50 | = | 69.52 | nM | 7.16 |
| CHEMBL5565112 | — | IC50 | = | 142.5 | nM | 6.85 |
| CHEMBL5569505 | — | IC50 | = | 148.5 | nM | 6.83 |
| CHEMBL5572687 | — | IC50 | = | 238.9 | nM | 6.62 |