Assay Detail
Binding
CHEMBL1176972
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Inhibition of Trypanosoma brucei 6PGDH expressed in Escherichia coli by spectroscopy
17
Total Activities
17
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Trypanosoma brucei |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Virtual fragment screening for novel inhibitors of 6-phosphogluconate dehydrogenase.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 11 | 4.38 | 5.24 |
| Ki | 6 | 6.81 | 8.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL116018 | — | — | 1 | 8.00 |
| CHEMBL324609 | — | — | 1 | 7.46 |
| CHEMBL114269 | — | — | 1 | 7.10 |
| CHEMBL1160945 | — | — | 1 | 6.89 |
| CHEMBL1173785 | — | — | 1 | 6.02 |
| CHEMBL1173784 | — | — | 1 | 5.36 |
| CHEMBL1173716 | — | — | 1 | 5.24 |
| CHEMBL1173650 | — | — | 1 | 4.55 |
| CHEMBL507614 | — | — | 1 | 4.38 |
| CHEMBL1173717 | — | — | 1 | 4.38 |
| CHEMBL1171074 | — | — | 1 | 4.37 |
| CHEMBL1173367 | — | — | 1 | 4.35 |
| CHEMBL1173371 | — | — | 1 | 4.29 |
| CHEMBL1173715 | — | — | 1 | 4.28 |
| CHEMBL1171264 | — | — | 1 | 4.25 |
| CHEMBL1173370 | — | — | 1 | 4.14 |
| CHEMBL1173372 | — | — | 1 | 3.94 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL116018 | — | Ki | = | 10.0 | nM | 8.00 |
| CHEMBL324609 | — | Ki | = | 35.0 | nM | 7.46 |
| CHEMBL114269 | — | Ki | = | 80.0 | nM | 7.10 |
| CHEMBL1160945 | — | Ki | = | 130.0 | nM | 6.89 |
| CHEMBL1173785 | — | Ki | = | 950.0 | nM | 6.02 |
| CHEMBL1173784 | — | Ki | = | 4400.0 | nM | 5.36 |
| CHEMBL1173716 | — | IC50 | = | 5800.0 | nM | 5.24 |
| CHEMBL1173650 | — | IC50 | = | 28000.0 | nM | 4.55 |
| CHEMBL507614 | — | IC50 | = | 42000.0 | nM | 4.38 |
| CHEMBL1173717 | — | IC50 | = | 42000.0 | nM | 4.38 |
| CHEMBL1171074 | — | IC50 | = | 43000.0 | nM | 4.37 |
| CHEMBL1173367 | — | IC50 | = | 45000.0 | nM | 4.35 |
| CHEMBL1173371 | — | IC50 | = | 51000.0 | nM | 4.29 |
| CHEMBL1173715 | — | IC50 | = | 53000.0 | nM | 4.28 |
| CHEMBL1171264 | — | IC50 | = | 56000.0 | nM | 4.25 |
| CHEMBL1173370 | — | IC50 | = | 73000.0 | nM | 4.14 |
| CHEMBL1173372 | — | IC50 | = | 114000.0 | nM | 3.94 |