Assay Detail
Binding
CHEMBL1912790
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Inhibition of DPP4
5
Total Activities
5
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Molecular dynamics simulations and MM/GBSA methods to investigate binding mechanisms of aminomethylpyrimidine inhibitors with DPP-IV.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 5 | 7.35 | 10.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL34062 | — | — | 1 | 10.00 |
| CHEMBL1909975 | — | — | 1 | 8.52 |
| CHEMBL36020 | — | — | 1 | 8.00 |
| CHEMBL34603 | — | — | 1 | 5.85 |
| CHEMBL289562 | — | — | 1 | 4.38 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL34062 | — | IC50 | = | 0.1 | nM | 10.00 |
| CHEMBL1909975 | — | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL36020 | — | IC50 | = | 10.0 | nM | 8.00 |
| CHEMBL34603 | — | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL289562 | — | IC50 | = | 42000.0 | nM | 4.38 |