Assay Detail
ADMET
CHEMBL1248643
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human recombinant CYP2C19 preincubated for 10 mins
16
Total Activities
16
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Design and synthesis of novel tricyclic benzoxazines as potent 5-HT(1A/B/D) receptor antagonists leading to the discovery of 6-{2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl}-4H-imidazo[5,1-c][1,4]benzoxazine-3-carboxamide (GSK588045).
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 16 | 5.44 | 5.52 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1242167 | — | — | 1 | 5.52 |
| CHEMBL1242904 | — | — | 1 | 5.40 |
| CHEMBL1242436 | — | — | 1 | 5.40 |
| CHEMBL1241738 | — | — | 1 | - |
| CHEMBL1241546 | — | — | 1 | - |
| CHEMBL1241736 | — | — | 1 | - |
| CHEMBL1241824 | — | — | 1 | - |
| CHEMBL1241912 | — | — | 1 | - |
| CHEMBL1241913 | — | — | 1 | - |
| CHEMBL1241998 | — | — | 1 | - |
| CHEMBL1242081 | — | — | 1 | - |
| CHEMBL1242345 | — | — | 1 | - |
| CHEMBL1242533 | — | — | 1 | - |
| CHEMBL1242623 | — | — | 1 | - |
| CHEMBL1242717 | — | — | 1 | - |
| CHEMBL1241642 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1242167 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL1242904 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL1242436 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL1241738 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL1241546 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL1241736 | — | IC50 | > | 5000.0 | nM | - |
| CHEMBL1241824 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL1241912 | — | IC50 | > | 9000.0 | nM | - |
| CHEMBL1241913 | — | IC50 | > | 9000.0 | nM | - |
| CHEMBL1241998 | — | IC50 | > | 8000.0 | nM | - |
| CHEMBL1242081 | — | IC50 | > | 7000.0 | nM | - |
| CHEMBL1242345 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL1242533 | — | IC50 | > | 6000.0 | nM | - |
| CHEMBL1242623 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL1242717 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL1241642 | — | IC50 | < | 1000.0 | nM | - |