Assay Detail
ADMET
CHEMBL1100427
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Inhibition of CYP1A2
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Evaluation of basic, heterocyclic ring systems as templates for use as potassium competitive acid blockers (pCABs).
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 21 | 4.99 | 6.16 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1076536 | — | — | 1 | 6.16 |
| CHEMBL1087758 | — | — | 1 | 5.92 |
| CHEMBL47529 | — | — | 1 | 5.70 |
| CHEMBL1081505 | — | — | 1 | 5.68 |
| CHEMBL1080473 | — | — | 1 | 5.43 |
| CHEMBL238146 | — | — | 1 | 5.37 |
| CHEMBL1080717 | — | — | 1 | 5.21 |
| CHEMBL1076210 | — | — | 1 | 4.85 |
| CHEMBL1079957 | — | — | 1 | 4.66 |
| CHEMBL1076245 | — | — | 1 | 4.58 |
| CHEMBL1080472 | — | — | 1 | 4.54 |
| CHEMBL1081870 | — | — | 1 | 4.51 |
| CHEMBL1079436 | — | — | 1 | 4.46 |
| CHEMBL1076192 | — | — | 1 | 4.39 |
| CHEMBL1080088 | — | — | 1 | 4.21 |
| CHEMBL1079958 | — | — | 1 | 4.19 |
| CHEMBL1081504 | — | — | 1 | - |
| CHEMBL1079437 | — | — | 1 | - |
| CHEMBL497011 | LINAPRAZAN | 2.0 | 1 | - |
| CHEMBL1080803 | — | — | 1 | - |
| CHEMBL1080982 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1076536 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL1087758 | — | IC50 | = | 1200.0 | nM | 5.92 |
| CHEMBL47529 | — | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL1081505 | — | IC50 | = | 2100.0 | nM | 5.68 |
| CHEMBL1080473 | — | IC50 | = | 3700.0 | nM | 5.43 |
| CHEMBL238146 | — | IC50 | = | 4300.0 | nM | 5.37 |
| CHEMBL1080717 | — | IC50 | = | 6100.0 | nM | 5.21 |
| CHEMBL1076210 | — | IC50 | = | 14000.0 | nM | 4.85 |
| CHEMBL1079957 | — | IC50 | = | 22000.0 | nM | 4.66 |
| CHEMBL1076245 | — | IC50 | = | 26000.0 | nM | 4.58 |
| CHEMBL1080472 | — | IC50 | = | 29000.0 | nM | 4.54 |
| CHEMBL1081870 | — | IC50 | = | 31000.0 | nM | 4.51 |
| CHEMBL1079436 | — | IC50 | = | 35000.0 | nM | 4.46 |
| CHEMBL1076192 | — | IC50 | = | 41000.0 | nM | 4.39 |
| CHEMBL1080088 | — | IC50 | = | 62000.0 | nM | 4.21 |
| CHEMBL1079958 | — | IC50 | = | 65000.0 | nM | 4.19 |
| CHEMBL1081504 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL1079437 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL497011 | LINAPRAZAN | IC50 | > | 50000.0 | nM | - |
| CHEMBL1080803 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL1080982 | — | IC50 | > | 100000.0 | nM | - |