Assay Detail
ADMET
CHEMBL2169434
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Inhibition of human liver OATP2B1 expressed in HEK293 Flp-In cells assessed as reduction in [3H]E3S uptake incubated for 5 mins by scintillation counting
22
Total Activities
11
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Cell Type | HEK293 |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Solute carrier organic anion transporter family member 2B1 (CHEMBL1743124) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Classification of inhibitors of hepatic organic anion transporting polypeptides (OATPs): influence of protein expression on drug-drug interactions.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 11 | 5.15 | 6.28 |
| IC50 | 11 | 5.09 | 6.26 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL553 | ERLOTINIB | 4.0 | 2 | 6.28 |
| CHEMBL15177 | MK-571 | — | 2 | 5.55 |
| CHEMBL421 | SULFASALAZINE | 4.0 | 2 | 5.52 |
| CHEMBL1163 | ATAZANAVIR | 4.0 | 2 | 5.29 |
| CHEMBL163 | RITONAVIR | 4.0 | 2 | 5.23 |
| CHEMBL343002 | — | — | 2 | 4.70 |
| CHEMBL160 | CYCLOSPORINE | 4.0 | 2 | 4.44 |
| CHEMBL374478 | RIFAMPIN | 4.0 | 2 | 4.20 |
| CHEMBL1144 | PRAVASTATIN | 4.0 | 2 | - |
| CHEMBL6 | INDOMETHACIN | 4.0 | 2 | - |
| CHEMBL53463 | DOXORUBICIN | 4.0 | 2 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL553 | ERLOTINIB | Ki | = | 530.0 | nM | 6.28 |
| CHEMBL553 | ERLOTINIB | IC50 | = | 550.0 | nM | 6.26 |
| CHEMBL15177 | MK-571 | Ki | = | 2800.0 | nM | 5.55 |
| CHEMBL15177 | MK-571 | IC50 | = | 2900.0 | nM | 5.54 |
| CHEMBL421 | SULFASALAZINE | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL421 | SULFASALAZINE | Ki | = | 3000.0 | nM | 5.52 |
| CHEMBL1163 | ATAZANAVIR | Ki | = | 5100.0 | nM | 5.29 |
| CHEMBL1163 | ATAZANAVIR | IC50 | = | 5200.0 | nM | 5.28 |
| CHEMBL163 | RITONAVIR | Ki | = | 5900.0 | nM | 5.23 |
| CHEMBL163 | RITONAVIR | IC50 | = | 6100.0 | nM | 5.21 |
| CHEMBL343002 | — | Ki | = | 20000.0 | nM | 4.70 |
| CHEMBL160 | CYCLOSPORINE | Ki | = | 36000.0 | nM | 4.44 |
| CHEMBL160 | CYCLOSPORINE | IC50 | = | 37000.0 | nM | 4.43 |
| CHEMBL343002 | — | IC50 | = | 51000.0 | nM | 4.29 |
| CHEMBL374478 | RIFAMPIN | Ki | = | 63000.0 | nM | 4.20 |
| CHEMBL374478 | RIFAMPIN | IC50 | = | 65000.0 | nM | 4.19 |
| CHEMBL1144 | PRAVASTATIN | IC50 | = | 190000.0 | nM | - |
| CHEMBL1144 | PRAVASTATIN | Ki | = | 180000.0 | nM | - |
| CHEMBL6 | INDOMETHACIN | IC50 | = | 140000.0 | nM | - |
| CHEMBL6 | INDOMETHACIN | Ki | = | 130000.0 | nM | - |
| CHEMBL53463 | DOXORUBICIN | Ki | = | 230000.0 | nM | - |
| CHEMBL53463 | DOXORUBICIN | IC50 | = | 240000.0 | nM | - |