Assay Detail
ADMET
CHEMBL4011663
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human BSEP expressed in fall armyworm sf9 cell plasma membrane vesicles assessed as reduction in vesicle-associated [3H]-taurocholate transport preincubated for 10 mins prior to ATP addition measured after 15 mins in presence of [3H]-taurocholate by topcount based membrane vesicle transport assay
216
Total Activities
216
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
Interference with bile salt export pump function is a susceptibility factor for human liver injury in drug development.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 216 | 4.82 | 6.40 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL595 | PIOGLITAZONE | 4.0 | 1 | 6.40 |
| CHEMBL160 | CYCLOSPORINE | 4.0 | 1 | 6.05 |
| CHEMBL223643 | VALINOMYCIN | — | 1 | 5.80 |
| CHEMBL163 | RITONAVIR | 4.0 | 1 | 5.66 |
| CHEMBL157101 | KETOCONAZOLE | 4.0 | 1 | 5.47 |
| CHEMBL15177 | MK-571 | — | 1 | 5.46 |
| CHEMBL1136 | TELITHROMYCIN | 4.0 | 1 | 5.40 |
| CHEMBL121 | ROSIGLITAZONE | 4.0 | 1 | 5.36 |
| CHEMBL114 | SAQUINAVIR | 4.0 | 1 | 5.31 |
| CHEMBL408 | TROGLITAZONE | 4.0 | 1 | 5.23 |
| CHEMBL623 | NEFAZODONE | 4.0 | 1 | 5.21 |
| CHEMBL472 | GLYBURIDE | 4.0 | 1 | 5.21 |
| CHEMBL554 | LAPATINIB | 4.0 | 1 | 5.19 |
| CHEMBL1336 | SORAFENIB | 4.0 | 1 | 5.10 |
| CHEMBL1484 | NICARDIPINE | 4.0 | 1 | 5.10 |
| CHEMBL772 | RESERPINE | 4.0 | 1 | 5.08 |
| CHEMBL374975 | FUSIDIC ACID | 3.0 | 1 | 5.00 |
| CHEMBL4068768 | — | — | 1 | 4.99 |
| CHEMBL939 | GEFITINIB | 4.0 | 1 | 4.96 |
| CHEMBL584 | NELFINAVIR | 4.0 | 1 | 4.93 |
| CHEMBL2218877 | ERYTHROMYCIN ESTOLATE | 4.0 | 1 | 4.89 |
| CHEMBL1292 | CLOFAZIMINE | 4.0 | 1 | 4.89 |
| CHEMBL428496 | WORTMANNIN | — | 1 | 4.87 |
| CHEMBL4060109 | — | — | 1 | 4.85 |
| CHEMBL672 | FENOFIBRATE | 4.0 | 1 | 4.82 |
| CHEMBL428647 | PACLITAXEL | 4.0 | 1 | 4.82 |
| CHEMBL1481 | GLIMEPIRIDE | 4.0 | 1 | 4.80 |
| CHEMBL43064 | CINNARIZINE | 2.0 | 1 | 4.80 |
| CHEMBL1017 | TELMISARTAN | 4.0 | 1 | 4.79 |
| CHEMBL388590 | BENZBROMARONE | 4.0 | 1 | 4.76 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL595 | PIOGLITAZONE | IC50 | = | 400.0 | nM | 6.40 |
| CHEMBL160 | CYCLOSPORINE | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL223643 | VALINOMYCIN | IC50 | = | 1600.0 | nM | 5.80 |
| CHEMBL163 | RITONAVIR | IC50 | = | 2200.0 | nM | 5.66 |
| CHEMBL157101 | KETOCONAZOLE | IC50 | = | 3400.0 | nM | 5.47 |
| CHEMBL15177 | MK-571 | IC50 | = | 3500.0 | nM | 5.46 |
| CHEMBL1136 | TELITHROMYCIN | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL121 | ROSIGLITAZONE | IC50 | = | 4400.0 | nM | 5.36 |
| CHEMBL114 | SAQUINAVIR | IC50 | = | 4900.0 | nM | 5.31 |
| CHEMBL408 | TROGLITAZONE | IC50 | = | 5900.0 | nM | 5.23 |
| CHEMBL623 | NEFAZODONE | IC50 | = | 6100.0 | nM | 5.21 |
| CHEMBL472 | GLYBURIDE | IC50 | = | 6100.0 | nM | 5.21 |
| CHEMBL554 | LAPATINIB | IC50 | = | 6500.0 | nM | 5.19 |
| CHEMBL1336 | SORAFENIB | IC50 | = | 8000.0 | nM | 5.10 |
| CHEMBL1484 | NICARDIPINE | IC50 | = | 7900.0 | nM | 5.10 |
| CHEMBL772 | RESERPINE | IC50 | = | 8400.0 | nM | 5.08 |
| CHEMBL374975 | FUSIDIC ACID | IC50 | = | 10100.0 | nM | 5.00 |
| CHEMBL4068768 | — | IC50 | = | 10300.0 | nM | 4.99 |
| CHEMBL939 | GEFITINIB | IC50 | = | 10900.0 | nM | 4.96 |
| CHEMBL584 | NELFINAVIR | IC50 | = | 11800.0 | nM | 4.93 |
| CHEMBL2218877 | ERYTHROMYCIN ESTOLATE | IC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL1292 | CLOFAZIMINE | IC50 | = | 12900.0 | nM | 4.89 |
| CHEMBL428496 | WORTMANNIN | IC50 | = | 13600.0 | nM | 4.87 |
| CHEMBL4060109 | — | IC50 | = | 14000.0 | nM | 4.85 |
| CHEMBL428647 | PACLITAXEL | IC50 | = | 15000.0 | nM | 4.82 |
| CHEMBL672 | FENOFIBRATE | IC50 | = | 15300.0 | nM | 4.82 |
| CHEMBL1481 | GLIMEPIRIDE | IC50 | = | 15700.0 | nM | 4.80 |
| CHEMBL43064 | CINNARIZINE | IC50 | = | 15700.0 | nM | 4.80 |
| CHEMBL1017 | TELMISARTAN | IC50 | = | 16200.0 | nM | 4.79 |
| CHEMBL388590 | BENZBROMARONE | IC50 | = | 17500.0 | nM | 4.76 |
| CHEMBL729 | LOPINAVIR | IC50 | = | 17300.0 | nM | 4.76 |
| CHEMBL64391 | ITRACONAZOLE | IC50 | = | 18000.0 | nM | 4.75 |
| CHEMBL388978 | STAUROSPORINE | IC50 | = | 18700.0 | nM | 4.73 |
| CHEMBL5483011 | INDINAVIR | IC50 | = | 21200.0 | nM | 4.67 |
| CHEMBL957 | BOSENTAN | IC50 | = | 22000.0 | nM | 4.66 |
| CHEMBL1064 | SIMVASTATIN | IC50 | = | 24700.0 | nM | 4.61 |
| CHEMBL374478 | RIFAMPIN | IC50 | = | 25300.0 | nM | 4.60 |
| CHEMBL475534 | NITRENDIPINE | IC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL633 | AMIODARONE | IC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL45816 | MIBEFRADIL | IC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL451 | CHLORDIAZEPOXIDE | IC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL941 | IMATINIB | IC50 | = | 25100.0 | nM | 4.60 |
| CHEMBL116 | AMPRENAVIR | IC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL444633 | RIFABUTIN | IC50 | = | 26700.0 | nM | 4.57 |
| CHEMBL1231 | OXYBUTYNIN | IC50 | = | 27400.0 | nM | 4.56 |
| CHEMBL710 | FINASTERIDE | IC50 | = | 28200.0 | nM | 4.55 |
| CHEMBL506 | PRIMAQUINE | IC50 | = | 32700.0 | nM | 4.49 |
| CHEMBL1324 | TOLCAPONE | IC50 | = | 34500.0 | nM | 4.46 |
| CHEMBL255044 | FLUPIRTINE | IC50 | = | 35500.0 | nM | 4.45 |
| CHEMBL2220442 | FLUVASTATIN | IC50 | = | 36100.0 | nM | 4.44 |