Assay Detail
Binding
CHEMBL3389757
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Inhibition of MDR1 (unknown origin) over-expressed in MDCK cells assessed as calcein accumulation incubated for 30 mins prior to Calcein-AM addition measured after 30 mins by fluorescence assay
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Cell Type | MDCK |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
SAR studies on tetrahydroisoquinoline derivatives: the role of flexibility and bioisosterism to raise potency and selectivity toward P-glycoprotein.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 21 | 5.92 | 8.40 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3352986 | — | — | 1 | 8.40 |
| CHEMBL3352989 | — | — | 1 | 7.16 |
| CHEMBL3352988 | — | — | 1 | 6.64 |
| CHEMBL3352979 | — | — | 1 | 6.24 |
| CHEMBL260506 | — | — | 1 | 6.22 |
| CHEMBL3352978 | — | — | 1 | 6.10 |
| CHEMBL3352974 | — | — | 1 | 6.04 |
| CHEMBL3352983 | — | — | 1 | 6.03 |
| CHEMBL3352987 | — | — | 1 | 5.92 |
| CHEMBL3352982 | — | — | 1 | 5.89 |
| CHEMBL260599 | — | — | 1 | 5.82 |
| CHEMBL3352984 | — | — | 1 | 5.75 |
| CHEMBL3352980 | — | — | 1 | 5.70 |
| CHEMBL3352976 | — | — | 1 | 5.37 |
| CHEMBL3352981 | — | — | 1 | 5.31 |
| CHEMBL3352973 | — | — | 1 | 5.24 |
| CHEMBL259582 | — | — | 1 | 5.20 |
| CHEMBL3352975 | — | — | 1 | 5.19 |
| CHEMBL3352977 | — | — | 1 | 5.09 |
| CHEMBL260505 | — | — | 1 | 5.03 |
| CHEMBL3352985 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3352986 | — | EC50 | = | 4.0 | nM | 8.40 |
| CHEMBL3352989 | — | EC50 | = | 69.0 | nM | 7.16 |
| CHEMBL3352988 | — | EC50 | = | 230.0 | nM | 6.64 |
| CHEMBL3352979 | — | EC50 | = | 570.0 | nM | 6.24 |
| CHEMBL260506 | — | EC50 | = | 600.0 | nM | 6.22 |
| CHEMBL3352978 | — | EC50 | = | 800.0 | nM | 6.10 |
| CHEMBL3352974 | — | EC50 | = | 910.0 | nM | 6.04 |
| CHEMBL3352983 | — | EC50 | = | 930.0 | nM | 6.03 |
| CHEMBL3352987 | — | EC50 | = | 1200.0 | nM | 5.92 |
| CHEMBL3352982 | — | EC50 | = | 1300.0 | nM | 5.89 |
| CHEMBL260599 | — | EC50 | = | 1500.0 | nM | 5.82 |
| CHEMBL3352984 | — | EC50 | = | 1800.0 | nM | 5.75 |
| CHEMBL3352980 | — | EC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL3352976 | — | EC50 | = | 4300.0 | nM | 5.37 |
| CHEMBL3352981 | — | EC50 | = | 4900.0 | nM | 5.31 |
| CHEMBL3352973 | — | EC50 | = | 5800.0 | nM | 5.24 |
| CHEMBL259582 | — | EC50 | = | 6350.0 | nM | 5.20 |
| CHEMBL3352975 | — | EC50 | = | 6400.0 | nM | 5.19 |
| CHEMBL3352977 | — | EC50 | = | 8100.0 | nM | 5.09 |
| CHEMBL260505 | — | EC50 | = | 9300.0 | nM | 5.03 |
| CHEMBL3352985 | — | EC50 | - | — | - |