Assay Detail
ADMET
CHEMBL4257974
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Inhibition of human recombinant CYP1B1 expressed in HEK293 cells using 7-ethoxyresorufin substrate substrate preincubated for 30 mins followed by substrate addition and measured after 60 mins by fluorescence assay relative to control
11
Total Activities
11
Compounds Tested
1
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 |
Publication
Identification of karanjin isolated from the Indian beech tree as a potent CYP1 enzyme inhibitor with cellular efficacy <i>via</i> screening of a natural product repository.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 11 | 5.56 | 6.67 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL44541 | MERIDIANIN C | — | 1 | 6.67 |
| CHEMBL4282750 | — | — | 1 | 6.66 |
| CHEMBL452751 | PHELLOPTERIN | — | 1 | 6.66 |
| CHEMBL226508 | — | — | 1 | 5.60 |
| CHEMBL4285296 | — | — | 1 | 5.22 |
| CHEMBL295316 | PLUMBAGIN | 1.0 | 1 | 5.21 |
| CHEMBL140796 | ISOPIMPINELLIN | — | 1 | 5.20 |
| CHEMBL4294195 | — | — | 1 | 5.11 |
| CHEMBL24171 | BERGAPTEN | 3.0 | 1 | 4.82 |
| CHEMBL44746 | KHELLIN | 2.0 | 1 | 4.46 |
| CHEMBL274056 | NAPHTHAZALIN | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL44541 | MERIDIANIN C | IC50 | = | 213.0 | nM | 6.67 |
| CHEMBL4282750 | — | IC50 | = | 220.0 | nM | 6.66 |
| CHEMBL452751 | PHELLOPTERIN | IC50 | = | 220.0 | nM | 6.66 |
| CHEMBL226508 | — | IC50 | = | 2500.0 | nM | 5.60 |
| CHEMBL4285296 | — | IC50 | = | 6040.0 | nM | 5.22 |
| CHEMBL295316 | PLUMBAGIN | IC50 | = | 6150.0 | nM | 5.21 |
| CHEMBL140796 | ISOPIMPINELLIN | IC50 | = | 6380.0 | nM | 5.20 |
| CHEMBL4294195 | — | IC50 | = | 7700.0 | nM | 5.11 |
| CHEMBL24171 | BERGAPTEN | IC50 | = | 15300.0 | nM | 4.82 |
| CHEMBL44746 | KHELLIN | IC50 | = | 34600.0 | nM | 4.46 |
| CHEMBL274056 | NAPHTHAZALIN | IC50 | > | 10000.0 | nM | - |