Assay Detail
ADMET
CHEMBL5377828
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of recombinant CYP1B1 (unknown origin) using 7-ethoxyresorufin as substrate preincubated for 5 mins followed by NADPH addition incubated for 35 mins by EROD assay
14
Total Activities
14
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
Design and Synthesis of Novel Near-Infrared Fluorescence Probes Based on an Open Conformation of a Cytochrome P450 1B1 Complex for Molecular Imaging of Colorectal Tumors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 14 | 8.02 | 9.17 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5422312 | — | — | 1 | 9.17 |
| CHEMBL5405256 | — | — | 1 | 8.84 |
| CHEMBL5400922 | — | — | 1 | 8.69 |
| CHEMBL5412492 | — | — | 1 | 8.61 |
| CHEMBL5421843 | — | — | 1 | 8.47 |
| CHEMBL5429019 | — | — | 1 | 8.35 |
| CHEMBL283196 | ALPHA-NAPHTHOFLAVONE | — | 1 | 8.30 |
| CHEMBL5426998 | — | — | 1 | 7.95 |
| CHEMBL5435493 | — | — | 1 | 7.75 |
| CHEMBL5418796 | — | — | 1 | 7.59 |
| CHEMBL5396845 | — | — | 1 | 7.54 |
| CHEMBL5426732 | — | — | 1 | 7.09 |
| CHEMBL5404201 | — | — | 1 | 7.02 |
| CHEMBL5411203 | — | — | 1 | 6.95 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5422312 | — | IC50 | = | 0.67 | nM | 9.17 |
| CHEMBL5405256 | — | IC50 | = | 1.44 | nM | 8.84 |
| CHEMBL5400922 | — | IC50 | = | 2.03 | nM | 8.69 |
| CHEMBL5412492 | — | IC50 | = | 2.47 | nM | 8.61 |
| CHEMBL5421843 | — | IC50 | = | 3.37 | nM | 8.47 |
| CHEMBL5429019 | — | IC50 | = | 4.43 | nM | 8.35 |
| CHEMBL283196 | ALPHA-NAPHTHOFLAVONE | IC50 | = | 4.97 | nM | 8.30 |
| CHEMBL5426998 | — | IC50 | = | 11.31 | nM | 7.95 |
| CHEMBL5435493 | — | IC50 | = | 17.93 | nM | 7.75 |
| CHEMBL5418796 | — | IC50 | = | 25.88 | nM | 7.59 |
| CHEMBL5396845 | — | IC50 | = | 28.73 | nM | 7.54 |
| CHEMBL5426732 | — | IC50 | = | 81.67 | nM | 7.09 |
| CHEMBL5404201 | — | IC50 | = | 95.05 | nM | 7.02 |
| CHEMBL5411203 | — | IC50 | = | 112.63 | nM | 6.95 |