Assay Detail
Binding
CHEMBL675206
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Displacement of [3H]-estradiol (E2) from sheep uterine estrogen receptor
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Ovis aries |
| Confidence | 5 — Multiple protein complex / RNA |
| Curated By | Intermediate |
Publication
Prediction of ligand binding affinity and orientation of xenoestrogens to the estrogen receptor by molecular dynamics simulations and the linear interaction energy method.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 12 | 5.94 | 8.52 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL414213 | — | — | 1 | 8.52 |
| CHEMBL462576 | KEPONE | — | 1 | 6.31 |
| CHEMBL28 | APIGENIN | — | 1 | 6.18 |
| CHEMBL7855 | CHRYSENE-1,2-DIOL | — | 1 | 6.06 |
| CHEMBL8020 | — | — | 1 | 5.96 |
| CHEMBL7970 | — | — | 1 | 5.40 |
| CHEMBL8145 | DAIDZEIN | 2.0 | 1 | 5.23 |
| CHEMBL8328 | — | — | 1 | 4.96 |
| CHEMBL7790 | — | — | 1 | 4.85 |
| CHEMBL275930 | — | — | 1 | - |
| CHEMBL267917 | — | — | 1 | - |
| CHEMBL8166 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL414213 | — | Kd | = | 3.0 | nM | 8.52 |
| CHEMBL462576 | KEPONE | Kd | = | 490.0 | nM | 6.31 |
| CHEMBL28 | APIGENIN | Kd | = | 660.0 | nM | 6.18 |
| CHEMBL7855 | CHRYSENE-1,2-DIOL | Kd | = | 880.0 | nM | 6.06 |
| CHEMBL8020 | — | Kd | = | 1100.0 | nM | 5.96 |
| CHEMBL7970 | — | Kd | = | 4000.0 | nM | 5.40 |
| CHEMBL8145 | DAIDZEIN | Kd | = | 5900.0 | nM | 5.23 |
| CHEMBL8328 | — | Kd | = | 11000.0 | nM | 4.96 |
| CHEMBL7790 | — | Kd | = | 14000.0 | nM | 4.85 |
| CHEMBL275930 | — | Kd | > | 300000.0 | nM | - |
| CHEMBL267917 | — | Kd | = | 160000.0 | nM | - |
| CHEMBL8166 | — | Kd | > | 300000.0 | nM | - |