Assay Detail
Binding
CHEMBL769140
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Inhibitory activity tested against protein kinase HER-2
46
Total Activities
46
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Expert |
Target
Receptor tyrosine-protein kinase erbB-2 (CHEMBL1824) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Receptor-guided alignment-based comparative 3D-QSAR studies of benzylidene malonitrile tyrphostins as EGFR and HER-2 kinase inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 46 | 5.19 | 6.89 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL116595 | — | — | 1 | 6.89 |
| CHEMBL326100 | — | — | 1 | 6.60 |
| CHEMBL118109 | — | — | 1 | 6.46 |
| CHEMBL119987 | — | — | 1 | 6.35 |
| CHEMBL119156 | — | — | 1 | 6.15 |
| CHEMBL140213 | — | — | 1 | 6.00 |
| CHEMBL432428 | — | — | 1 | 5.99 |
| CHEMBL118205 | — | — | 1 | 5.82 |
| CHEMBL333454 | — | — | 1 | 5.78 |
| CHEMBL141175 | — | — | 1 | 5.70 |
| CHEMBL122522 | — | — | 1 | 5.60 |
| CHEMBL143805 | — | — | 1 | 5.54 |
| CHEMBL56879 | — | — | 1 | 5.52 |
| CHEMBL115895 | — | — | 1 | 5.48 |
| CHEMBL1161236 | — | — | 1 | 5.34 |
| CHEMBL143212 | — | — | 1 | 5.34 |
| CHEMBL56542 | — | — | 1 | 5.31 |
| CHEMBL331026 | — | — | 1 | 5.21 |
| CHEMBL296407 | — | — | 1 | 5.19 |
| CHEMBL324030 | — | — | 1 | 5.06 |
| CHEMBL54471 | — | — | 1 | 5.00 |
| CHEMBL118321 | — | — | 1 | 5.00 |
| CHEMBL326318 | — | — | 1 | 5.00 |
| CHEMBL59145 | — | — | 1 | 4.92 |
| CHEMBL55204 | — | — | 1 | 4.89 |
| CHEMBL56543 | — | — | 1 | 4.87 |
| CHEMBL115519 | — | — | 1 | 4.82 |
| CHEMBL1161234 | — | — | 1 | 4.80 |
| CHEMBL56393 | — | — | 1 | 4.77 |
| CHEMBL417941 | — | — | 1 | 4.77 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL116595 | — | IC50 | = | 128.82 | nM | 6.89 |
| CHEMBL326100 | — | IC50 | = | 251.19 | nM | 6.60 |
| CHEMBL118109 | — | IC50 | = | 346.74 | nM | 6.46 |
| CHEMBL119987 | — | IC50 | = | 446.68 | nM | 6.35 |
| CHEMBL119156 | — | IC50 | = | 707.95 | nM | 6.15 |
| CHEMBL140213 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL432428 | — | IC50 | = | 1023.29 | nM | 5.99 |
| CHEMBL118205 | — | IC50 | = | 1513.56 | nM | 5.82 |
| CHEMBL333454 | — | IC50 | = | 1659.59 | nM | 5.78 |
| CHEMBL141175 | — | IC50 | = | 1995.26 | nM | 5.70 |
| CHEMBL122522 | — | IC50 | = | 2511.89 | nM | 5.60 |
| CHEMBL143805 | — | IC50 | = | 2884.03 | nM | 5.54 |
| CHEMBL56879 | — | IC50 | = | 3019.95 | nM | 5.52 |
| CHEMBL115895 | — | IC50 | = | 3311.31 | nM | 5.48 |
| CHEMBL143212 | — | IC50 | = | 4570.88 | nM | 5.34 |
| CHEMBL1161236 | — | IC50 | = | 4570.88 | nM | 5.34 |
| CHEMBL56542 | — | IC50 | = | 4897.79 | nM | 5.31 |
| CHEMBL331026 | — | IC50 | = | 6165.95 | nM | 5.21 |
| CHEMBL296407 | — | IC50 | = | 6456.54 | nM | 5.19 |
| CHEMBL324030 | — | IC50 | = | 8709.64 | nM | 5.06 |
| CHEMBL54471 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL118321 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL326318 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL59145 | — | IC50 | = | 12022.64 | nM | 4.92 |
| CHEMBL55204 | — | IC50 | = | 12882.5 | nM | 4.89 |
| CHEMBL56543 | — | IC50 | = | 13489.63 | nM | 4.87 |
| CHEMBL115519 | — | IC50 | = | 15135.61 | nM | 4.82 |
| CHEMBL1161234 | — | IC50 | = | 15848.93 | nM | 4.80 |
| CHEMBL56393 | — | IC50 | = | 16982.44 | nM | 4.77 |
| CHEMBL417941 | — | IC50 | = | 16982.44 | nM | 4.77 |
| CHEMBL334032 | — | IC50 | = | 17378.01 | nM | 4.76 |
| CHEMBL56132 | — | IC50 | = | 18197.01 | nM | 4.74 |
| CHEMBL141238 | — | IC50 | = | 20892.96 | nM | 4.68 |
| CHEMBL293749 | — | IC50 | = | 22908.68 | nM | 4.64 |
| CHEMBL55360 | — | IC50 | = | 33884.42 | nM | 4.47 |
| CHEMBL55994 | — | IC50 | = | 34673.69 | nM | 4.46 |
| CHEMBL53898 | — | IC50 | = | 34673.69 | nM | 4.46 |
| CHEMBL55979 | — | IC50 | = | 37153.52 | nM | 4.43 |
| CHEMBL56731 | — | IC50 | = | 41686.94 | nM | 4.38 |
| CHEMBL55993 | — | IC50 | = | 50118.72 | nM | 4.30 |
| CHEMBL56219 | — | IC50 | = | 57543.99 | nM | 4.24 |
| CHEMBL116423 | — | IC50 | = | 58884.37 | nM | 4.23 |
| CHEMBL440298 | — | IC50 | = | 501187.23 | nM | - |
| CHEMBL56319 | — | IC50 | = | 331131.12 | nM | - |
| CHEMBL57251 | — | IC50 | = | 165958.69 | nM | - |
| CHEMBL120564 | — | IC50 | = | 112201.85 | nM | - |