Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 13/20 | 1.00 |
| ▸ | EGFR | P00533 | 7/20 | 0.65 |
| ▸ | INSR | P06213 | 4/20 | 0.65 |
| ▸ | IGF1R | P08069 | 3/20 | 0.65 |
| ▸ | AURKA | O14965 | 1/20 | 0.65 |
| ▸ | ROS1 | P08922 | 1/20 | 0.65 |
| ▸ | EML4 | Q9HC35 | 1/20 | 0.65 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.56 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28508962 | 0.87 | ALK (0.80) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL21846979 | 0.81 | EGFR (0.78) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL28033932 | 0.81 | ALK (0.77) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL3767425 | 0.81 | ALK (0.68) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL3718097 | 0.80 | ALK (0.68) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL21709647 | 0.79 | ALK (0.87) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL26611528 | 0.79 | EGFR (0.79) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL20398846 | 0.79 | ALK (0.75) | ALKEGFRINSRIGF1R | |
| SCHEMBL16371266 | 0.79 | ALK (0.87) | ALKEGFRINSRIGF1RAURKA | |
| SCHEMBL3762586 | 0.79 | ALK (0.68) | ALKEGFRINSRIGF1RAURKA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108341835-B | Boron-containing compounds as tyrosine kinase inhibitors | 正大天晴药业集团股份有限公司 | 2021-01-15 | — | — | CN | disclosed |