Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 12/20 | 0.39 |
| ▸ | ADK | P55263 | 6/20 | 0.38 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | YES1 | P07947 | 1/20 | 0.35 |
| ▸ | LYN | P07948 | 1/20 | 0.35 |
| ▸ | HCK | P08631 | 1/20 | 0.35 |
| ▸ | FGR | P09769 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | TEC | P42680 | 1/20 | 0.35 |
| ▸ | TXK | P42681 | 1/20 | 0.35 |
| ▸ | BLK | P51451 | 1/20 | 0.35 |
| ▸ | BMX | P51813 | 1/20 | 0.35 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29064399 | 1.00 | BTK (0.39) | BTKADKSLC29A1FGFR1FGFR4 | |
| SCHEMBL29064455 | 0.87 | BTK (0.47) | BTKFGFR1FGFR4LCKFYN | |
| SCHEMBL28097476 | 0.87 | BTK (0.47) | BTKFGFR1FGFR4LCKFYN | |
| SCHEMBL15564132 | 0.87 | BTK (0.47) | BTKFGFR1FGFR4LCKFYN | |
| SCHEMBL13857901 | 0.85 | IL1B (0.43) | BTKADKFGFR1FGFR4 | |
| SCHEMBL18925739 | 0.85 | IL1B (0.43) | BTKADKFGFR1FGFR4 | |
| SCHEMBL29588723 | 0.85 | IL1B (0.43) | BTKADKFGFR1FGFR4 | |
| SCHEMBL13857900 | 0.85 | IL1B (0.43) | BTKADKFGFR1FGFR4 | |
| SCHEMBL28097469 | 0.80 | BTK (0.39) | BTKLCKEGFRJAK3ITK | |
| SCHEMBL17749198 | 0.76 | ADK (0.42) | ADKSLC29A1ACACBSRC |
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-116514806-A | Biological inhibitor containing acrylketone, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-08-01 | — | — | CN | disclosed |