Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 11/20 | 0.69 |
| ▸ | JAK2 | O60674 | 2/20 | 0.69 |
| ▸ | BLK | P51451 | 2/20 | 0.69 |
| ▸ | BMX | P51813 | 2/20 | 0.69 |
| ▸ | JAK3 | P52333 | 2/20 | 0.69 |
| ▸ | CTSC | P53634 | 3/20 | 0.65 |
| ▸ | MAP3K7 | O43318 | 3/20 | 0.58 |
| ▸ | MAP2K1 | Q02750 | 3/20 | 0.58 |
| ▸ | FLT3 | P36888 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | NUAK1 | O60285 | 2/20 | 0.55 |
| ▸ | NUAK2 | Q9H093 | 2/20 | 0.55 |
| ▸ | PLK4 | O00444 | 1/20 | 0.55 |
| ▸ | GAK | O14976 | 1/20 | 0.55 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.55 |
| ▸ | BTK | Q06187 | 1/20 | 0.55 |
| ▸ | ITK | Q08881 | 1/20 | 0.55 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.55 |
| ▸ | DCLK3 | Q9C098 | 1/20 | 0.55 |
| ▸ | EML4 | Q9HC35 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL19970912 | 0.90 | EGFR (0.68) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL15453488 | 0.83 | EGFR (0.70) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL93524 | 0.82 | MAP3K7 (0.57) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL93510 | 0.82 | EGFR (1.00) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL30854720 | 0.82 | EGFR (1.00) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL29351880 | 0.82 | EGFR (1.00) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL10127917 | 0.80 | CTSC (0.71) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL10127853 | 0.79 | EGFR (0.81) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL16513550 | 0.79 | BRD4 (0.53) | EGFRJAK2BLKBMXJAK3 | |
| SCHEMBL1706135 | 0.77 | EGFR (0.72) | EGFRJAK2BLKBMXJAK3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2425830-A1 | Synergistic drug combination for the treatment of cancer | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2012-03-07 | — | — | EP | disclosed |