Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.45 |
| ▸ | AURKA | O14965 | 7/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 5/20 | 0.45 |
| ▸ | FLT1 | P17948 | 4/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.45 |
| ▸ | PLK4 | O00444 | 1/20 | 0.45 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.45 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.45 |
| ▸ | STK10 | O94804 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | INSR | P06213 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.45 |
| ▸ | YES1 | P07947 | 1/20 | 0.45 |
| ▸ | LYN | P07948 | 1/20 | 0.45 |
| ▸ | RET | P07949 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 1/20 | 0.45 |
| ▸ | ROS1 | P08922 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL378048 | 0.93 | AURKA (0.41) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL377857 | 0.90 | KDR (0.56) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL3097095 | 0.88 | KDR (0.57) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL378235 | 0.87 | KDR (0.47) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL378492 | 0.87 | KDR (0.52) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL378730 | 0.85 | KDR (0.47) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL378442 | 0.85 | AURKA (0.48) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL378698 | 0.85 | KDR (0.53) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL3083212 | 0.84 | KDR (0.54) | KDRAURKAPDGFRBFLT1AURKB | |
| SCHEMBL3085249 | 0.84 | KDR (0.54) | KDRAURKAPDGFRBFLT1AURKB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1784183-B1 | PROCESSES FOR THE PREPARATION OF ISOTHIAZOLE DERIVATIVES | PFIZER (US) | 2012-01-25 | — | — | EP | claimed |
| EP-1545519-B1 | COMBINATION THERAPY FOR HYPERPROLIFERATIVE DISEASES | PFIZER (US) | 2011-03-23 | — | — | EP | claimed |
| EP-1084114-B1 | ISOTHIAZOLE DERIVATIVES USEFUL AS ANTICANCER AGENTS | PFIZER PROD INC (US) | 2004-09-08 | — | — | EP | claimed |