Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 20/20 | 0.64 |
| ▸ | AURKB | Q96GD4 | 15/20 | 0.64 |
| ▸ | AURKA | O14965 | 12/20 | 0.64 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.53 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL16966484 | 0.94 | PDPK1 (0.57) | PDPK1AURKBAURKAROCK1TGFBR1 | |
| SCHEMBL16966492 | 0.87 | PDPK1 (0.49) | PDPK1AURKBAURKAROCK1TGFBR1 | |
| SCHEMBL3127215 | 0.85 | PDPK1 (0.79) | PDPK1AURKBAURKAROCK1TGFBR1 | |
| SCHEMBL1320327 | 0.84 | PDPK1 (0.66) | PDPK1AURKBAURKAROCK1TGFBR1 | |
| SCHEMBL16966458 | 0.81 | PDPK1 (0.79) | PDPK1AURKBAURKAROCK1TGFBR1 | |
| SCHEMBL1320323 | 0.81 | PDPK1 (0.65) | PDPK1AURKBAURKAROCK1TGFBR1 | |
| SCHEMBL1318883 | 0.80 | PDPK1 (0.58) | PDPK1AURKBAURKAROCK1TGFBR1 | |
| SCHEMBL16966472 | 0.79 | KDM1A (0.41) | PDPK1AURKBAURKA | |
| SCHEMBL1317770 | 0.79 | PDPK1 (0.74) | PDPK1AURKBAURKAROCK1 | |
| SCHEMBL16966470 | 0.79 | PDPK1 (0.68) | PDPK1AURKBAURKAROCK1TGFBR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2362775-B1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2015-08-05 | — | — | EP | claimed |
| WO-2010059658-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-05-27 | — | — | WO | claimed |
| EP-2362775-B1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2015-08-05 | — | — | EP | disclosed |
| WO-2010059658-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-05-27 | — | — | WO | disclosed |