Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 17/20 | 0.67 |
| ▸ | AURKB | Q96GD4 | 16/20 | 0.67 |
| ▸ | ROCK1 | Q13464 | 10/20 | 0.67 |
| ▸ | AURKA | O14965 | 11/20 | 0.55 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.55 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.50 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.34 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL1319103 | 0.81 | PDPK1 (0.86) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL12118796 | 0.79 | PDPK1 (0.76) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL1318232 | 0.74 | PDPK1 (0.62) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL1318451 | 0.71 | PDPK1 (1.00) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL1320752 | 0.71 | PDPK1 (0.68) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL1318996 | 0.70 | PDPK1 (0.80) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL12122780 | 0.69 | PDPK1 (0.71) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL1317861 | 0.68 | PDPK1 (0.86) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL1318926 | 0.68 | PDPK1 (0.60) | PDPK1AURKBROCK1AURKATGFBR1 | |
| SCHEMBL13354830 | 0.67 | PDPK1 (0.57) | PDPK1AURKBROCK1AURKATGFBR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2362775-A1 | CHEMICAL COMPOUNDS | GlaxoSmithKline LLC (US) | 2011-09-07 | — | — | EP | disclosed |
| WO-2010059658-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-05-27 | — | — | WO | disclosed |