Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 7/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 3/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.41 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 8/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 8/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2446206 | 1.00 | MTOR (0.45) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL1317359 | 1.00 | MTOR (0.45) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL1317985 | 0.92 | MTOR (0.45) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL12122776 | 0.88 | PDPK1 (0.43) | MTORPDPK1ROCK1AURKBAURKA | |
| SCHEMBL1317478 | 0.87 | MTOR (0.41) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL1317751 | 0.85 | PDPK1 (0.41) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL1317660 | 0.84 | PDPK1 (0.51) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL1326032 | 0.84 | PDPK1 (0.51) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL1318413 | 0.83 | PDPK1 (0.45) | MTORKDM1APDPK1ROCK1AURKB | |
| SCHEMBL1316976 | 0.83 | PDPK1 (0.42) | MTORKDM1APDPK1ROCK1AURKB |
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 |