Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.32 |
| ▸ | IRAK1 | P51617 | 2/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.30 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20632281 | 0.90 | CHRM4 (0.35) | ROCK2ROCK1CDC42BPBGSK3BABL1 | |
| SCHEMBL20633316 | 0.90 | OPRK1 (0.35) | MTOREGFRGSK3BCHRM4FAAH | |
| SCHEMBL17618760 | 0.90 | FAAH (0.35) | IRAK4IRAK1EGFRMAPTGSK3B | |
| SCHEMBL17618526 | 0.85 | FAAH (0.35) | IRAK4IRAK1MAPTGSK3BABL1 | |
| SCHEMBL20631665 | 0.83 | SLC9A1 (0.35) | EGFRGRM5FAAHHCRTR2CDK5 | |
| SCHEMBL20632826 | 0.81 | FAAH (0.33) | ROCK2ROCK1FAAHCDK5CDK5R1 | |
| SCHEMBL20632133 | 0.79 | MPL (0.35) | MTORGSK3BFAAHCDK5CDK5R1 | |
| SCHEMBL20632299 | 0.79 | GSK3B (0.35) | ROCK2ROCK1CDC42BPBGSK3BABL1 | |
| SCHEMBL20633048 | 0.79 | PRMT5 (0.39) | MTOREGFRGSK3BGRM5HCRTR2 | |
| SCHEMBL16776288 | 0.79 | CHRM4 (0.39) | GSK3BABL1CHRM4FAAHAKT1 |
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-2997029-B1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2019-01-09 | — | — | EP | disclosed |