Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | F11 | P03951 | 3/20 | 0.37 |
| ▸ | F2 | P00734 | 2/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 6/20 | 0.35 |
| ▸ | LPL | P06858 | 5/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.33 |
| ▸ | P4HB | P07237 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 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 | |
|---|---|---|---|---|
| SCHEMBL2558324 | 0.87 | ROCK1 (0.43) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL15092603 | 0.85 | BACE1 (0.45) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL2550630 | 0.78 | BACE1 (0.47) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL17423909 | 0.78 | ROCK1 (0.45) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL59978 | 0.75 | ROCK1 (0.42) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL2550196 | 0.74 | ROCK1 (0.42) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL30057793 | 0.73 | ROCK1 (0.43) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL16858754 | 0.73 | BACE1 (0.47) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL2559186 | 0.72 | ROCK1 (0.41) | ROCK1F11F2PRSS1PRSS2 | |
| SCHEMBL13718426 | 0.72 | LPL (0.49) | ROCK1F11LIPGLPLBACE1 |
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-2552206-A1 | TRYCYCLIC COMPOUNDS AND PBK INHIBITORS CONTAINING THE SAME | OncoTherapy Science, Inc. (JP) | 2013-02-06 | — | — | EP | disclosed |
| WO-2011123419-A1 | TRYCYCLIC COMPOUNDS AND PBK INHIBITORS CONTAINING THE SAME | ONCOTHERAPY SCIENCE, INC. (JP) | 2011-10-06 | — | — | WO | disclosed |