Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.43 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 9/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12825027 | 0.89 | SMO (0.43) | SMOEPHX2IRAK4MAPTHTT | |
| SCHEMBL12825060 | 0.88 | SMO (0.43) | SMOEPHX2MAPT | |
| SCHEMBL12824722 | 0.86 | SMO (0.43) | SMOEPHX2IRAK4 | |
| SCHEMBL10004003 | 0.86 | SMO (0.50) | SMOCCR8EPHX2IRAK4MGAT2 | |
| SCHEMBL12824727 | 0.86 | SMO (0.45) | SMOCCR8EPHX2IRAK4MAPT | |
| SCHEMBL12825061 | 0.85 | SMO (0.46) | SMOEPHX2 | |
| SCHEMBL12824599 | 0.84 | SMO (0.40) | SMOEPHX2IRAK4 | |
| SCHEMBL12824860 | 0.83 | CYP2D6 (0.42) | SMOCCR8MAPT | |
| SCHEMBL12825025 | 0.82 | SMO (0.48) | SMOCCR8EPHX2IRAK4 | |
| SCHEMBL12825023 | 0.82 | SMO (0.42) | SMOEPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011024869-A1 | FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF | 武田薬品工業株式会社 (JP) | 2011-03-03 | — | — | WO | disclosed |