Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 5/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 5/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.32 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.31 |
| ▸ | MERTK | Q12866 | 1/20 | 0.31 |
| ▸ | GAS6 | Q14393 | 1/20 | 0.31 |
| ▸ | PDE5A | O76074 | 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 | |
|---|---|---|---|---|
| SCHEMBL13492727 | 0.92 | PIK3CA (0.35) | MTORPIK3CAGRM5ACACBIRAK4 | |
| SCHEMBL13492722 | 0.89 | IRAK4 (0.35) | MTORPIK3CAGRM5ACACBIRAK4 | |
| SCHEMBL10093999 | 0.88 | IRAK4 (0.44) | MTORPIK3CAIRAK4 | |
| SCHEMBL13492717 | 0.85 | ACACB (0.34) | ACACB | |
| SCHEMBL13492715 | 0.84 | ACACB (0.35) | MTORPIK3CAACACBIRAK4 | |
| SCHEMBL13492703 | 0.83 | ACACB (0.34) | MTORPIK3CAACACB | |
| SCHEMBL10094003 | 0.82 | IRAK4 (0.43) | IRAK4 | |
| SCHEMBL13492784 | 0.80 | ACACB (0.34) | MTORPIK3CAACACBIRAK4FLT3 | |
| SCHEMBL13492770 | 0.80 | IRAK4 (0.30) | IRAK4 | |
| SCHEMBL10093997 | 0.80 | IRAK4 (0.44) | IRAK4 |
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-2010022125-A1 | ETHYNYL-SUBSTITUTED PYRIDINE AND PYRIMIDINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS | SCHERING CORPORATION (US) | 2010-02-25 | — | — | WO | disclosed |