Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 2/20 | 0.58 |
| ▸ | RORC | P51449 | 2/20 | 0.42 |
| ▸ | DHODH | Q02127 | 2/20 | 0.42 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | BTK | Q06187 | 8/20 | 0.38 |
| ▸ | HCK | P08631 | 7/20 | 0.38 |
| ▸ | MLNR | O43193 | 4/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | GHSR | Q92847 | 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 | |
|---|---|---|---|---|
| SCHEMBL807743 | 0.92 | ITK (0.57) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL808081 | 0.90 | ITK (0.54) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL808093 | 0.88 | ITK (0.61) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL807803 | 0.88 | ITK (0.58) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL10285825 | 0.86 | ITK (0.58) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL2395616 | 0.84 | ITK (0.56) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL808096 | 0.83 | ITK (0.51) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL807540 | 0.81 | ITK (0.46) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL22374670 | 0.80 | ITK (0.71) | ITKRORCDHODHSSTR5LCK | |
| SCHEMBL807926 | 0.78 | ITK (0.59) | ITKRORCDHODHSSTR5LCK |
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-2012035055-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-22 | — | — | WO | disclosed |