Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 13/20 | 0.68 |
| ▸ | AURKA | O14965 | 4/20 | 0.62 |
| ▸ | SCD | O00767 | 2/20 | 0.52 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.52 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.51 |
| ▸ | GSK3B | P49841 | 2/20 | 0.51 |
| ▸ | WNT1 | P04628 | 1/20 | 0.49 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.49 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.49 |
| ▸ | CLK2 | P49760 | 1/20 | 0.48 |
| ▸ | CLK3 | P49761 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL16163239 | 0.88 | ITK (0.88) | ITKAURKASCDSCD5DYRK1A | |
| SCHEMBL14712479 | 0.86 | ITK (0.62) | ITKAURKASCDSCD5DYRK1A | |
| SCHEMBL14712581 | 0.85 | ITK (0.66) | ITKAURKADYRK1AGSK3BWNT1 | |
| SCHEMBL14712429 | 0.83 | ITK (0.64) | ITKAURKADYRK1AWNT1 | |
| SCHEMBL14712570 | 0.83 | ITK (0.77) | ITKAURKASCDSCD5 | |
| SCHEMBL14712515 | 0.83 | ITK (0.59) | ITKAURKA | |
| SCHEMBL14712559 | 0.83 | ITK (0.59) | ITKAURKASCDSCD5 | |
| SCHEMBL14712518 | 0.82 | ITK (0.63) | ITKAURKADYRK1AWNT1HCRTR1 | |
| SCHEMBL14712407 | 0.81 | ITK (0.61) | ITKAURKASCDSCD5HCRTR1 | |
| SCHEMBL14712402 | 0.81 | ITK (0.57) | ITKAURKASCDSCD5DYRK1A |
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-2013024011-A1 | INDAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2013-02-21 | — | — | WO | disclosed |