Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.49 |
| ▸ | NR1H2 | P55055 | 9/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 6/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL462071 | 0.89 | RIPK1 (0.49) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL448615 | 0.88 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL430769 | 0.88 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL433245 | 0.88 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL448616 | 0.88 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL29429632 | 0.88 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL433225 | 0.86 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL430761 | 0.86 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL10280117 | 0.86 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 | |
| SCHEMBL29744513 | 0.86 | RIPK1 (0.51) | RIPK1NR1H2NR1H3PDE5AJAK2 |
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-2012034095-A1 | COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS | IRM LLC (BM) | 2012-03-15 | — | — | WO | disclosed |