Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 6/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.39 |
| ▸ | MERTK | Q12866 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.38 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4231771 | 0.94 | ROCK2 (0.45) | TLR7TLR9TLR8ROCK2AXL | |
| SCHEMBL4212333 | 0.87 | ROCK2 (0.40) | TLR7TLR9TLR8ROCK2AXL | |
| SCHEMBL4230382 | 0.83 | PIK3CA (0.46) | TLR7TLR9TLR8 | |
| SCHEMBL4212335 | 0.83 | AXL (0.40) | TLR7TLR9TLR8ROCK2HCRTR1 | |
| SCHEMBL4223229 | 0.82 | GAA (0.48) | TLR7TLR9TLR8KDM4EHSD17B10 | |
| SCHEMBL4048549 | 0.80 | KDR (0.47) | TLR7TLR9TLR8ROCK2 | |
| SCHEMBL4219363 | 0.76 | LRRK2 (0.41) | TLR7TLR9TLR8HCRTR1HCRTR2 | |
| SCHEMBL4234405 | 0.73 | ADORA1 (0.51) | TLR7TLR9TLR8ADORA2AADORA2B | |
| SCHEMBL4220286 | 0.72 | ADORA1 (0.52) | TLR7TLR9TLR8ADORA1 | |
| SCHEMBL4049232 | 0.71 | TLR7 (0.52) | TLR7TLR9TLR8MERTKCYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2026811-A1 | PYRAZOLO [3, 4-D]PYRIMIDINE DERIVATIVES USEFUL TO TREAT RESPIRATORY DISORDERS | Novartis AG (CH) | 2009-02-25 | — | — | EP | disclosed |
| WO-2007134828-A1 | PYRAZOLO [3, 4-D] PYRIMIDINE DERIVATIVES USEFUL TO TREAT RESPIRATORY DISORDERS | NOVARTIS AG (CH) | 2007-11-29 | — | — | WO | disclosed |