Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROS1 | P08922 | 10/20 | 0.49 |
| ▸ | ALK | Q9UM73 | 7/20 | 0.43 |
| ▸ | MET | P08581 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 8/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | FRK | P42685 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.32 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3918438 | 0.91 | ROS1 (0.60) | ROS1ALKMETBRAF | |
| SCHEMBL3911878 | 0.90 | ROS1 (0.49) | ROS1ALKMETBRAFPTGS2 | |
| SCHEMBL3911904 | 0.87 | ROS1 (0.45) | ROS1ALKMETBRAFMAPK14 | |
| SCHEMBL3909956 | 0.86 | ROS1 (0.41) | ROS1ALKMETBRAFMAPK14 | |
| SCHEMBL3909796 | 0.84 | ROS1 (0.45) | ROS1ALKMETBRAF | |
| SCHEMBL1557302 | 0.84 | ROS1 (0.49) | ROS1ALKMETBRAF | |
| SCHEMBL14414507 | 0.83 | ROS1 (0.49) | ROS1ALKMETBRAFMAPK14 | |
| SCHEMBL3908117 | 0.82 | ROS1 (0.50) | ROS1ALKMETBRAF | |
| SCHEMBL3912171 | 0.81 | ROS1 (0.37) | ROS1ALKBRAFMAPK14MAPK9 | |
| SCHEMBL3912514 | 0.80 | ROS1 (0.55) | ROS1ALKMETBRAFMAPK14 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2024353-A2 | PYRAZOLE COMPOUNDS | Pfizer Products Inc. (US) | 2009-02-18 | — | — | EP | disclosed |
| WO-2007105058-A2 | PYRAZOLE COMPOUNDS | PFIZER PRODUCTS INC. (US) | 2007-09-20 | — | — | WO | disclosed |
| WO-2007105058-A2 | PYRAZOLE COMPOUNDS | PFIZER PRODUCTS INC. (US) | 2007-09-20 | — | — | WO | disclosed |