Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 20/20 | 0.68 |
| ▸ | JAK2 | O60674 | 14/20 | 0.68 |
| ▸ | ROS1 | P08922 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL462121 | 0.94 | NTRK1 (0.72) | NTRK1JAK2ROS1 | |
| SCHEMBL469694 | 0.94 | NTRK1 (0.72) | NTRK1JAK2ROS1 | |
| SCHEMBL12468052 | 0.91 | NTRK1 (0.75) | NTRK1JAK2ROS1 | |
| SCHEMBL12468051 | 0.91 | NTRK1 (0.75) | NTRK1JAK2ROS1 | |
| SCHEMBL462649 | 0.85 | NTRK1 (0.76) | NTRK1JAK2 | |
| SCHEMBL462648 | 0.85 | NTRK1 (0.76) | NTRK1JAK2 | |
| SCHEMBL461582 | 0.85 | NTRK1 (0.78) | NTRK1JAK2ROS1 | |
| SCHEMBL461581 | 0.85 | NTRK1 (0.78) | NTRK1JAK2ROS1 | |
| SCHEMBL462972 | 0.84 | NTRK1 (0.79) | NTRK1JAK2 | |
| SCHEMBL462365 | 0.84 | NTRK1 (0.76) | NTRK1JAK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012034095-A1 | COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS | IRM LLC (BM) | 2012-03-15 | — | — | WO | claimed |
| WO-2012034095-A1 | COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS | IRM LLC (BM) | 2012-03-15 | — | — | WO | disclosed |
| WO-2012034095-A1 | COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS | IRM LLC (BM) | 2012-03-15 | — | — | WO | disclosed |