Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 20/20 | 0.57 |
| ▸ | JAK2 | O60674 | 12/20 | 0.57 |
| ▸ | ROS1 | P08922 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL460710 | 1.00 | NTRK1 (0.57) | NTRK1JAK2ROS1 | |
| SCHEMBL462859 | 0.84 | NTRK1 (0.54) | NTRK1JAK2ROS1 | |
| SCHEMBL2238950 | 0.81 | NTRK1 (0.66) | NTRK1JAK2ROS1 | |
| SCHEMBL2238956 | 0.81 | NTRK1 (0.66) | NTRK1JAK2ROS1 | |
| SCHEMBL461004 | 0.81 | NTRK1 (0.66) | NTRK1JAK2ROS1 | |
| SCHEMBL461003 | 0.81 | NTRK1 (0.66) | NTRK1JAK2ROS1 | |
| SCHEMBL460918 | 0.80 | NTRK1 (0.62) | NTRK1JAK2 | |
| SCHEMBL460919 | 0.80 | NTRK1 (0.62) | NTRK1JAK2 | |
| SCHEMBL461582 | 0.79 | NTRK1 (0.78) | NTRK1JAK2ROS1 | |
| SCHEMBL461581 | 0.79 | NTRK1 (0.78) | NTRK1JAK2ROS1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |