Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 18/20 | 0.49 |
| ▸ | ITK | Q08881 | 1/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4585902 | 0.87 | KDR (0.45) | KDRITKNSD2 | |
| SCHEMBL4594038 | 0.84 | KDR (0.48) | KDR | |
| SCHEMBL4593764 | 0.83 | KDR (0.42) | KDRITK | |
| SCHEMBL4586348 | 0.82 | KDR (0.47) | KDR | |
| SCHEMBL4593037 | 0.81 | KDR (0.41) | KDRITK | |
| SCHEMBL4593040 | 0.81 | KDR (0.41) | KDRITK | |
| SCHEMBL4585514 | 0.81 | KDR (0.46) | KDR | |
| SCHEMBL4593852 | 0.79 | KDR (0.43) | KDR | |
| SCHEMBL4594092 | 0.77 | NSD2 (0.49) | KDRNSD2 | |
| SCHEMBL7003815 | 0.77 | KDR (0.55) | KDR |
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-1558609-A4 | KINASE INHIBITORS | MERCK & CO INC (US) | 2008-05-28 | — | — | EP | disclosed |
| EP-1558609-A2 | KINASE INHIBITORS | Merck & Co., Inc. (US) | 2005-08-03 | — | — | EP | disclosed |
| WO-2004041164-A2 | KINASE INHIBITORS | MERCK & CO., INC. (US) | 2004-05-21 | — | — | WO | disclosed |