Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 17/20 | 0.45 |
| ▸ | ITK | Q08881 | 1/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL4593764 | 0.94 | KDR (0.42) | KDRITK | |
| SCHEMBL4594057 | 0.87 | KDR (0.49) | KDRITKNSD2 | |
| SCHEMBL4587497 | 0.82 | KDR (0.43) | KDR | |
| SCHEMBL4593037 | 0.81 | KDR (0.41) | KDRITK | |
| SCHEMBL4593040 | 0.81 | KDR (0.41) | KDRITK | |
| SCHEMBL4594092 | 0.77 | NSD2 (0.49) | KDRNSD2 | |
| SCHEMBL7003815 | 0.77 | KDR (0.55) | KDR | |
| SCHEMBL4592543 | 0.76 | KDR (0.60) | KDR | |
| SCHEMBL4594715 | 0.76 | KDR (0.43) | KDR | |
| SCHEMBL4594178 | 0.75 | KDR (0.52) | 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 |