Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 4/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.37 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.37 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | WEE1 | P30291 | 1/20 | 0.37 |
| ▸ | ULK1 | O75385 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23978627 | 1.00 | MAP3K5 (0.44) | MAP3K5AURKAHDAC3HDAC1HDAC2 | |
| SCHEMBL23978706 | 0.87 | MAP3K5 (0.45) | MAP3K5FGFR1FGFR2FGFR4FGFR3 | |
| SCHEMBL23979058 | 0.79 | ITGB1 (0.39) | MAP3K5 | |
| SCHEMBL23978646 | 0.75 | INSR (0.36) | MAP3K5FGFR1FGFR2FGFR4FGFR3 | |
| SCHEMBL23978630 | 0.73 | FGFR1 (0.34) | MAP3K5FGFR1FGFR2FGFR4FGFR3 | |
| SCHEMBL6467426 | 0.71 | MAP3K5 (0.54) | MAP3K5AURKAJAK2AURKBFGFR1 | |
| SCHEMBL30336865 | 0.71 | FGFR4 (0.36) | AURKAHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL23978659 | 0.71 | FGFR4 (0.36) | AURKAHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL167891 | 0.68 | MAP3K5 (0.60) | MAP3K5AURKAJAK2AURKBFGFR1 | |
| SCHEMBL31381352 | 0.68 | MAP3K5 (0.60) | MAP3K5AURKAJAK2AURKBFGFR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115916176-A | Inhibitors of alpha 2 beta 1 integrin and methods of use thereof | 加利福尼亚大学董事会 | 2023-04-04 | — | — | CN | disclosed |