Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.53 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 3/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.44 |
| ▸ | PLK4 | O00444 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | INSR | P06213 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | MARK3 | P27448 | 1/20 | 0.44 |
| ▸ | FLT4 | P35916 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | CLK2 | P49760 | 1/20 | 0.44 |
| ▸ | GSK3A | P49840 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28712249 | 0.81 | F2 (0.45) | EGLN1KDRMAP4K4MKNK2ALDH1A1 | |
| SCHEMBL29010236 | 0.79 | PARP1 (0.48) | MAPKAPK2EGLN1KDRALDH1A1ATM | |
| SCHEMBL28700571 | 0.78 | MAP4K4 (0.50) | EGLN1MAP4K4ALDH1A1KDM4EMAPT | |
| SCHEMBL28710155 | 0.78 | BCL2L1 (0.46) | EGLN1KDRMAP4K4ALDH1A1KDM4E | |
| SCHEMBL3076935 | 0.78 | KCNH2 (0.39) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL5646211 | 0.76 | MAPKAPK2 (0.51) | MAPKAPK2EGLN1KDRMAP4K4PLK4 | |
| SCHEMBL28705426 | 0.75 | MMP3 (0.44) | EGLN1MAP4K4FLT1HDAC2 | |
| SCHEMBL5990507 | 0.74 | CLK1 (0.51) | MAPKAPK2KDRMAP4K4PLK4AURKA | |
| SCHEMBL182164 | 0.74 | MAPKAPK2 (0.79) | MAPKAPK2EGLN1MAP4K4ALDH1A1KDM4E | |
| SCHEMBL13763422 | 0.73 | GAA (0.47) | MAPKAPK2KDRMAP4K4PLK4AURKA |
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-114057646-A | Pyrazole derivative and application thereof in preparation of antitumor drugs | 常州大学 | 2022-02-18 | — | — | CN | disclosed |