Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 2/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 4/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5350862 | 0.84 | IRAK4 (0.39) | IRAK4RIPK3CDK9NR3C2GSK3B | |
| SCHEMBL5353510 | 0.75 | MAPK10 (0.39) | IRAK4RIPK3TGFBR1NR3C2 | |
| SCHEMBL5352686 | 0.75 | KCNH2 (0.38) | IRAK4RIPK3CDK9NR3C2 | |
| SCHEMBL5347459 | 0.74 | MAPK14 (0.40) | IRAK4RIPK3 | |
| SCHEMBL1104982 | 0.71 | RIPK3 (0.44) | IRAK4RIPK3CDK9AAK1TGFBR1 | |
| SCHEMBL5350912 | 0.69 | NR3C2 (0.39) | IRAK4RIPK3CDK9NR3C2 | |
| SCHEMBL5350212 | 0.68 | CDK9 (0.40) | IRAK4CDK9TGFBR1 | |
| SCHEMBL5352200 | 0.67 | IRAK4 (0.42) | IRAK4RIPK3CDK9NR3C2PIK3C3 | |
| SCHEMBL15885857 | 0.67 | IRAK4 (0.55) | IRAK4AAK1TGFBR1PIK3C3GSK3B | |
| SCHEMBL29402022 | 0.66 | ATR (0.46) | IRAK4RIPK3CDK9TGFBR1PIK3C3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1553096-B1 | PYRAZOLE COMPOUNDS | UBE INDUSTRIES (JP) | 2012-10-31 | — | — | EP | disclosed |