Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.37 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.37 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.37 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.36 |
| ▸ | ABL1 | P00519 | 4/20 | 0.36 |
| ▸ | S100B | P04271 | 1/20 | 0.36 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4676304 | 0.82 | CDK1 (0.39) | CDK1CDK2SMPD3CHUKABL1 | |
| Hydrochloric Acid SCHEMBL5373380 | 0.81 | CDK1 (0.38) | CDK1CDK2SMPD3CHUKABL1 | |
| SCHEMBL4674357 | 0.80 | SMPD3 (0.45) | CDK2SMPD3SMARCA2SMARCA4PBRM1 | |
| SCHEMBL4676761 | 0.73 | OPRK1 (0.42) | CDK1CDK2SMPD3SMARCA2SMARCA4 | |
| SCHEMBL13807237 | 0.72 | CDK1 (0.48) | CDK1CDK2SMPD3CHUKABL1 | |
| SCHEMBL17512592 | 0.71 | ABL1 (0.41) | CDK1CDK2CHUKABL1AOC3 | |
| SCHEMBL17512518 | 0.71 | ABL1 (0.41) | CDK1CDK2CHUKABL1AOC3 | |
| SCHEMBL17512521 | 0.71 | ABL1 (0.41) | CDK1CDK2CHUKABL1AOC3 | |
| SCHEMBL27517766 | 0.71 | GRIN2D (0.49) | CDK1CDK2KDM4E | |
| SCHEMBL2416270 | 0.70 | SMPD3 (0.47) | CDK2SMPD3SMARCA2SMARCA4PBRM1 |
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-1312606-B1 | 2,5-diaminopyridine oxidation bases and their use for dyeing of keratin fibres | OREAL (FR) | 2011-09-21 | — | — | EP | claimed |