Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.31 |
| ▸ | TERT | O14746 | 1/20 | 0.31 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.30 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.30 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4430325 | 1.00 | CYP2D6 (0.37) | CYP2D6CYP2C19BRD4GPR84POLB | |
| SCHEMBL4420609 | 0.84 | MAPT (0.49) | GPR84MAPTKDM4EALDH1A1GAA | |
| SCHEMBL4429246 | 0.79 | EHMT2 (0.39) | CYP2D6CYP2C19GPR84POLBPKM | |
| SCHEMBL4416730 | 0.75 | BRD4 (0.33) | CYP2D6CYP2C19BRD4 | |
| SCHEMBL4417853 | 0.74 | AOC3 (0.48) | ALDH1A1HSD17B10AOC3 | |
| SCHEMBL5040623 | 0.73 | GPR84 (0.39) | CYP2D6CYP2C19GPR84POLBPKM | |
| SCHEMBL4429358 | 0.71 | MAP2K7 (0.39) | CYP2D6CYP2C19GPR84KDM4EMAP2K7 | |
| SCHEMBL5154565 | 0.70 | CYP2D6 (0.37) | CYP2D6CYP2C19BRD4GPR84POLB | |
| SCHEMBL8349903 | 0.68 | KDM4E (0.48) | MAPTKDM4EMAPK1ALDH1A1HSD17B10 | |
| SCHEMBL4419987 | 0.68 | ALDH1A1 (0.35) | ALDH1A1AOC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1720615-A1 | KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF | The Procter and Gamble Company (US) | 2006-11-15 | — | — | EP | disclosed |
| WO-2005087187-A1 | KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF | THE PROCTER & GAMBLE COMPANY (US) | 2005-09-22 | — | — | WO | disclosed |