Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL50921 | 0.86 | RORC (0.51) | CYP2D6ALOX15CYP2C9CYP2C19TP53 | |
| SCHEMBL5015411 | 0.82 | CYP2C19 (0.54) | CYP2D6ALOX15CYP2C9CYP2C19TP53 | |
| SCHEMBL9510080 | 0.81 | CYP2C19 (0.49) | CYP2D6ALOX15CYP2C9CYP2C19TP53 | |
| SCHEMBL4596678 | 0.78 | TYR (0.50) | CYP2D6ALOX15CYP2C9CYP2C19TP53 | |
| SCHEMBL8443342 | 0.78 | CYP2C19 (0.54) | CYP2D6ALOX15CYP2C9CYP2C19TP53 | |
| SCHEMBL11329698 | 0.77 | CYP2C19 (0.53) | CYP2D6ALOX15CYP2C9CYP2C19TP53 | |
| SCHEMBL11699873 | 0.77 | RORC (0.62) | CYP2D6ALOX15CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL4595527 | 0.77 | TRPA1 (0.57) | CYP2D6ALOX15CYP2C9CYP2C19TP53 | |
| SCHEMBL52009 | 0.76 | ALDH1A1 (0.59) | CYP2D6ALOX15ALDH1A1HPGDHSD17B10 | |
| SCHEMBL5167842 | 0.76 | ALDH1A1 (0.59) | CYP2D6ALOX15ALDH1A1HPGDHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1437231-B1 | DEVELOPER FOR THERMAL RECORDING MATERIAL AND THERMAL RECORDING MATERIALS | API CORP (JP) | 2008-01-09 | — | — | EP | disclosed |
| US-20040241598-A1 | Developer for thermal recording material and thermal recording materials | NIPPON PAPER INDUSTRIES CO., LTD. (JP) | 2004-12-02 | — | — | US | disclosed |
| EP-1437231-A1 | DEVELOPER FOR THERMAL RECORDING MATERIAL AND THERMAL RECORDING MATERIALS | API Corporation (JP) | 2004-07-14 | — | — | EP | disclosed |