Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 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 | |
|---|---|---|---|---|
| SCHEMBL8728993 | 0.85 | ALDH1A1 (0.45) | ALDH1A1AOC3CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL12742303 | 0.83 | KMT2A (0.45) | ALDH1A1AOC3ALOX5CYP2C9CYP2C19 | |
| SCHEMBL9711274 | 0.83 | AOC3 (0.44) | ALDH1A1AOC3ALOX5CYP2C9CYP2C19 | |
| SCHEMBL32665686 | 0.81 | ALDH1A1 (0.49) | ALDH1A1ALOX5CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL18832093 | 0.80 | ALDH1A1 (0.41) | ALDH1A1AOC3CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL28615664 | 0.80 | ALDH1A1 (0.49) | ALDH1A1AOC3L3MBTL1KDM4EKMT2A | |
| SCHEMBL1641813 | 0.78 | HPGD (0.46) | ALDH1A1AOC3CYP2C9CYP2C19KDM4E | |
| SCHEMBL9711275 | 0.78 | AOC3 (0.45) | ALDH1A1AOC3CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL1285411 | 0.77 | ALDH1A1 (0.51) | ALDH1A1ALOX5CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL6894430 | 0.77 | ALDH1A1 (0.51) | ALDH1A1ALOX5CYP2C9CYP2C19CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115872887-B | Preparation method of agomelatine | 上海国创医药股份有限公司 | 2023-07-07 | — | — | CN | disclosed |
| CN-115872887-A | Preparation method of agomelatine | 上海国创医药股份有限公司 | 2023-03-31 | — | — | CN | disclosed |
| EP-0547148-A1 | NAPHTHALENEPROPIONIC ACID DERIVATIVES AS ANTI-INFLAMMATORY/ANTIALLERGIC AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1993-06-23 | — | — | EP | disclosed |
| WO-1992004325-A1 | NAPHTHALENEPROPIONIC ACID DERIVATIVES AS ANTI-INFLAMMATORY/ANTIALLERGIC AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-03-19 | — | — | WO | disclosed |