Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | STAT1 | P42224 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28594276 | 0.80 | NTRK1 (0.56) | ALDH1A1KMT2AGAAMAPTNTRK1 | |
| SCHEMBL28594274 | 0.80 | NTRK1 (0.56) | ALDH1A1KMT2AGAAMAPTNTRK1 | |
| SCHEMBL29279203 | 0.79 | MAPT (0.44) | ALDH1A1KDM4EKMT2AGAAMAPT | |
| SCHEMBL3850358 | 0.79 | NTRK1 (0.55) | ALDH1A1KMT2AGAAMAPTNTRK1 | |
| SCHEMBL22510050 | 0.78 | KMT2A (0.55) | ALDH1A1KMT2AGAAMAPTNTRK1 | |
| SCHEMBL30396306 | 0.76 | KMT2A (0.52) | ALDH1A1KMT2AGAAMAPTTP53 | |
| SCHEMBL20320311 | 0.76 | NTRK1 (0.56) | ALDH1A1KMT2AGAANTRK1CYP1A2 | |
| SCHEMBL499894 | 0.75 | NTRK1 (0.51) | ALDH1A1KMT2AGAAMAPTNTRK1 | |
| SCHEMBL20320310 | 0.75 | KMT2A (0.54) | ALDH1A1KMT2AGAAMAPTNTRK1 | |
| SCHEMBL28580354 | 0.74 | GAA (0.52) | ALDH1A1KDM4EKMT2AGAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117586232-A | Edaravone prodrug derivative and application thereof | 天地恒一制药股份有限公司 | 2024-02-23 | — | — | CN | disclosed |