Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 6/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6184942 | 0.76 | NR1H2 (0.36) | ALDH1A1KMT2AGAARIPK1 | |
| SCHEMBL28412066 | 0.74 | RIPK1 (0.34) | ALDH1A1KMT2AGAARIPK1 | |
| SCHEMBL8164836 | 0.71 | ANPEP (0.40) | KDM4EALDH1A1 | |
| SCHEMBL7343190 | 0.71 | KCNA5 (0.45) | ALDH1A1KMT2AGAA | |
| SCHEMBL517085 | 0.68 | AOC3 (0.40) | AOC3SLC6A4KDM4EALDH1A1KMT2A | |
| SCHEMBL17076303 | 0.68 | AOC3 (0.40) | AOC3SLC6A4KDM4EALDH1A1KMT2A | |
| SCHEMBL4729192 | 0.68 | OPRK1 (0.40) | ALDH1A1KMT2AATM | |
| SCHEMBL6326613 | 0.68 | RIPK1 (0.41) | AOC3KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL6400372 | 0.68 | OPRK1 (0.40) | ALDH1A1KMT2AATM | |
| SCHEMBL5153345 | 0.67 | KDM4E (0.57) | AOC3SLC6A4KDM4EALDH1A1KMT2A |
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-0593615-A1 | AROMATIC COMPOUNDS, COMPOSITIONS CONTAINING THEM AND THEIR USE IN THERAPY. | MERCK SHARP & DOHME (GB) | 1994-04-27 | — | — | EP | disclosed |