Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7448732 | 0.88 | ALDH1A1 (0.47) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL26290931 | 0.83 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL18510056 | 0.83 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL28218016 | 0.83 | ALDH1A1 (0.49) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL27616535 | 0.80 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL9841014 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL12215144 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL9841010 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL26988864 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDTDP1KMT2A | |
| SCHEMBL30489371 | 0.79 | KMT2A (0.55) | ALDH1A1MAPTKMT2AL3MBTL1LMNA |
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-0593557-A1 | AROMATIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THERAPY. | MERCK SHARP & DOHME (GB) | 1994-04-27 | — | — | EP | disclosed |