Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.53 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.48 |
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MME | P08473 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL11807534 | 0.89 | ALDH1A1 (0.56) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL11805036 | 0.88 | MAPT (0.55) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL11453894 | 0.87 | ALDH1A1 (0.56) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL31302308 | 0.85 | FFAR1 (0.66) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL8634851 | 0.85 | FFAR1 (0.66) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL21222712 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL31302290 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL11968926 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPTMEN1CYP3A4TSHR | |
| SCHEMBL11802059 | 0.81 | ALDH1A1 (0.54) | ALDH1A1MAPTMEN1TSHRKMT2A | |
| Benzylacetone SCHEMBL27625521 | 0.81 | ALDH1A1 (0.81) | ALDH1A1MAPTTSHRKMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-3950427-A | ANTIINFLAMMATORY, ANTIPYRETIC | BOEHRINGER INGELHEIM GMBH (DT) | 1976-04-13 | — | — | US | disclosed |