Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL269825 | 0.87 | TAAR1 (0.58) | TAAR1NR3C1NR3C2POLBKDM4E | |
| SCHEMBL29462885 | 0.87 | TAAR1 (0.58) | TAAR1NR3C1NR3C2POLBKDM4E | |
| SCHEMBL9489653 | 0.86 | RAPGEF4 (0.37) | TAAR1NR3C1NR3C2POLBHTT | |
| SCHEMBL18919877 | 0.82 | TAAR1 (0.46) | TAAR1NR3C1NR3C2POLBKDM4E | |
| Acetic Acid SCHEMBL31285767 | 0.78 | NPC1 (0.49) | TAAR1POLBKDM4EHTTALDH1A1 | |
| SCHEMBL271754 | 0.78 | ALDH1A1 (0.42) | NR3C1NR3C2ALDH1A1TP53RAPGEF4 | |
| SCHEMBL169507 | 0.76 | TRPA1 (0.44) | TAAR1ALDH1A1NPC1RAB9AGAA | |
| SCHEMBL5498171 | 0.76 | TRPA1 (0.44) | TAAR1ALDH1A1NPC1RAB9AGAA | |
| SCHEMBL27625494 | 0.74 | POLB (0.42) | TAAR1NR3C1NR3C2POLBKDM4E | |
| SCHEMBL21273338 | 0.73 | TAAR1 (0.44) | TAAR1NR3C1NR3C2POLBKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5670704-A | TRANSMETHYLATION OF NAPHTHALENE OR 2-METHYLNAPHTHALENE USING LEWIS ACID CATALYST MORE ACIDIC THAN FERRIC CHLORIDE | AMOCO CORPORATION (US) | 1997-09-23 | — | — | US | disclosed |
| US-5210355-A | Ethylation of 2-methylnaphthalene with tri-, tetra-, or penta-ethylbenzene in the presence of a catalyst | AMOCO CORPORATION (US) | 1993-05-11 | — | — | US | disclosed |
| US-4873386-A | ETHYLATING AGENT, LEWIS ACID CATALYST | AMOCO CORPORATION (US) | 1989-10-10 | — | — | US | disclosed |