Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4692369 | 0.74 | TRPA1 (0.42) | ALDH1A1MAPTMEN1USP2HPGD | |
| SCHEMBL5198423 | 0.72 | TRPA1 (0.43) | ALDH1A1TAAR1TRPA1TSHRNPC1 | |
| SCHEMBL181368 | 0.71 | TRPA1 (0.46) | ALDH1A1MEN1HPGDKMT2ATAAR1 | |
| SCHEMBL1856265 | 0.71 | TAAR1 (0.52) | TAAR1TRPA1TSHRHTR2A | |
| SCHEMBL1344877 | 0.71 | TSHR (0.50) | ALDH1A1MEN1KMT2ATAAR1TRPA1 | |
| SCHEMBL1127660 | 0.71 | TRPA1 (0.42) | ALDH1A1TAAR1TRPA1TSHRRIPK1 | |
| Hydrochloric Acid SCHEMBL7863498 | 0.70 | TAAR1 (0.50) | TAAR1TRPA1TSHRHTR2A | |
| SCHEMBL11865382 | 0.69 | TSHR (0.50) | ALDH1A1KDM4EHSD17B10MEN1ALOX15 | |
| SCHEMBL12949533 | 0.68 | HRH1 (0.56) | TAAR1TRPA1TSHRCYP2D6CYP1A2 | |
| SCHEMBL953748 | 0.68 | TRPA1 (0.43) | ALDH1A1MEN1HPGDKMT2ATRPA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1019358-A1 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | Pharmacia & Upjohn AB (SE) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998043942-A1 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | PHARMACIA & UPJOHN AB (SE) | 1998-10-08 | — | — | WO | disclosed |