Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | VDR | P11473 | 1/20 | 0.38 |
| ▸ | TOP2A | P11388 | 2/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22280595 | 0.85 | FAAH (0.45) | FAAHSLC6A4SLC6A3ALDH1A1SMN1; SMN2 | |
| SCHEMBL24720272 | 0.77 | ALOX5AP (0.36) | NPC1RAB9ATDP1EGFRKMT2A | |
| SCHEMBL30931137 | 0.77 | ALOX5AP (0.36) | NPC1RAB9ATDP1EGFRKMT2A | |
| SCHEMBL22280426 | 0.76 | IMPDH2 (0.46) | — | |
| SCHEMBL30956463 | 0.73 | SLC6A4 (0.41) | SLC6A4SLC6A3ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL184016 | 0.72 | SLC6A3 (0.72) | SLC6A4SLC6A3ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL3511611 | 0.72 | TSHR (0.57) | SLC6A3ALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL19484320 | 0.71 | FAAH (0.55) | FAAHSLC6A4SLC6A3ALDH1A1SMN1; SMN2 | |
| SCHEMBL14637938 | 0.71 | FAAH (0.55) | FAAHALDH1A1SMN1; SMN2MAPTNPC1 | |
| SCHEMBL29991987 | 0.71 | NOTUM (0.48) | SLC6A4SLC6A3ALDH1A1SMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020153431-A1 | ESTER COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |
| WO-2020153431-A1 | ESTER COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |