Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5042028 | 0.82 | F10 (0.39) | SCN9ATSHRKDM4EALDH1A1MEN1 | |
| SCHEMBL6452774 | 0.72 | POLB (0.48) | SCN9ATSHRL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL30151904 | 0.71 | SCN9A (0.53) | SCN9ATSHRIRAK4KDM4EALDH1A1 | |
| SCHEMBL29397819 | 0.68 | TSHR (0.43) | SCN9ATSHRIRAK4KDM4EALDH1A1 | |
| SCHEMBL24337345 | 0.68 | L3MBTL1 (0.42) | SCN9ATSHRL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL2814439 | 0.67 | SCN9A (0.54) | SCN9ATSHRKDM4EALDH1A1PTGER1 | |
| SCHEMBL2814888 | 0.67 | SCN9A (0.54) | SCN9ATSHRKDM4EALDH1A1PTGER1 | |
| SCHEMBL20090371 | 0.67 | HTR2A (0.44) | SCN9ATSHRL3MBTL1PTGER1MEN1 | |
| SCHEMBL12697009 | 0.67 | ALDH1A1 (0.49) | SCN9ATSHRKDM4EALDH1A1PTGER1 | |
| SCHEMBL12697089 | 0.67 | ALDH1A1 (0.49) | SCN9ATSHRKDM4EALDH1A1PTGER1 |
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-1567498-A2 | MANDELIC ACID DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004048335-A2 | MANDELIC ACID DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-06-10 | — | — | WO | disclosed |