Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.42 |
| ▸ | MMP3 | P08254 | 2/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8722230 | 0.90 | CYP2C19 (0.47) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 | |
| SCHEMBL8430055 | 0.85 | SLC1A1 (0.51) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 | |
| SCHEMBL8836900 | 0.85 | SLC1A1 (0.51) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 | |
| Cadaverine Tartrate SCHEMBL27707728 | 0.79 | TSHR (0.62) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 | |
| SCHEMBL8768910 | 0.79 | SLC1A1 (0.57) | HTTSMN1; SMN2SLC1A1CYP2C19TEAD3 | |
| SCHEMBL22087968 | 0.79 | MMP3 (0.46) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 | |
| SCHEMBL10853455 | 0.79 | HTT (0.46) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 | |
| SCHEMBL2252306 | 0.79 | CYP2C19 (0.46) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 | |
| SCHEMBL8618292 | 0.79 | SLC1A1 (0.57) | HTTSMN1; SMN2SLC1A1CYP2C19TEAD3 | |
| SCHEMBL8879002 | 0.79 | MMP3 (0.49) | HTTSMN1; SMN2FOLH1TSHRSLC1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104560907-B | Diketoreductase mutant and its application | 凯莱英医药集团（天津）股份有限公司 | 2017-12-22 | — | — | CN | disclosed |
| WO-1998008854-A2 | SUGAR DERIVATIVES AS SIALYL LEWIS X MIMETICS | NOVARTIS AG (CH) | 1998-03-05 | — | — | WO | disclosed |