Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | KLK7 | P49862 | 1/20 | 0.45 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30826538 | 0.92 | TMPRSS15 (0.46) | S1PR1LMNATDP1TMPRSS15ALDH1A1 | |
| SCHEMBL5118218 | 0.89 | LMNA (0.49) | S1PR1LMNATDP1ALDH1A1L3MBTL1 | |
| SCHEMBL5113817 | 0.87 | MEN1 (0.48) | LMNATDP1ALDH1A1MMP9L3MBTL1 | |
| SCHEMBL14177313 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MMP9CASP1KLK7KLK5 | |
| SCHEMBL28709501 | 0.83 | ALDH1A1 (0.53) | TDP1ALDH1A1MMP9CASP1KLK7 | |
| SCHEMBL6990743 | 0.83 | CASP3 (0.46) | LMNATDP1TMPRSS15CASP1L3MBTL1 | |
| SCHEMBL25491969 | 0.82 | CASP1 (0.50) | S1PR1LMNATDP1ALDH1A1GAA | |
| SCHEMBL8765627 | 0.82 | CASP1 (0.60) | ALDH1A1CASP1 | |
| SCHEMBL9312398 | 0.82 | CASP1 (0.60) | ALDH1A1CASP1 | |
| SCHEMBL8682005 | 0.82 | L3MBTL1 (0.58) | LMNATDP1ALDH1A1L3MBTL1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023083291-A1 | DERIVATIVE OF ASPARTIC ACID AND USE THEREOF IN TREATMENT OF METABOLIC DISEASES SUCH AS HEPATIC FIBROSIS AND NON-ALCOHOLIC HEPATITIS | 深圳利沃生物医药科技有限公司 | 2023-05-19 | — | — | WO | disclosed |