Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | METAP1 | P53582 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PRNP | P04156 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL28910708 | 1.00 | SMN1; SMN2 (0.60) | SMN1; SMN2CA1CA2CA4CA7 | |
| SCHEMBL28608472 | 0.89 | SMN1; SMN2 (0.50) | SMN1; SMN2CA1CA2CA4CA7 | |
| SCHEMBL28587931 | 0.87 | SMN1; SMN2 (0.49) | SMN1; SMN2CA1CA2CA4CA7 | |
| SCHEMBL12638888 | 0.85 | BACE1 (0.50) | SMN1; SMN2CA1CA2CA4CA7 | |
| SCHEMBL29940608 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2METAP1ALDH1A1LMNATDP1 | |
| SCHEMBL28600522 | 0.84 | CA1 (0.42) | SMN1; SMN2CA1CA2CA4CA7 | |
| SCHEMBL1875543 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2METAP1ALDH1A1LMNATDP1 | |
| SCHEMBL1874449 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2METAP1ALDH1A1LMNATDP1 | |
| SCHEMBL30293721 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2METAP1ALDH1A1LMNATDP1 | |
| SCHEMBL29476749 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2METAP1ALDH1A1LMNATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108516937-B | Method for preparing chiral alpha-hydroxy-beta-keto ester compound by visible light-initiated aerobic Salan-copper catalyst | 大连理工大学 | 2021-03-26 | — | — | CN | disclosed |