Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA3 | P07451 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA5A | P35218 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | MAOB | P27338 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28670379 | 0.89 | ADORA3 (0.56) | CA12CA1CA2CA3CA4 | |
| SCHEMBL28677812 | 0.85 | CA12 (0.42) | CA12CA1CA2CA3CA4 | |
| SCHEMBL28663810 | 0.81 | ALDH1A1 (0.64) | KDM4EALDH1A1SMN1; SMN2NPC1MAPT | |
| SCHEMBL19929823 | 0.79 | ADORA3 (0.54) | ADORA3KDM4EALDH1A1MAOBSMN1; SMN2 | |
| SCHEMBL28660360 | 0.78 | TNKS (0.54) | CA12CA1CA2CA3CA4 | |
| SCHEMBL28655613 | 0.77 | MAOB (0.50) | MAOBNPC1RAB9ATNKSMEN1 | |
| SCHEMBL28929133 | 0.77 | MAOB (0.48) | ADORA3KDM4EALDH1A1MAOBNPC1 | |
| SCHEMBL28665194 | 0.75 | ALDH1A1 (0.52) | KDM4EALDH1A1MAOBSMN1; SMN2NPC1 | |
| SCHEMBL30023352 | 0.74 | RXRA (0.38) | CA12CA1CA2CA3CA4 | |
| SCHEMBL28655615 | 0.73 | DHODH (0.53) | KDM4EALDH1A1MAOBNPC1MAPT |
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-113754619-B | Method for preparing polysubstituted benzofuran-4-formic acid compound under catalysis of ruthenium | 广州大学 | 2022-12-20 | — | — | CN | disclosed |
| CN-113754619-A | Method for preparing polysubstituted benzofuran-4-formic acid compound under catalysis of ruthenium | 广州大学 | 2021-12-07 | — | — | CN | disclosed |