Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29089456 | 0.84 | NPC1 (0.46) | GSK3BGAARAB9AALDH1A1MAPT | |
| SCHEMBL29089455 | 0.83 | RAB9A (0.44) | GSK3BGAAHSD17B10RAB9AALDH1A1 | |
| SCHEMBL29089425 | 0.83 | LMNA (0.46) | GSK3BGAARAB9AALDH1A1MAPT | |
| SCHEMBL29089447 | 0.83 | USP2 (0.46) | HSD17B10RAB9AALDH1A1MAPTPOLB | |
| SCHEMBL29089432 | 0.80 | GSK3B (0.48) | GSK3BGAARAB9AALDH1A1MAPT | |
| SCHEMBL29089466 | 0.80 | PTPN1 (0.46) | GSK3BALDH1A1MAPT | |
| SCHEMBL29089412 | 0.74 | NPC1 (0.42) | GSK3BHSD17B10RAB9AALDH1A1MAPT | |
| SCHEMBL8757253 | 0.70 | GSK3B (0.59) | GSK3BGAACA1CA2CA12 | |
| SCHEMBL250688 | 0.65 | GSK3B (1.00) | GSK3BCA1CA2RAB9AALDH1A1 | |
| SCHEMBL1146988 | 0.65 | RAB9A (0.71) | GSK3BGAACA1CA2RAB9A |
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-116903480-A | Method for preparing beta-enaminone based on sulfoxide and aldoxime and beta-enaminone | 盐城师范学院 | 2023-10-20 | — | — | CN | disclosed |