Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | MAP4K1 | Q92918 | 3/20 | 0.37 |
| ▸ | LATS1 | O95835 | 2/20 | 0.36 |
| ▸ | LATS2 | Q9NRM7 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2611050 | 0.73 | TLR8 (0.46) | PIK3CATLR8TLR7TLR9BRD4 | |
| SCHEMBL17998714 | 0.70 | ALDH1A1 (0.39) | TRPA1ALDH1A1 | |
| SCHEMBL19465608 | 0.66 | HCAR2 (0.41) | TRPA1LATS2ALDH1A1 | |
| SCHEMBL21105124 | 0.64 | RPS6KA3 (0.60) | RPS6KA3LATS1LATS2LIMK1 | |
| SCHEMBL6648507 | 0.63 | KDM4E (0.53) | RPS6KA3ALDH1A1 | |
| SCHEMBL6910260 | 0.61 | RPS6KA3 (0.57) | RPS6KA3LIMK1RPS6KB1 | |
| SCHEMBL20624711 | 0.61 | RPS6KA3 (0.49) | RPS6KA3LATS1LATS2TLR8TLR7 | |
| SCHEMBL10228363 | 0.61 | ALDH1A1 (0.35) | TRPA1TLR8TLR7TLR9ALDH1A1 | |
| SCHEMBL6650711 | 0.61 | CYP19A1 (0.47) | RPS6KA3ALDH1A1 | |
| SCHEMBL27377899 | 0.61 | CLK1 (0.44) | PIK3CALATS1LATS2TLR8 |
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-2023116779-A1 | DIALKYNE COMPOUND AND USE THEREOF | 上海艾力斯医药科技股份有限公司 | 2023-06-29 | — | — | WO | disclosed |