Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 6/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28125417 | 0.78 | MAOA (0.44) | PTGS1PTGS2HTTTSHRMAPT | |
| SCHEMBL21515820 | 0.77 | AOC1 (0.44) | PTGS1PTGS2SLC22A12CA12CA1 | |
| SCHEMBL9207139 | 0.77 | CA12 (0.37) | PTGS1PTGS2CA12CA1CA2 | |
| SCHEMBL14361044 | 0.76 | PTGS1 (0.37) | PTGS1PTGS2CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL28441332 | 0.76 | AOC1 (0.46) | PTGS1PTGS2SLC22A12CA12CA1 | |
| SCHEMBL17580381 | 0.75 | AAK1 (0.41) | SLC22A12HTT | |
| SCHEMBL5010704 | 0.75 | KDM4E (0.53) | HTTTSHRGAA | |
| SCHEMBL9372692 | 0.74 | — | — | |
| SCHEMBL23934641 | 0.74 | CA12 (0.49) | PTGS1PTGS2SLC22A12CA12CA1 | |
| SCHEMBL15881345 | 0.74 | MAPT (0.49) | PTGS1PTGS2TSHRMAPTGAA |
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-2023016521-A1 | SUBSTITUTED TRIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | 上海赛默罗生物科技有限公司 | 2023-02-16 | — | — | WO | disclosed |