Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.45 |
| ▸ | SCD | O00767 | 5/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL23967842 | 0.82 | PRKAG1 (0.43) | — | |
| SCHEMBL17402629 | 0.80 | PTGS1 (0.42) | PTGS1PTGS2SCDNR1H2NR1H3 | |
| SCHEMBL16069386 | 0.79 | SCD (0.41) | PTGS1PTGS2SCDNR1H2NR1H3 | |
| SCHEMBL17402606 | 0.79 | PTGS2 (0.41) | PTGS1PTGS2SCDNR1H2NR1H3 | |
| SCHEMBL16069387 | 0.79 | SCD (0.41) | PTGS1PTGS2SCDNR1H2NR1H3 | |
| SCHEMBL16069390 | 0.77 | PRKAG1 (0.46) | PTGS1PTGS2SCD | |
| SCHEMBL23967834 | 0.76 | PTGS2 (0.47) | PTGS1PTGS2SCD | |
| SCHEMBL17402617 | 0.76 | SCD (0.39) | PTGS1PTGS2SCDNR1H2NR1H3 | |
| SCHEMBL16069385 | 0.76 | PRKAG1 (0.45) | PTGS1PTGS2SCD | |
| SCHEMBL16069673 | 0.76 | SCD (0.38) | PTGS1PTGS2SCDNR1H2NR1H3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2970119-B1 | NOVEL INDOLE DERIVATIVES USEFUL AS ANTI-DIABETIC AGENTS | MERCK SHARP & DOHME (US) | 2021-11-03 | — | — | EP | disclosed |