Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELAVL1 | Q15717 | 3/20 | 0.45 |
| ▸ | HTR6 | P50406 | 6/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HMGCR | P04035 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PPME1 | Q9Y570 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.35 |
| ▸ | NEK2 | P51955 | 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 | |
|---|---|---|---|---|
| SCHEMBL9024945 | 0.82 | ELAVL1 (0.44) | ELAVL1HTR6CA12CA1CA2 | |
| SCHEMBL9750837 | 0.79 | HMGCR (0.58) | PTGS2HMGCRL3MBTL1 | |
| SCHEMBL9024288 | 0.78 | ALDH3A1 (0.40) | ELAVL1HTR6PTGS2PKMPPME1 | |
| SCHEMBL9024842 | 0.76 | ALDH1A1 (0.53) | PKML3MBTL1LMNAHTTSMN1; SMN2 | |
| SCHEMBL9751046 | 0.75 | HMGCR (0.55) | PTGS2HMGCRPTGS1 | |
| SCHEMBL9024104 | 0.71 | PKM (0.39) | PKMHMGCRHTTSMN1; SMN2 | |
| SCHEMBL9024101 | 0.71 | PKM (0.39) | PKMHMGCRHTTSMN1; SMN2 | |
| SCHEMBL1156285 | 0.69 | PKM (0.43) | ELAVL1HTR6PTGS2PKMPPME1 | |
| SCHEMBL9518373 | 0.69 | HMGCR (0.58) | PTGS2HMGCRPTGS1 | |
| SCHEMBL9024469 | 0.68 | PKM (0.38) | PKMHMGCRHTTSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0464845-B1 | Pyrrole derivatives | SHIONOGI & CO (JP) | 1996-06-05 | — | — | EP | disclosed |
| US-5128366-A | Enzyme inhibitors, anticholesterol | SHINOGI & CO., LTD. (JP) | 1992-07-07 | — | — | US | disclosed |
| EP-0464845-A1 | Pyrrole derivatives | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1992-01-08 | — | — | EP | disclosed |