Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | ACACB | O00763 | 1/20 | 0.48 |
| ▸ | PTGES | O14684 | 16/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | CHAT | P28329 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9476552 | 0.88 | HRH3 (0.48) | HRH3ACACBPTGESALOX5CHAT | |
| SCHEMBL9192563 | 0.84 | PTGES (0.56) | PTGESALOX5PTGS1PTGS2 | |
| SCHEMBL9195229 | 0.84 | ACACB (0.48) | ACACBPTGESALOX5PTGS1PTGS2 | |
| SCHEMBL9193618 | 0.83 | PTGES (0.62) | PTGESALOX5PTGS1PTGS2 | |
| SCHEMBL9197210 | 0.77 | PTGES (0.58) | ACACBPTGESALOX5PTGS1PTGS2 | |
| SCHEMBL9299975 | 0.75 | ACACB (0.43) | HRH3ACACBALOX5PTGS1PTGS2 | |
| SCHEMBL9197316 | 0.75 | PTGES (0.59) | ACACBPTGESALOX5PTGS1PTGS2 | |
| SCHEMBL9197649 | 0.75 | PTGES (0.59) | PTGESALOX5PTGS1PTGS2 | |
| SCHEMBL9197154 | 0.75 | PTGES (0.50) | ACACBPTGES | |
| SCHEMBL9476517 | 0.73 | FFAR1 (0.41) | PTGESALOX5 |
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-0468281-B1 | Substituted phenylacetylenes, pharmaceuticals containing them and methods for the preparation of these compounds and pharmaceuticals | GRUENENTHAL GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| US-5202349-A | Lipoxygenase inhibitors, antiasthatics | GRUENENTHAL GMBH (DE) | 1993-04-13 | — | — | US | disclosed |
| EP-0468281-A1 | Substituted phenylacetylenes, pharmaceuticals containing them and methods for the preparation of these compounds and pharmaceuticals | Grünenthal GmbH (DE) | 1992-01-29 | — | — | EP | disclosed |