Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.60 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | FGF23 | Q9GZV9 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2622585 | 0.88 | PTGS2 (0.68) | PTGS2PTGS1SLC6A3FGF23ESR1 | |
| SCHEMBL7243101 | 0.81 | ESR2 (0.58) | CA12CA1CA2CA7CA9 | |
| SCHEMBL13766500 | 0.81 | PTGS2 (0.60) | PTGS2PTGS1SLC6A3FGF23ESR1 | |
| SCHEMBL50514 | 0.78 | — | — | |
| SCHEMBL6512391 | 0.76 | CA1 (0.65) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5302598 | 0.76 | CA1 (0.65) | CA12CA1CA2CA7CA9 | |
| Hydrogen Sulfide SCHEMBL27634199 | 0.76 | CA1 (0.65) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6521833 | 0.76 | CA1 (0.65) | CA12CA1CA2CA7CA9 | |
| SCHEMBL28010058 | 0.76 | CA1 (0.65) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27744604 | 0.76 | CA1 (0.65) | CA12CA1CA2CA7CA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0724566-A1 | 1,2-DIARYLCYCLOPENTENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-08-07 | — | — | EP | disclosed |
| WO-1995011883-A1 | 1,2-DIARYLCYCLOPENTENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-05-04 | — | — | WO | disclosed |