Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 1.00 |
| ▸ | PTGS1 | P23219 | 4/20 | 1.00 |
| ▸ | NAT1 | P18440 | 1/20 | 0.67 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.62 |
| ▸ | MAOA | P21397 | 1/20 | 0.62 |
| ▸ | MAOB | P27338 | 1/20 | 0.62 |
| ▸ | IGF1R | P08069 | 2/20 | 0.62 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | GSK3B | P49841 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL3667218 | 1.00 | PTGS2 (1.00) | PTGS2PTGS1NAT1CISD1MAOA | |
| SCHEMBL3667216 | 1.00 | PTGS2 (1.00) | PTGS2PTGS1NAT1CISD1MAOA | |
| Choline SCHEMBL7698143 | 0.88 | PTGS2 (0.77) | PTGS2PTGS1NAT1CISD1MAOA | |
| Choline SCHEMBL7698141 | 0.88 | PTGS2 (0.77) | PTGS2PTGS1NAT1CISD1MAOA | |
| SCHEMBL7768284 | 0.86 | PTGS2 (1.00) | PTGS2PTGS1NAT1CISD1GAA | |
| Darbufelone SCHEMBL452950 | 0.86 | PTGS2 (0.75) | PTGS2PTGS1GAAALOX5 | |
| Darbufelone SCHEMBL452951 | 0.86 | PTGS2 (0.75) | PTGS2PTGS1GAAALOX5 | |
| Darbufelone SCHEMBL8526046 | 0.86 | PTGS2 (0.75) | PTGS2PTGS1GAAALOX5 | |
| SCHEMBL8618544 | 0.86 | PTGS2 (1.00) | PTGS2PTGS1NAT1CISD1GAA | |
| SCHEMBL8309757 | 0.86 | PTGS2 (1.00) | PTGS2PTGS1NAT1CISD1GAA |
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-0449216-B1 | 3,5-di-tertiarybutyl-4-hydroxyphenylmethylene derivatives of 2-substituted thiazolidinones, oxazolidinones, and imidazolidinones as antiinflammatory agents | WARNER LAMBERT CO (US) | 1996-02-07 | — | — | EP | claimed |
| US-5143928-A | Inhibitors of cyclooxygenase and lipoxygenase | WARNER-LAMBERT COMPANY (US) | 1992-09-01 | — | — | US | claimed |
| EP-0449216-A1 | 3,5-di-tertiarybutyl-4-hydroxyphenylmethylene derivatives of 2-substituted thiazolidinones, oxazolidinones, and imidazolidinones as antiinflammatory agents | WARNER-LAMBERT COMPANY (US) | 1991-10-02 | — | — | EP | claimed |