Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 10/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.50 |
| ▸ | EEF2K | O00418 | 1/20 | 0.50 |
| ▸ | SRC | P12931 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8581179 | 0.92 | PTGS2 (0.49) | PTGS2PTGS1CYP1A2CYP2C9GAA | |
| SCHEMBL8580941 | 0.85 | TP53 (0.45) | PTGS2PTGS1CYP1A2CYP2C9ALDH1A1 | |
| SCHEMBL8580718 | 0.80 | MAPT (0.42) | PTGS2PTGS1CYP1A2CYP2C9GAA | |
| SCHEMBL8582453 | 0.77 | CYP1A2 (0.56) | PTGS2PTGS1CYP1A2ALDH1A1 | |
| Darbufelone SCHEMBL452950 | 0.73 | PTGS2 (0.75) | PTGS2PTGS1CYP1A2CYP2C9GAA | |
| Darbufelone SCHEMBL8526046 | 0.73 | PTGS2 (0.75) | PTGS2PTGS1CYP1A2CYP2C9GAA | |
| Darbufelone SCHEMBL452951 | 0.73 | PTGS2 (0.75) | PTGS2PTGS1CYP1A2CYP2C9GAA | |
| SCHEMBL3667218 | 0.72 | PTGS2 (1.00) | PTGS2PTGS1GAAALOX5 | |
| SCHEMBL3667216 | 0.72 | PTGS2 (1.00) | PTGS2PTGS1GAAALOX5 | |
| SCHEMBL8962138 | 0.72 | PTGS2 (1.00) | PTGS2PTGS1GAAALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| US-5731336-A | USING ARYL-SUBSTITUTED RHODAMINES | ELI LILLY AND COMPANY (US) | 1998-03-24 | — | — | US | disclosed |