Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.52 |
| ▸ | MT-CO2 | P00403 | 2/20 | 0.52 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ACLY | P53396 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6990229 | 0.85 | PTGS2 (0.69) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8921742 | 0.85 | PTGS2 (0.49) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8896404 | 0.85 | GPBAR1 (0.47) | PTGS2NR4A2GAAALDH1A1ALOX12 | |
| SCHEMBL8894627 | 0.83 | PTGS2 (0.55) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL10154022 | 0.82 | ALDH1A1 (0.53) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8896453 | 0.82 | PTGS2 (0.54) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8911333 | 0.81 | ALDH1A1 (0.53) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL5069873 | 0.81 | PTGS2 (0.77) | PTGS2MT-CO2NR4A2ALDH1A1NPSR1 | |
| SCHEMBL3052006 | 0.79 | PTGS2 (0.54) | PTGS2MT-CO2MEN1GAAKMT2A | |
| SCHEMBL8897672 | 0.78 | PTGS2 (0.49) | PTGS2MT-CO2NR4A2MEN1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997038986-A1 | SUBSTITUTED BENZENESULFONAMIDE DERIVATIVES AS PRODRUGS OF COX-2 INHIBITORS | G.D. SEARLE & CO. (US) | 1997-10-23 | — | — | WO | disclosed |