Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.52 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.44 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.43 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RET | P07949 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6979939 | 0.93 | PTGS2 (0.61) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A | |
| SCHEMBL6972059 | 0.88 | PTGS2 (0.61) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A | |
| SCHEMBL6979226 | 0.82 | PTGS2 (0.57) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A | |
| SCHEMBL6979278 | 0.77 | MAPK14 (0.71) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A | |
| SCHEMBL6974037 | 0.77 | PTGS2 (0.61) | PTGS2MAPK14PTGS1NTRK1PLK3 | |
| SCHEMBL6978798 | 0.77 | PTGS2 (0.56) | PTGS2MAPK14PTGS1NTRK1PLK3 | |
| SCHEMBL6974845 | 0.76 | PTGS2 (0.72) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A | |
| SCHEMBL6974205 | 0.76 | PTGS2 (0.58) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A | |
| SCHEMBL6981828 | 0.76 | PTGS2 (0.58) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A | |
| SCHEMBL6977480 | 0.75 | PTGS2 (0.57) | PTGS2MAPK14PTGS1PLA2G2APLA2G4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1105384-B1 | DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS | PACIFIC CORP (KR) | 2003-03-26 | — | — | EP | disclosed |