Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 2/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8077236 | 1.00 | ENPP2 (0.44) | ENPP2EPHX2NR1H4PTGS2MEN1 | |
| SCHEMBL8133933 | 0.83 | ENPP2 (0.48) | ENPP2EPHX2NR1H4PTGS2MEN1 | |
| SCHEMBL14462577 | 0.81 | ENPP2 (0.42) | ENPP2EPHX2NR1H4PTGS2AKR1C3 | |
| SCHEMBL2600037 | 0.79 | ESR1 (0.50) | ENPP2EPHX2NR1H4PTGS2PTPN1 | |
| SCHEMBL8562185 | 0.78 | GAA (0.37) | ENPP2EPHX2NR1H4PTGS2PTGDR2 | |
| SCHEMBL6606841 | 0.77 | EPHX2 (0.46) | ENPP2EPHX2NR1H4PTGS2AKR1C3 | |
| SCHEMBL8563783 | 0.77 | EPHX2 (0.46) | ENPP2EPHX2NR1H4PTGS2MEN1 | |
| SCHEMBL28303457 | 0.76 | ENPP2 (0.43) | ENPP2EPHX2NR1H4PTGS2PTPN1 | |
| SCHEMBL6609254 | 0.75 | EPHX2 (0.47) | ENPP2EPHX2NR1H4PTGS2AKR1C3 | |
| SCHEMBL18403162 | 0.75 | EPHX2 (0.40) | ENPP2EPHX2NR1H4PTGS2AKR1C3 |
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-1028951-A1 | DIARYL-5-ALKYL-5-METHYL-2(5H)-FURANONES AS SELECTIVE CYCLOOXYGENASE-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 2000-08-23 | — | — | EP | disclosed |
| WO-1999023087-A1 | DIARYL-5-ALKYL-5-METHYL-2(5H)-FURANONES AS SELECTIVE CYCLOOXYGENASE-2 INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 1999-05-14 | — | — | WO | disclosed |