Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 11/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8605996 | 0.91 | PTGS2 (0.47) | PTGS2PTGS1ALDH1A1EPHX2RXRA | |
| SCHEMBL6315576 | 0.88 | PTGS2 (0.50) | PTGS2PTGS1ALDH1A1EPHX2RXRA | |
| SCHEMBL8604016 | 0.86 | CA2 (0.44) | PTGS2PTGS1EPHX2RXRARXRB | |
| SCHEMBL8604402 | 0.86 | PTGS2 (0.43) | PTGS2PTGS1EPHX2RXRARXRB | |
| SCHEMBL6308148 | 0.84 | PTGS2 (0.51) | PTGS2PTGS1EPHX2RXRARXRB | |
| SCHEMBL8604308 | 0.84 | RXRA (0.47) | PTGS2PTGS1ALDH1A1RXRARXRB | |
| SCHEMBL8605984 | 0.84 | RXRA (0.47) | PTGS2PTGS1ALDH1A1RXRARXRB | |
| SCHEMBL6309066 | 0.82 | PTGS2 (0.49) | PTGS2PTGS1EPHX2RXRARXRB | |
| SCHEMBL8606213 | 0.82 | PTGS2 (0.53) | PTGS2PTGS1ALDH1A1NLRP3LMNA | |
| SCHEMBL7520779 | 0.81 | PTGS2 (0.47) | PTGS2PTGS1ALDH1A1 |
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-0828718-A1 | HETEROCYCLO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-03-18 | — | — | EP | disclosed |
| WO-1996038418-A1 | HETEROCYCLO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS | G.D. SEARLE & CO. (US) | 1996-12-05 | — | — | WO | disclosed |