Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL5724507 | 0.89 | PTGS2 (0.48) | PTGS2PTGS1 | |
| SCHEMBL5723555 | 0.86 | PTGS2 (0.64) | PTGS2PTGS1FAAHMGLL | |
| SCHEMBL5724360 | 0.85 | PTGS2 (0.55) | PTGS2PTGS1LTB4R | |
| SCHEMBL5723973 | 0.83 | PTGS2 (0.54) | PTGS2PTGS1FAAHMGLL | |
| SCHEMBL5723724 | 0.80 | PTGS2 (0.52) | PTGS2PTGS1 | |
| SCHEMBL5723604 | 0.80 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL5723497 | 0.79 | PTGS2 (0.52) | PTGS2PTGS1 | |
| SCHEMBL5723997 | 0.79 | PTGS2 (0.49) | PTGS2PTGS1 | |
| SCHEMBL5723593 | 0.73 | PTGS2 (0.43) | PTGS2PTGS1 | |
| SCHEMBL5723718 | 0.73 | PTGS2 (0.69) | PTGS2PTGS1LMNA |
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-1406609-B1 | SUBSTITUTED ARYL COMPOUNDS AS NOVEL CYCLOOXYGENASE-2 SELECTIVE INHIBITORS, COMPOSITIONS AND METHODS OF USE | NITROMED INC (US) | 2006-09-06 | — | — | EP | claimed |