Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 15/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7855541 | 0.91 | PTGS2 (0.51) | PTGS2PTGS1 | |
| SCHEMBL7853463 | 0.90 | PTGS2 (0.50) | PTGS2PTGS1 | |
| SCHEMBL7857386 | 0.89 | PTGS2 (0.47) | PTGS2ESR1 | |
| SCHEMBL7856241 | 0.89 | PTGS2 (0.47) | PTGS2PTGS1 | |
| SCHEMBL7843040 | 0.82 | PTGS2 (0.59) | PTGS2PTGS1 | |
| SCHEMBL8823417 | 0.75 | PTGS2 (0.66) | PTGS2PTGS1 | |
| SCHEMBL7989345 | 0.72 | PTGS2 (0.59) | PTGS2PTGS1 | |
| SCHEMBL6711246 | 0.70 | PTGS2 (0.83) | PTGS2PTGS1 | |
| SCHEMBL7084896 | 0.69 | PTGS2 (0.57) | PTGS2PTGS1 | |
| SCHEMBL7085196 | 0.68 | PTGS2 (0.59) | PTGS2PTGS1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1085845-A2 | MULTIBINDING INHIBITORS OF CYCLOOXYGENASE-2 | Advanced Medicine, Inc. (US) | 2001-03-28 | — | — | EP | disclosed |
| EP-0989857-A4 | NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES | ADVANCED MEDICINE INC (US) | 2001-01-17 | — | — | EP | disclosed |
| EP-0989857-A1 | NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES | Advanced Medicine, Inc. (US) | 2000-04-05 | — | — | EP | disclosed |
| WO-1999063939-A2 | MULTIBINDING INHIBITORS OF CYCLOOXYGENASE-2 | ADVANCED MEDICINE, INC. (US) | 1999-12-16 | — | — | WO | disclosed |
| WO-1999064037-A1 | NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES | ADVANCED MEDICINE, INC. (US) | 1999-12-16 | — | — | WO | disclosed |