Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 15/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 9/20 | 0.58 |
| ▸ | PDPK1 | O15530 | 6/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | PTGES | O14684 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | PDE5A | O76074 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8636828 | 0.94 | PDPK1 (0.61) | PTGS2PTGS1PDPK1CYP2C9PTGES | |
| SCHEMBL8351386 | 0.94 | PTGS2 (0.49) | PTGS2PTGS1PDPK1 | |
| Benzenesulfonamide SCHEMBL7113357 | 0.90 | PTGS2 (0.59) | PTGS2PTGS1PDPK1CYP2C9 | |
| Benzenesulfonamide SCHEMBL8525050 | 0.87 | PTGS2 (0.61) | PTGS2PTGS1PDPK1 | |
| Benzenesulfonamide SCHEMBL7926068 | 0.87 | PTGS2 (0.61) | PTGS2PTGS1PDPK1CYP2C9PTGES | |
| SCHEMBL8640765 | 0.87 | PTGS1 (0.51) | PTGS2PTGS1PDPK1 | |
| SCHEMBL8643571 | 0.86 | PTGS2 (0.51) | PTGS2PTGS1PDPK1CYP2C9 | |
| SCHEMBL8643881 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1TSHR | |
| SCHEMBL8643941 | 0.85 | PTGS2 (0.42) | PTGS2PTGS1PDPK1 | |
| SCHEMBL8641577 | 0.85 | PTGS2 (0.49) | PTGS2PTGS1PDPK1CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0979077-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE PREVENTION OF CARDIOVASCULAR DISORDERS | G.D. Searle & Co. (US) | 2000-02-16 | — | — | EP | disclosed |
| EP-0932402-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE TREATMENT AND PREVENTION OF NEOPLASIA | G.D. SEARLE & CO. (US) | 1999-08-04 | — | — | EP | disclosed |
| WO-1998047509-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE PREVENTION OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1998-10-29 | — | — | WO | disclosed |
| WO-1998016227-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE TREATMENT AND PREVENTION OF NEOPLASIA | G.D. SEARLE & CO. (US) | 1998-04-23 | — | — | WO | disclosed |