Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 16/20 | 0.64 |
| ▸ | PTGS1 | P23219 | 14/20 | 0.64 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA4 | P22748 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5698589 | 0.87 | PTGS2 (0.69) | PTGS2PTGS1PDPK1CA1CA2 | |
| SCHEMBL8989413 | 0.87 | PTGS2 (0.57) | PTGS2PTGS1CA1CA2CA4 | |
| SCHEMBL8638794 | 0.86 | PTGS2 (0.60) | PTGS2PTGS1CA1CA2CA4 | |
| SCHEMBL8641056 | 0.85 | PTGS2 (0.61) | PTGS2PTGS1CA1CA2CA4 | |
| SCHEMBL8631360 | 0.82 | PTGS2 (0.73) | PTGS2PTGS1PDPK1CA1CA2 | |
| SCHEMBL6350044 | 0.81 | PTGS2 (0.80) | PTGS2PTGS1PDPK1 | |
| SCHEMBL6352592 | 0.81 | PTGS2 (0.71) | PTGS2PTGS1PDPK1 | |
| SCHEMBL6351481 | 0.81 | PTGS2 (0.73) | PTGS2PTGS1PDPK1CA1CA2 | |
| SCHEMBL8635532 | 0.81 | PTGS2 (0.68) | PTGS2PTGS1PDPK1CA1CA2 | |
| SCHEMBL8639285 | 0.81 | PTGS2 (0.59) | PTGS2PTGS1CA1CA2CA4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5521207-A | Substituted pyrazolyl benzenesulfonamide for the treatment of inflammation | G.D. SEARLE & CO. (US) | 1996-05-28 | — | — | US | disclosed |
| US-5516907-A | ANTIINFLAMMATORY AGENTS | G.D. SEARLE & CO. (US) | 1996-05-14 | — | — | US | disclosed |
| US-5466823-A | Antiinflammatory agents; FDA Orange book listed patent for Celebrex | G.D. SEARLE & CO. (US) | 1995-11-14 | — | — | US | disclosed |