Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 10/20 | 0.63 |
| ▸ | CA1 | P00915 | 6/20 | 0.48 |
| ▸ | CA2 | P00918 | 6/20 | 0.48 |
| ▸ | CA9 | Q16790 | 5/20 | 0.48 |
| ▸ | CA12 | O43570 | 4/20 | 0.48 |
| ▸ | MT-CO2 | P00403 | 3/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8348668 | 0.94 | PTGS2 (0.53) | PTGS2MT-CO2PTGS1ALDH1A1NPSR1 | |
| SCHEMBL8477416 | 0.84 | ALDH1A1 (0.47) | PTGS2MT-CO2ALDH1A1NPSR1PKM | |
| SCHEMBL8597059 | 0.84 | PTGS2 (0.45) | PTGS2MT-CO2ALDH1A1NPSR1PKM | |
| SCHEMBL8476337 | 0.84 | ALDH1A1 (0.49) | PTGS2MT-CO2PTGS1ALDH1A1NPSR1 | |
| Benzenesulfonamide SCHEMBL7180310 | 0.83 | PTGS2 (0.62) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL8475895 | 0.82 | PTGS2 (0.54) | PTGS2MT-CO2PTGS1ALDH1A1NPSR1 | |
| SCHEMBL8473431 | 0.81 | ALDH1A1 (0.51) | PTGS2MT-CO2PTGS1ALDH1A1NPSR1 | |
| SCHEMBL8473498 | 0.81 | ALDH1A1 (0.48) | PTGS2MT-CO2PTGS1ALDH1A1NPSR1 | |
| SCHEMBL8474218 | 0.80 | ALDH1A1 (0.50) | PTGS2MT-CO2PTGS1ALDH1A1NPSR1 | |
| SCHEMBL8473748 | 0.79 | ALDH1A1 (0.45) | PTGS2MT-CO2ALDH1A1NPSR1PKM |
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 |
|---|---|---|---|---|---|---|---|
| JP-2001527542-A | — | — | 2001-12-25 | — | — | JP | claimed |
| EP-1140181-A1 | COMBINATION THERAPY OF RADIATION AND A COX-2 INHIBITOR FOR THE TREATMENT OF NEOPLASIA | G.D. SEARLE & CO. (US) | 2001-10-10 | — | — | EP | claimed |
| WO-2000038716-A1 | COMBINATION THERAPY OF RADIATION AND A COX-2 INHIBITOR FOR THE TREATMENT OF NEOPLASIA | G.D. SEARLE & CO. (US) | 2000-07-06 | — | — | WO | claimed |
| EP-0979077-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE PREVENTION OF CARDIOVASCULAR DISORDERS | G.D. Searle & Co. (US) | 2000-02-16 | — | — | EP | claimed |
| WO-1998047509-A1 | METHOD OF USING CYCLOOXYGENASE-2 INHIBITORS IN THE PREVENTION OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1998-10-29 | — | — | WO | claimed |