Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 12/20 | 0.39 |
| ▸ | CA1 | P00915 | 11/20 | 0.39 |
| ▸ | CA2 | P00918 | 11/20 | 0.39 |
| ▸ | CA12 | O43570 | 11/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6314715 | 0.97 | CA1 (0.39) | CA9CA1CA2CA12PTGS2 | |
| SCHEMBL6308406 | 0.96 | CA9 (0.40) | CA9CA1CA2CA12PTGS2 | |
| SCHEMBL8634963 | 0.92 | PTGS2 (0.39) | PTGS2PTGS1 | |
| SCHEMBL6309227 | 0.89 | PTGS2 (0.39) | PTGS2PTGS1 | |
| SCHEMBL6307645 | 0.88 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL6744826 | 0.78 | CA1 (0.46) | CA9CA1CA2CA12PTGS2 | |
| SCHEMBL6747452 | 0.76 | CA9 (0.43) | CA9CA1CA2CA12PTGS2 | |
| SCHEMBL6746809 | 0.76 | CA1 (0.39) | CA9CA1CA2CA12PTGS2 | |
| SCHEMBL6314672 | 0.75 | CA9 (0.40) | CA9CA1CA2CA12PTGS2 | |
| SCHEMBL7777960 | 0.75 | PTGS2 (0.49) | CA9CA1CA2CA12PTGS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0828718-A1 | HETEROCYCLO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-03-18 | — | — | EP | disclosed |
| WO-1996038418-A1 | HETEROCYCLO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS | G.D. SEARLE & CO. (US) | 1996-12-05 | — | — | WO | disclosed |