Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 17/20 | 0.64 |
| ▸ | PTGS2 | P35354 | 17/20 | 0.64 |
| ▸ | CTSG | P08311 | 1/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8295867 | 0.87 | PTGS1 (0.66) | PTGS1PTGS2 | |
| SCHEMBL14516892 | 0.87 | PTGS1 (0.76) | PTGS1PTGS2 | |
| SCHEMBL8289162 | 0.85 | PTGS1 (0.60) | PTGS1PTGS2CTSGCMA1 | |
| SCHEMBL14516614 | 0.83 | PTGS1 (0.76) | PTGS1PTGS2 | |
| SCHEMBL14497482 | 0.82 | PTGS1 (0.73) | PTGS1PTGS2 | |
| SCHEMBL8287004 | 0.81 | PTGS1 (0.61) | PTGS1PTGS2 | |
| SCHEMBL8302475 | 0.80 | PTGS1 (0.71) | PTGS1PTGS2 | |
| SCHEMBL14516175 | 0.79 | PTGS1 (0.74) | PTGS1PTGS2 | |
| SCHEMBL14497478 | 0.79 | PTGS1 (0.74) | PTGS1PTGS2 | |
| SCHEMBL14516372 | 0.78 | PTGS1 (0.73) | PTGS1PTGS2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005009354-A2 | COMPOSITIONS OF A CYCLOOXYGENASE-2 SELECTIVE INHIBITOR AND AN IKK INHIBITOR FOR THE TREATMENT OF ISCHEMIC-MEDIATED CENTRAL NERVOUS SYSTEM DISORDERS OR INJURY | PHARMACIA CORPORATION (US) | 2005-02-03 | — | — | WO | disclosed |