Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 15/20 | 0.51 |
| ▸ | CA1 | P00915 | 14/20 | 0.51 |
| ▸ | CA9 | Q16790 | 5/20 | 0.51 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8098757 | 0.87 | CA2 (0.50) | CA2CA1CA9CA12PTGS2 | |
| SCHEMBL8105450 | 0.84 | CA1 (0.47) | CA2CA1CA9CA12SOS1 | |
| SCHEMBL8101123 | 0.83 | PTGS1 (0.56) | CA2CA1CA9CA12SOS1 | |
| SCHEMBL905181 | 0.80 | CCR2 (0.54) | — | |
| SCHEMBL8092098 | 0.80 | PTGS1 (0.60) | CA2CA1CA9CA12PTGS2 | |
| SCHEMBL8101811 | 0.79 | CA2 (0.47) | CA2CA1CA9CA12SOS1 | |
| SCHEMBL8091416 | 0.79 | PTGS1 (0.56) | CA2CA1CA9CA12PTGS2 | |
| SCHEMBL8105031 | 0.77 | SOS1 (0.59) | CA2CA1CA9CA12SOS1 | |
| SCHEMBL8101694 | 0.76 | CA2 (0.47) | CA2CA1CA9CA12PTGS2 | |
| SCHEMBL8105274 | 0.75 | CA2 (0.50) | CA2CA1CA9CA12PTGS2 |
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-0848703-B1 | DERIVATIVES OF BENZOSULPHONAMIDES AS INHIBITORS OF THE ENZYME CYCLO-OXYGENASE II | NYCOMED AUSTRIA GMBH (AT) | 2000-09-27 | — | — | EP | disclosed |
| US-6004948-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION | NYCOMED AUSTRIA GMBH (AT) | 1999-12-21 | — | — | US | disclosed |