Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6599340 | 1.00 | CA4 (0.35) | CA4TSHRTHPO | |
| SCHEMBL5572189 | 0.71 | — | — | |
| SCHEMBL5572187 | 0.71 | — | — | |
| SCHEMBL11003135 | 0.70 | CA4 (0.30) | CA4TSHR | |
| SCHEMBL11003136 | 0.70 | CA4 (0.30) | CA4TSHR | |
| SCHEMBL2418090 | 0.69 | PTGS1 (0.34) | TSHR | |
| SCHEMBL2418084 | 0.69 | PTGS1 (0.34) | TSHR | |
| SCHEMBL608050 | 0.67 | TSHR (0.33) | TSHR | |
| Acetone SCHEMBL10432348 | 0.65 | LMNA (0.43) | CA4TSHRTHPO | |
| SCHEMBL10590385 | 0.65 | — | — |
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-1441731-A1 | PYRIDONE, PYRIDAZONE AND TRIAZONE DERIVATIVES AS LP-PLA2 INHIBITORS | SmithKline Beecham P.L.C. (GB) | 2004-08-04 | — | — | EP | disclosed |
| WO-2003041712-A1 | PYRIDONE, PYRIDAZONE AND TRIAZONE DERIVATIVES AS LP-PLA2 INHIBITORS | SMITHKLINE BEECHAM P.L.C. (GB) | 2003-05-22 | — | — | WO | disclosed |