Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 16/20 | 0.54 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL6062107 | 0.79 | HDAC7 (0.51) | HDAC7 | |
| SCHEMBL1515691 | 0.78 | HDAC7 (0.68) | HDAC7 | |
| SCHEMBL18687238 | 0.78 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL2477386 | 0.73 | HDAC7 (0.53) | HDAC7 | |
| SCHEMBL1482128 | 0.73 | LMNA (0.47) | PTGS2 | |
| SCHEMBL18217887 | 0.72 | LMNA (0.55) | PTGS2 | |
| SCHEMBL28019946 | 0.72 | CA2 (0.45) | PTGS2HDAC7 | |
| SCHEMBL12341698 | 0.71 | PTGS2 (0.68) | PTGS2PTGS1 | |
| SCHEMBL14934280 | 0.71 | — | — | |
| SCHEMBL6732777 | 0.71 | PTGS2 (0.78) | PTGS2 |
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-1404330-A1 | SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS | Merck Frosst Canada & Co. (CA) | 2004-04-07 | — | — | EP | disclosed |
| WO-2003002118-A1 | SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2003-01-09 | — | — | WO | disclosed |