Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3928974 | 0.77 | CA1 (0.36) | CA1CA2ALDH1A1 | |
| SCHEMBL11594456 | 0.75 | CA1 (0.35) | CA1CA2ALDH1A1 | |
| SCHEMBL22821168 | 0.74 | EPHX1 (0.38) | CA1CA2EPHX1 | |
| SCHEMBL28488919 | 0.72 | EPHX1 (0.37) | CA1CA2EPHX1 | |
| SCHEMBL28489243 | 0.72 | EPHX1 (0.37) | CA1CA2EPHX1 | |
| SCHEMBL28493384 | 0.72 | EPHX1 (0.37) | CA1CA2EPHX1 | |
| SCHEMBL28254281 | 0.72 | EPHX1 (0.34) | CA1CA2EPHX1 | |
| SCHEMBL23617843 | 0.69 | — | — | |
| SCHEMBL2835677 | 0.69 | POLB (0.34) | CA1CA2EPHX1 | |
| SCHEMBL10198481 | 0.67 | CA1 (0.30) | CA1CA2EPHX1 |
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-2004089911-A1 | PYRAZOLE DERIVATIVES AS GAMMA-SECRETASE INHIBITORS USEFUL IN THE TREATMENT OF ALZHEIMER’S DISEASE | MERCK SHARP & DOHME LIMITED (GB) | 2004-10-21 | — | — | WO | disclosed |