Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.33 |
| ▸ | CA1 | P00915 | 5/20 | 0.33 |
| ▸ | CA9 | Q16790 | 5/20 | 0.33 |
| ▸ | PREP | P48147 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30556213 | 0.85 | CA1 (0.38) | CA12CA1CA9PREPCA2 | |
| SCHEMBL29787984 | 0.79 | HTT (0.35) | CA12CA1CA9PREPCA2 | |
| SCHEMBL11856938 | 0.79 | CA1 (0.36) | CA12CA1CA9CA2CA4 | |
| SCHEMBL29847229 | 0.79 | CA1 (0.36) | CA12CA1CA9CA2CA4 | |
| SCHEMBL24167590 | 0.78 | CA1 (0.54) | CA12CA1CA9CA2CA4 | |
| SCHEMBL30556207 | 0.78 | TSHR (0.44) | CA12CA1CA9PREP | |
| SCHEMBL2329763 | 0.78 | TSHR (0.44) | CA12CA1CA9PREP | |
| SCHEMBL29497318 | 0.78 | HTR7 (0.39) | CA12CA1CA9 | |
| SCHEMBL1863318 | 0.78 | HTR7 (0.39) | CA12CA1CA9 | |
| SCHEMBL2411136 | 0.77 | ADRA2A (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008101029-A2 | USE OF THIAZOLE, OXAZOLE AND IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS | XENON PHARMACEUTICALS INC. (CA) | 2008-08-21 | — | — | WO | disclosed |
| EP-0465802-A1 | Oxidant sensitive and insensitive aromatic esters as inhibitors of human neutrophil elastase | CORTECH, INC. (US) | 1992-01-15 | — | — | EP | disclosed |