Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2530546 | 0.89 | CA1 (0.45) | CA1FDPSMAPK1CES2LTA4H | |
| SCHEMBL2525387 | 0.88 | CA1 (0.44) | CA1MAPK1CES2LTA4H | |
| SCHEMBL3099302 | 0.86 | CA1 (0.50) | CA1FDPSMAPK1CES2LTA4H | |
| SCHEMBL15386609 | 0.86 | CA1 (0.50) | CA1FDPSCA2MAPK1FFAR4 | |
| SCHEMBL2529707 | 0.86 | TSHR (0.39) | CA1FDPSMAPK1FFAR4NFKB1 | |
| SCHEMBL10904102 | 0.86 | CA1 (0.50) | CA1FDPSMAPK1CES2LTA4H | |
| SCHEMBL2532121 | 0.86 | CES2 (0.47) | MAPK1FFAR4FFAR1CES2 | |
| SCHEMBL2523983 | 0.86 | CES2 (0.47) | MAPK1FFAR4FFAR1CES2 | |
| SCHEMBL2527272 | 0.83 | CA1 (0.47) | CA1FDPSCA2MAPK1FFAR4 | |
| SCHEMBL31472637 | 0.83 | CES2 (0.57) | CA1MAPK1FFAR4FFAR1CES2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8461135-B2 | Boron-containing small molecules as anti-inflammatory agents | ANACOR PHARMACEUTICALS, INC. (US) | 2013-06-11 | — | — | US | claimed |
| US-8039450-B2 | Boron-containing small molecules as anti-inflammatory agents | ANACOR PHARMACEUTICALS, INC. (US) | 2011-10-18 | — | — | US | claimed |