Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 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 | |
|---|---|---|---|---|
| SCHEMBL2523649 | 0.98 | NAAA (0.44) | CA1NAAAALDH1A1CA2EPHX1 | |
| SCHEMBL2525615 | 0.98 | NAAA (0.44) | CA1NAAAALDH1A1CA2EPHX1 | |
| SCHEMBL2529449 | 0.94 | CA1 (0.42) | CA1NAAAALDH1A1CA2EPHX1 | |
| SCHEMBL2531921 | 0.91 | NAAA (0.38) | CA1NAAAALDH1A1EPHX1ATM | |
| SCHEMBL7222715 | 0.90 | CA1 (0.50) | CA1NAAAALDH1A1CA2EPHX1 | |
| SCHEMBL2529097 | 0.89 | NAAA (0.41) | NAAAALDH1A1EPHX1ACHETSHR | |
| SCHEMBL2525641 | 0.89 | NAAA (0.41) | NAAAALDH1A1EPHX1ACHETSHR | |
| SCHEMBL7223421 | 0.89 | NAAA (0.53) | CA1NAAAALDH1A1EPHX1ACHE | |
| SCHEMBL7217720 | 0.89 | NAAA (0.53) | CA1NAAAALDH1A1EPHX1ACHE | |
| SCHEMBL7223411 | 0.89 | NAAA (0.53) | CA1NAAAALDH1A1EPHX1ACHE |
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 |