Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 14/20 | 0.42 |
| ▸ | CA2 | P00918 | 14/20 | 0.42 |
| ▸ | CA9 | Q16790 | 7/20 | 0.38 |
| ▸ | CA12 | O43570 | 6/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.37 |
| ▸ | CA4 | P22748 | 3/20 | 0.37 |
| ▸ | PDE4A | P27815 | 2/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL22114296 | 0.87 | CA1 (0.45) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22114324 | 0.85 | CA1 (0.42) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22114323 | 0.83 | CA1 (0.40) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22114289 | 0.83 | CA1 (0.47) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22114337 | 0.82 | CA1 (0.47) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22114348 | 0.82 | CA1 (0.50) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22757537 | 0.79 | CA1 (0.44) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22114273 | 0.79 | CA1 (0.44) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22757524 | 0.77 | CA1 (0.42) | CA1CA2CA9CA12PDE4B | |
| SCHEMBL22757564 | 0.76 | CA1 (0.46) | CA1CA2CA9CA12PDE4B |
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-2020123881-A1 | BORON CONTAINING COMPOUNDS AND THEIR USES | Boragen, Inc. (US) | 2020-06-18 | — | — | WO | disclosed |