Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL125969 | 0.73 | CA12 (0.42) | CA12CA1CA9IDO1CES2 | |
| SCHEMBL29229465 | 0.71 | CA12 (0.40) | CA12CA1CA9IDO1CES2 | |
| SCHEMBL1493119 | 0.71 | CA12 (0.40) | CA12CA1CA9IDO1CES2 | |
| SCHEMBL449836 | 0.71 | — | — | |
| SCHEMBL6246558 | 0.69 | TRPV6 (0.52) | CA12CA1CA9CES2CES1 | |
| SCHEMBL124847 | 0.69 | CA1 (0.45) | CA12CA1CA9CES2CES1 | |
| SCHEMBL27517155 | 0.67 | CES2 (0.43) | CA12CA1CA9IDO1CES2 | |
| SCHEMBL28455177 | 0.67 | CA12 (0.57) | CA12CA1CA9IDO1CES2 | |
| SCHEMBL29032005 | 0.67 | CA12 (0.57) | CA12CA1CA9IDO1CES2 | |
| SCHEMBL30577822 | 0.67 | CA12 (0.57) | CA12CA1CA9IDO1CES2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6352798-B1 | Phenyl boron-based compounds as anion receptors for non-aqueous battery electrolytes | BROOKHAVEN SCIENCE ASSOCIATES, LLC | 2002-03-05 | — | — | US | disclosed |