Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 14/20 | 0.41 |
| ▸ | CA2 | P00918 | 14/20 | 0.41 |
| ▸ | CA9 | Q16790 | 8/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | CA3 | P07451 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9047614 | 1.00 | CA1 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL4456004 | 0.91 | CA2 (0.47) | CA1CA2CA9CA12CA7 | |
| SCHEMBL27877423 | 0.89 | CA2 (0.46) | CA1CA2CA9CA12CA7 | |
| SCHEMBL27908673 | 0.89 | CA2 (0.46) | CA1CA2CA9CA12CA7 | |
| SCHEMBL1932935 | 0.89 | CA1 (0.46) | CA1CA2CA9CA12CA7 | |
| Ammonia Solution, Strong SCHEMBL28108606 | 0.88 | CA2 (0.45) | CA1CA2CA9CA12CA7 | |
| SCHEMBL11626216 | 0.87 | CA2 (0.47) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8769302 | 0.84 | CA1 (0.35) | CA1CA2 | |
| SCHEMBL9047624 | 0.84 | CA1 (0.39) | CA1CA2CA9CA12CA7 | |
| SCHEMBL576013 | 0.83 | CA2 (0.51) | CA1CA2CA9CA12CA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0792255-A1 | LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1997-09-03 | — | — | EP | disclosed |