Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9277553 | 0.85 | CA1 (0.52) | CA1CA2CA9CA7MEN1 | |
| SCHEMBL14414887 | 0.83 | CA1 (0.50) | CA1CA2CA9CA7MEN1 | |
| SCHEMBL673256 | 0.83 | — | — | |
| SCHEMBL12386619 | 0.82 | CA1 (0.41) | CA1CA2CA9CA7MEN1 | |
| SCHEMBL8701872 | 0.81 | — | — | |
| SCHEMBL11574845 | 0.79 | — | — | |
| SCHEMBL8518064 | 0.79 | CA1 (0.46) | CA1CA2CA9CA7MEN1 | |
| SCHEMBL1100143 | 0.79 | — | — | |
| SCHEMBL14150082 | 0.79 | CA1 (0.46) | CA1CA2CA9CA7MEN1 | |
| SCHEMBL13177507 | 0.79 | — | — |
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-9850226-B2 | Lithium-selective crown ether, lithium adsorbent using same, and preparation method thereof | MYONGJI UNIVERSITY INDUSTRY AND ACADEMIA COOPERTAION FOUNDATION (KR) | 2017-12-26 | — | — | US | disclosed |