Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 14/20 | 0.45 |
| ▸ | CA2 | P00918 | 14/20 | 0.45 |
| ▸ | CA9 | Q16790 | 12/20 | 0.45 |
| ▸ | CA12 | O43570 | 11/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL20169264 | 0.81 | CA1 (0.65) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL13589509 | 0.78 | TDP1 (0.48) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL39430 | 0.78 | TDP1 (0.72) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL14509390 | 0.76 | ALDH1A1 (0.53) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL13588732 | 0.72 | TDP1 (0.46) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL8761539 | 0.72 | TDP1 (0.46) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL475453 | 0.72 | TDP1 (0.56) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL22648282 | 0.72 | TDP1 (0.56) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL9934007 | 0.71 | TDP1 (0.81) | TDP1ALDH1A1CYP3A4THRBALOX15 | |
| SCHEMBL8431367 | 0.70 | TDP1 (0.54) | TDP1ALDH1A1CYP3A4THRBALOX15 |
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-2022213193-A1 | COMPOSITIONS AND METHODS FOR REMOVING BORON FROM AQUEOUS SOLUTIONS | CARBONET NANOTECHNOLOGIES INC. (CA) | 2022-10-13 | — | — | WO | disclosed |