Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | DGKA | P23743 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9937991 | 0.89 | ALDH1A1 (0.52) | ALDH1A1TSHRNAAACES2THRB | |
| SCHEMBL197068 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TSHRNAAACES2DGKA | |
| SCHEMBL18938210 | 0.82 | NAAA (0.41) | ALDH1A1TSHRNAAACES2DGKA | |
| SCHEMBL9937395 | 0.81 | TDP1 (0.37) | ALDH1A1TSHRNAAAPOLBDGKA | |
| SCHEMBL9937456 | 0.81 | NAAA (0.59) | ALDH1A1TSHRNAAACES2DGKA | |
| SCHEMBL18927365 | 0.81 | NAAA (0.59) | ALDH1A1NAAACES2DGKARAD52 | |
| SCHEMBL9936776 | 0.81 | CES2 (0.38) | ALDH1A1TSHRNAAACES2THRB | |
| SCHEMBL9937648 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRNAAATHRBPOLB | |
| SCHEMBL123715 | 0.78 | NAAA (0.39) | ALDH1A1TSHRNAAACES2DGKA | |
| SCHEMBL445680 | 0.78 | NAAA (0.59) | ALDH1A1TSHRNAAATHRBPOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2652832-A1 | BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION | Dow Global Technologies LLC (US) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012082760-A1 | BATTERY ELECTROLYTE SOLUTION CONTAINING CERTAIN ESTER-BASED SOLVENTS, AND BATTERIES CONTAINING SUCH AN ELECTROLYTE SOLUTION | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-06-21 | — | — | WO | disclosed |