Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | DGKA | P23743 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL783994 | 0.84 | ALDH1A1 (0.48) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL783759 | 0.84 | NAAA (0.39) | ALDH1A1LMNADGKA | |
| SCHEMBL783576 | 0.77 | ALDH1A1 (0.39) | ALDH1A1CES2LMNATSHR | |
| SCHEMBL784617 | 0.77 | ALDH1A1 (0.50) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL784817 | 0.72 | CES2 (0.36) | ALDH1A1CES2CES1 | |
| SCHEMBL783983 | 0.72 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL10446 | 0.72 | ALDH1A1 (0.55) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL27887514 | 0.72 | ALDH1A1 (0.55) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| Benzene SCHEMBL10578594 | 0.71 | ALDH1A1 (0.48) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL10613652 | 0.71 | DGKA (0.44) | ALDH1A1CES2CES1LMNADGKA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102412416-A | Nonaqueous electrolyte and nonaqueous electrolyte battery | SONY CORP | 2012-04-11 | — | — | CN | disclosed |
| US-20120070730-A1 | NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE BATTERY | SONY CORPORATION (JP) | 2012-03-22 | — | — | US | disclosed |