Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.35 |
| ▸ | CES1 | P23141 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 7/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.34 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL28664047 | 0.91 | EPHX1 (0.41) | CES2CES1ALDH1A1EPHX1 | |
| SCHEMBL28659058 | 0.84 | AKR1B1 (0.36) | CES2CES1ALDH1A1ACHEEPHX1 | |
| SCHEMBL476046 | 0.84 | ALDH1A1 (0.43) | CES2CES1ALDH1A1ACHEEPHX1 | |
| SCHEMBL570531 | 0.82 | NAAA (0.42) | CES2CES1ALDH1A1ACHEEPHX1 | |
| SCHEMBL3698413 | 0.82 | ALOX15 (0.36) | CES2CES1ALDH1A1ACHEEPHX1 | |
| SCHEMBL476045 | 0.82 | LMNA (0.33) | CES2CES1ALDH1A1ACHEEPHX1 | |
| SCHEMBL6545806 | 0.82 | TSHR (0.39) | CES2CES1ALDH1A1AKR1B1 | |
| SCHEMBL16004899 | 0.80 | EPHX1 (0.31) | CES2CES1ALDH1A1ACHEEPHX1 | |
| SCHEMBL2599070 | 0.80 | ALDH1A1 (0.44) | CES2CES1ALDH1A1AKR1B1 | |
| SCHEMBL6546145 | 0.80 | TSHR (0.44) | CES2CES1ALDH1A1ATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-113795963-A | Carbonate solvents for non-aqueous electrolytes for metal and metal ion batteries | 斯塞法国公司 | 2021-12-14 | — | — | CN | disclosed |