Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.31 |
| ▸ | ACHE | P22303 | 2/20 | 0.31 |
| ▸ | CES1 | P23141 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL304056 | 0.83 | ALDH1A1 (0.47) | ALDH1A1TSHRNPSR1GLO1CES2 | |
| SCHEMBL27576280 | 0.78 | NPSR1 (0.39) | ALDH1A1TSHRNPSR1GLO1CES2 | |
| SCHEMBL12563242 | 0.75 | FAAH (0.40) | ALDH1A1NPSR1GLO1CES2ACHE | |
| SCHEMBL27648818 | 0.74 | GLO1 (0.47) | ALDH1A1TSHRNPSR1GLO1CES2 | |
| SCHEMBL5644945 | 0.74 | GLO1 (0.47) | ALDH1A1TSHRNPSR1GLO1CES2 | |
| SCHEMBL12555533 | 0.73 | NPSR1 (0.40) | ALDH1A1TSHRNPSR1GLO1CES2 | |
| SCHEMBL22334509 | 0.73 | NPSR1 (0.38) | ALDH1A1TSHRNPSR1GLO1CES2 | |
| SCHEMBL28569623 | 0.72 | FAAH (0.45) | NPSR1CES2CES1 | |
| SCHEMBL23608441 | 0.72 | NPSR1 (0.41) | ALDH1A1TSHRNPSR1GLO1CES2 | |
| SCHEMBL1761289 | 0.72 | CYP3A4 (0.37) | ALDH1A1TSHRNPSR1MAPT |
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-10312546-B2 | Non-aqueous liquid electrolyte for secondary battery and secondary battery | FUJIFILM CORPORATION (JP) | 2019-06-04 | — | — | US | disclosed |