Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | STAT1 | P42224 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | DGKA | P23743 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17057 | 0.89 | ALDH1A1 (0.56) | HCAR2ALDH1A1ATMLMNATSHR | |
| SCHEMBL6934821 | 0.86 | ALDH1A1 (0.53) | HCAR2ALDH1A1ATMLMNATSHR | |
| Fluoride SCHEMBL29068323 | 0.86 | ALDH1A1 (0.53) | HCAR2ALDH1A1ATMLMNATSHR | |
| SCHEMBL13465919 | 0.86 | ALDH1A1 (0.53) | HCAR2ALDH1A1ATMLMNATSHR | |
| Hydrogen Peroxide SCHEMBL28922349 | 0.86 | ALDH1A1 (0.53) | HCAR2ALDH1A1ATMLMNATSHR | |
| Ethane SCHEMBL28190088 | 0.86 | ALDH1A1 (0.53) | HCAR2ALDH1A1ATMLMNATSHR | |
| Formic Acid Methyl Ester SCHEMBL28088359 | 0.85 | HCAR2 (0.43) | HCAR2ALDH1A1ATMLMNATSHR | |
| Acetic Acid Propyl Ester SCHEMBL17825897 | 0.84 | ALDH1A1 (0.61) | HCAR2ALDH1A1ATMLMNATSHR | |
| Ethyne SCHEMBL165176 | 0.83 | ALDH1A1 (0.50) | HCAR2ALDH1A1ATMLMNATSHR | |
| Bicarbonate SCHEMBL278365 | 0.83 | ALDH1A1 (0.50) | HCAR2ALDH1A1ATMLMNATSHR |
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-103296268-B | Active material for non-aqueous electrolyte secondary batteries and manufacture method, the electrode using it and battery | 株式会社杰士汤浅国际 | 2016-12-28 | — | — | CN | disclosed |