Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | RECQL | P46063 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL28026131 | 0.92 | CES2 (0.58) | CES2CES1PTPN1ALDH1A1ERCC5 | |
| Hydrocinnamyl Alcohol SCHEMBL27945830 | 0.89 | SMN1; SMN2 (0.53) | CES2CES1PTPN1ALDH1A1ERCC5 | |
| SCHEMBL24446 | 0.87 | — | — | |
| SCHEMBL3811314 | 0.87 | CES2 (0.68) | CES2CES1PTPN1ALDH1A1ERCC5 | |
| Octacosanol SCHEMBL5935751 | 0.86 | GAA (0.50) | CES2CES1PTPN1ALDH1A1ERCC5 | |
| Alcohol SCHEMBL28296602 | 0.86 | CES2 (0.56) | CES2CES1PTPN1ALDH1A1ERCC5 | |
| SCHEMBL25196785 | 0.85 | — | — | |
| SCHEMBL9580893 | 0.85 | CES2 (0.65) | CES2CES1PTPN1ALDH1A1ERCC5 | |
| Ammonia Solution, Strong SCHEMBL6719610 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL753936 | 0.85 | — | — |
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-107206673-B | Soluble material for three-dimensional modeling | 花王株式会社 | 2020-01-14 | — | — | CN | disclosed |