Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 3/20 | 0.37 |
| ▸ | CES1 | P23141 | 3/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| 1-Hexanol SCHEMBL27724844 | 1.00 | ALDH1A1 (0.62) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| Octanol SCHEMBL28214972 | 1.00 | ALDH1A1 (0.62) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| Dodecanol SCHEMBL27568671 | 1.00 | ALDH1A1 (0.62) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| Myristyl Alcohol SCHEMBL28576750 | 1.00 | ALDH1A1 (0.62) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| Dodecanol SCHEMBL28093446 | 0.98 | ALDH1A1 (0.59) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| 1-Hexanol SCHEMBL28211210 | 0.98 | ALDH1A1 (0.59) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| Decanol SCHEMBL28267432 | 0.98 | ALDH1A1 (0.59) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| Octanol SCHEMBL28211750 | 0.98 | ALDH1A1 (0.59) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| 1-Pentanol SCHEMBL969990 | 0.98 | SMN1; SMN2 (0.60) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| 1-Pentanol SCHEMBL27286273 | 0.95 | SMN1; SMN2 (0.57) | ALDH1A1LMNAMEN1KMT2ATSHR |
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-109415309-A | Sulfonate compound and its utilization | 日产化学株式会社 | 2019-03-01 | — | — | CN | disclosed |