Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 4/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL1846060 | 1.00 | CES1 (0.38) | CES1SRCMAPK1ALDH1A1TDP1 | |
| SCHEMBL1846320 | 1.00 | CES1 (0.38) | CES1SRCMAPK1ALDH1A1TDP1 | |
| Bromide SCHEMBL21753647 | 0.98 | CES1 (0.37) | CES1SRCMAPK1ALDH1A1TDP1 | |
| Bromide SCHEMBL30007543 | 0.98 | CES1 (0.37) | CES1SRCMAPK1ALDH1A1TDP1 | |
| SCHEMBL1843233 | 0.75 | CES1 (0.38) | CES1SRCMAPK1ALDH1A1TDP1 | |
| SCHEMBL1845079 | 0.75 | CES1 (0.38) | CES1SRCMAPK1ALDH1A1TDP1 | |
| SCHEMBL27700743 | 0.75 | CES1 (0.38) | CES1SRCMAPK1ALDH1A1TDP1 | |
| SCHEMBL8071585 | 0.74 | CES1 (0.47) | CES1SRCMAPK1ALDH1A1TDP1 | |
| SCHEMBL30006971 | 0.72 | SRC (0.54) | CES1SRCMAPK1ALDH1A1TDP1 | |
| SCHEMBL21753643 | 0.72 | SRC (0.54) | CES1SRCMAPK1ALDH1A1TDP1 |
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-110198950-B | Novel ergosterol glycoside derivatives | ST制药株式会社 | 2022-06-14 | — | — | CN | disclosed |