Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 3/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | MPI | P34949 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14396721 | 0.88 | SRC (0.50) | SRCTRPA1ALDH1A1MAPTKDM4E | |
| SCHEMBL31747007 | 0.79 | ATM (0.46) | ATMTRPA1ALDH1A1MAPTKDM4E | |
| SCHEMBL27108052 | 0.79 | ATM (0.46) | ATMTRPA1ALDH1A1MAPTKDM4E | |
| SCHEMBL13550677 | 0.79 | ATM (0.46) | ATMTRPA1ALDH1A1MAPTKDM4E | |
| SCHEMBL19880486 | 0.78 | NPSR1 (0.49) | SRCALDH1A1MAPTKDM4EPOLB | |
| SCHEMBL21883711 | 0.78 | ACHE (0.40) | SRCALDH1A1MAPTPOLBRECQL | |
| SCHEMBL19594037 | 0.78 | ALDH1A1 (0.40) | SRCALDH1A1MAPTRETGAA | |
| SCHEMBL19880559 | 0.74 | TSHR (0.46) | SRCALDH1A1MAPTKDM4EPOLB | |
| SCHEMBL6073256 | 0.72 | POLB (0.62) | SRCALDH1A1MAPTKDM4EPOLB | |
| SCHEMBL10903092 | 0.71 | SRC (0.46) | SRCALDH1A1MAPTKDM4ERET |
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-108473408-A | Ascochlorin derivative and its purposes as AMPK activator | NRL制药股份有限公司 | 2018-08-31 | — | — | CN | disclosed |