Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.57 |
| ▸ | HPGD | P15428 | 7/20 | 0.57 |
| ▸ | MEN1 | O00255 | 5/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2198474 | 1.00 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL13725598 | 0.91 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| Benzoquinone SCHEMBL14716541 | 0.89 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL5092242 | 0.83 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL24330025 | 0.81 | PNMT (0.45) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL29583068 | 0.81 | PNMT (0.45) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL5090657 | 0.81 | HSP90AA1 (0.42) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL13727049 | 0.79 | TYMS (0.66) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL10615264 | 0.78 | KDM4E (0.40) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10615296 | 0.77 | KDM4E (0.39) | ALDH1A1KDM4EHPGDMEN1KMT2A |
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-115108921-A | Acenaphthene derivative and application thereof | 北京八亿时空液晶科技股份有限公司 | 2022-09-27 | — | — | CN | disclosed |