Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.63 |
| ▸ | FEN1 | P39748 | 1/20 | 0.63 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.57 |
| ▸ | HPGD | P15428 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.56 |
| ▸ | BCHE | P06276 | 1/20 | 0.56 |
| ▸ | CES1 | P23141 | 1/20 | 0.56 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL27752410 | 0.79 | ERCC1 (0.65) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL28782585 | 0.78 | ERCC1 (0.59) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL29578831 | 0.78 | MEN1 (0.50) | ALDH1A1KDM4EHSD17B10HPGDMEN1 | |
| SCHEMBL1425875 | 0.78 | MEN1 (0.50) | ALDH1A1KDM4EHSD17B10HPGDMEN1 | |
| SCHEMBL24453236 | 0.77 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL29410043 | 0.77 | ERCC1 (1.00) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL21099252 | 0.77 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL862546 | 0.77 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL4604913 | 0.77 | MPO (0.70) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL6734026 | 0.77 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E |
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-114702509-B | Benzothiophene naphthalimide derivative and synthesis process and application thereof | 浙江工业大学 | 2023-07-25 | — | — | CN | disclosed |