Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28993126 | 0.81 | CYP1A2 (0.54) | TDP1MAPTCES1CES2CYP1A2 | |
| SCHEMBL28993105 | 0.77 | NPC1 (0.44) | MEN1KMT2AMAPTCES1CYP1A2 | |
| SCHEMBL16147513 | 0.77 | PTPN1 (0.53) | MEN1KMT2ATDP1PTPN1MAPT | |
| SCHEMBL28993094 | 0.76 | CES1 (0.53) | MEN1KMT2ATDP1MAPTCES1 | |
| SCHEMBL7861321 | 0.73 | PTPN1 (0.47) | MEN1KMT2ATDP1PTPN1MAPT | |
| SCHEMBL29941124 | 0.73 | PTPN1 (0.47) | MEN1KMT2ATDP1PTPN1MAPT | |
| SCHEMBL29226433 | 0.73 | PTPN1 (0.47) | MEN1KMT2ATDP1PTPN1MAPT | |
| SCHEMBL4678770 | 0.70 | PTPN1 (0.49) | KMT2APTPN1MAPTCES1CES2 | |
| SCHEMBL9719820 | 0.70 | PTPN1 (0.49) | MEN1KMT2ATDP1PTPN1MAPT | |
| SCHEMBL11587470 | 0.69 | PTPN1 (0.50) | TDP1PTPN1CES1CES2CYP1A2 |
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-116023202-A | Synthetic method of alpha-chlorarone derivative | 西南大学 | 2023-04-28 | — | — | CN | disclosed |