Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | PLK1 | P53350 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | BCL9 | O00512 | 2/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | FABP3 | P05413 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28669959 | 0.75 | MEN1 (0.42) | ALDH1A1CYP3A4MAPTTSHRRECQL | |
| SCHEMBL28654877 | 0.74 | ADORA3 (0.52) | ALDH1A1CYP3A4HPGDMAPTTSHR | |
| SCHEMBL31065460 | 0.74 | ALDH1A1 (0.68) | ALDH1A1CYP3A4ACHEPLK1BACE1 | |
| SCHEMBL28668792 | 0.73 | MEN1 (0.42) | HTTRECQLBCL9CTNNB1GPR35 | |
| Gnaphaliin B SCHEMBL27695868 | 0.72 | ALDH1A1 (0.69) | ALDH1A1CYP3A4ACHEPLK1BACE1 | |
| SCHEMBL28668413 | 0.69 | MEN1 (0.47) | ALDH1A1CYP3A4ACHEHPGDMAPT | |
| SCHEMBL27687571 | 0.69 | FABP3 (0.58) | ALDH1A1HPGDMAPTHTTRECQL | |
| SCHEMBL7273539 | 0.69 | MAPT (0.60) | ALDH1A1HPGDMAPTHTTRECQL | |
| SCHEMBL737207 | 0.69 | ADORA3 (0.58) | ALDH1A1CYP3A4HPGDMAPTTSHR | |
| 2-Methyl-5,7,8-Trimethoxyisoflavone SCHEMBL4283593 | 0.69 | ALDH1A1 (1.00) | ALDH1A1CYP3A4ACHEPLK1BACE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113754619-B | Method for preparing polysubstituted benzofuran-4-formic acid compound under catalysis of ruthenium | 广州大学 | 2022-12-20 | — | — | CN | disclosed |
| CN-113754619-A | Method for preparing polysubstituted benzofuran-4-formic acid compound under catalysis of ruthenium | 广州大学 | 2021-12-07 | — | — | CN | disclosed |