Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | SCN1A | P35498 | 1/20 | 0.46 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.46 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CASR | P41180 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ACP3 | P15309 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ASPH | Q12797 | 1/20 | 0.41 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17530034 | 1.00 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL28544725 | 1.00 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL5349302 | 0.90 | SLC6A2 (0.48) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL21836248 | 0.87 | SLC6A2 (0.53) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL21836246 | 0.87 | SLC6A2 (0.53) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL20483229 | 0.84 | SLC10A1 (0.48) | SLC6A3ALDH1A1POLBACP3KDM4E | |
| SCHEMBL20483230 | 0.84 | SLC10A1 (0.48) | SLC6A3ALDH1A1POLBACP3KDM4E | |
| SCHEMBL20851536 | 0.84 | SLC10A1 (0.48) | SLC6A3ALDH1A1POLBACP3KDM4E | |
| SCHEMBL20840520 | 0.84 | SLC10A1 (0.48) | SLC6A3ALDH1A1POLBACP3KDM4E | |
| SCHEMBL12259279 | 0.82 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A |
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-108440307-B | Preparation method of chiral amine compound | 浙江工业大学 | 2020-11-17 | — | — | CN | claimed |