Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 12/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20025698 | 1.00 | SLC6A4 (0.61) | SLC6A4ALDH1A1USP2GAAPKM | |
| SCHEMBL943047 | 0.84 | ALDH1A1 (0.47) | SLC6A4ALDH1A1USP2GAAPKM | |
| SCHEMBL20621635 | 0.83 | SLC6A4 (0.52) | SLC6A4MAOASLC6A2SLC6A3 | |
| SCHEMBL598140 | 0.83 | ALDH1A1 (0.52) | ALDH1A1USP2GAAPKMHPGD | |
| SCHEMBL24032674 | 0.80 | SLC6A4 (0.48) | SLC6A4ALDH1A1MAOASLC6A2SLC6A3 | |
| SCHEMBL1104208 | 0.80 | SLC6A4 (0.50) | SLC6A4ALDH1A1USP2GAAPKM | |
| SCHEMBL2021510 | 0.80 | ALDH1A1 (0.44) | SLC6A4ALDH1A1USP2GAAPKM | |
| SCHEMBL12201107 | 0.80 | ALDH1A1 (0.44) | SLC6A4ALDH1A1USP2GAAPKM | |
| SCHEMBL20032404 | 0.79 | SLC6A4 (0.63) | SLC6A4MAOASLC6A2SLC6A3 | |
| SCHEMBL23516454 | 0.78 | SLC6A4 (0.47) | SLC6A4ALDH1A1MAOASLC6A2SLC6A3 |
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-112851479-B | Method for preparing chiral alkyl compound by catalyzing asymmetric hydrogenation reaction of olefin with iron complex catalyst | 浙江大学 | 2022-05-13 | — | — | CN | disclosed |