Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ASIC3 | Q9UHC3 | 2/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29159293 | 0.87 | MAPT (0.39) | MAPTPTPN1CYP3A4ASIC3KDM4E | |
| SCHEMBL29159290 | 0.85 | MAPT (0.53) | MAPTCYP3A4KDM4EALDH1A1KMT2A | |
| SCHEMBL30778221 | 0.82 | MAPT (0.48) | MAPTCYP3A4CYP2D6KCNH2KIF11 | |
| SCHEMBL30778253 | 0.82 | MAPT (0.47) | MAPT | |
| SCHEMBL30778209 | 0.82 | MAPT (0.47) | MAPTKIF11KDM4EMEN1ALDH1A1 | |
| SCHEMBL29159304 | 0.82 | MAPT (0.47) | MAPTKIF11ALDH1A1 | |
| SCHEMBL30778246 | 0.82 | MAPT (0.47) | MAPTMEN1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL30778219 | 0.82 | MAPT (0.54) | MAPTCYP3A4CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL30778216 | 0.81 | MAPT (0.47) | MAPTCYP3A4KCNH2KIF11KDM4E | |
| SCHEMBL30778243 | 0.79 | MAPT (0.44) | MAPTCYP3A4CYP2D6KCNH2KIF11 |
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-117603027-A | Olefin difunctional method and delta-trifluoromethyl ketone product prepared by same | 重庆理工大学 | 2024-02-27 | — | — | CN | disclosed |