Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.68 |
| ▸ | PKM | P14618 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | GAA | P10253 | 3/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | GSR | P00390 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31448409 | 0.82 | MAPT (0.71) | MAPTPKMKDM4EALDH1A1GAA | |
| SCHEMBL7817360 | 0.81 | CYP3A4 (0.62) | MAPTPKMKDM4EALDH1A1GAA | |
| SCHEMBL19448879 | 0.81 | MAPT (1.00) | MAPTPKMKDM4EALDH1A1GAA | |
| SCHEMBL14006985 | 0.76 | ALDH1A1 (1.00) | MAPTPKMKDM4EALDH1A1GAA | |
| SCHEMBL7815250 | 0.74 | MAPT (0.54) | MAPTPKMKDM4EALDH1A1GAA | |
| SCHEMBL30139977 | 0.74 | KDM4E (0.82) | MAPTPKMKDM4EALDH1A1GAA | |
| SCHEMBL28516529 | 0.74 | KDM4E (0.82) | MAPTPKMKDM4EALDH1A1GAA | |
| SCHEMBL6341548 | 0.73 | ALDH1A1 (0.57) | MAPTKDM4EALDH1A1HPGDMEN1 | |
| SCHEMBL24104967 | 0.73 | GSR (0.40) | MAPTKDM4EALDH1A1HPGDGSR | |
| SCHEMBL20816334 | 0.73 | RAD51 (0.55) | MAPTKDM4EALDH1A1HPGDMEN1 |
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-113956208-A | Aryl heterocyclic derivative and synthetic method thereof | 郑州大学 | 2022-01-21 | — | — | CN | disclosed |