Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.36 |
| ▸ | PON1 | P27169 | 1/20 | 0.36 |
| ▸ | GAK | O14976 | 1/20 | 0.36 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.36 |
| ▸ | COQ8A | Q8NI60 | 1/20 | 0.36 |
| ▸ | NLK | Q9UBE8 | 1/20 | 0.36 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23450954 | 1.00 | AKR1C3 (0.40) | AKR1C3AKR1C2SLC2A1HTTEPHX2 | |
| SCHEMBL24509571 | 0.92 | AKR1C3 (0.37) | AKR1C3AKR1C2HTTEPHX2MEN1 | |
| SCHEMBL23447235 | 0.86 | CSNK1D (0.37) | AKR1C3AKR1C2HTTEPHX2MAPT | |
| SCHEMBL21307811 | 0.86 | ALDH1A1 (0.42) | AKR1C3AKR1C2HTTEPHX2MEN1 | |
| SCHEMBL29911045 | 0.86 | CSNK1D (0.37) | AKR1C3AKR1C2HTTEPHX2MAPT | |
| SCHEMBL24779288 | 0.83 | RAPGEF4 (0.37) | HTTMAPTALDH1A1CSNK1DPON1 | |
| SCHEMBL23442562 | 0.80 | AKR1C3 (0.35) | AKR1C3AKR1C2SLC2A1MEN1KMT2A | |
| SCHEMBL30679840 | 0.78 | NPC1 (0.36) | HTTMEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL28700964 | 0.78 | NPC1 (0.36) | HTTMEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL28194326 | 0.75 | AKR1C3 (0.49) | AKR1C3AKR1C2SLC2A1MAPTALDH1A1 |
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-113795497-B | Compound and organic light emitting device comprising the same | 株式会社LG化学 | 2024-04-26 | — | — | CN | disclosed |