Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.63 |
| ▸ | CTSB | P07858 | 1/20 | 0.63 |
| ▸ | BACE1 | P56817 | 1/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.57 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.54 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.54 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.54 |
| ▸ | JUN | P05412 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | LY96 | Q9Y6Y9 | 1/20 | 0.53 |
| ▸ | APP | P05067 | 1/20 | 0.53 |
| ▸ | F3 | P13726 | 1/20 | 0.52 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28838351 | 0.86 | F3 (0.71) | MAPTKMT2ACAPN1CTSBBACE1 | |
| SCHEMBL29575068 | 0.85 | TNFRSF1A (0.74) | MAPTALDH1A1MEN1KMT2ACTSB | |
| SCHEMBL28838374 | 0.84 | GSK3B (0.59) | MAPTALDH1A1MEN1KMT2AHDAC8 | |
| SCHEMBL28360809 | 0.83 | CAPN1 (0.85) | MAPTALDH1A1MEN1KMT2ACAPN1 | |
| SCHEMBL5598355 | 0.82 | MAPT (1.00) | MAPTALDH1A1MEN1KMT2ACAPN1 | |
| SCHEMBL5598357 | 0.82 | MAPT (1.00) | MAPTALDH1A1MEN1KMT2ACAPN1 | |
| SCHEMBL18508908 | 0.79 | MAPT (0.81) | MAPTALDH1A1MEN1KMT2ACAPN1 | |
| SCHEMBL28838354 | 0.79 | PPARA (0.56) | MAPTKMT2ABACE1JUNF3 | |
| SCHEMBL28838365 | 0.78 | MAPT (0.50) | MAPTALDH1A1MEN1KMT2ACAPN1 | |
| SCHEMBL28838357 | 0.77 | MAOB (0.55) | MAPTALDH1A1MEN1KMT2ABACE1 |
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-109721559-B | 1, 4-pentadiene-3-ketone derivative containing thioether triazole, preparation method and application | 贵州大学 | 2022-02-15 | — | — | CN | disclosed |