Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31323999 | 0.99 | ALDH1A1 (0.37) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL31323942 | 0.88 | ALDH1A1 (0.41) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL8966675 | 0.85 | SPHK1 (0.40) | ALDH1A1LMNAHTT | |
| SCHEMBL8966271 | 0.85 | SPHK1 (0.40) | ALDH1A1LMNAHTT | |
| SCHEMBL31323960 | 0.84 | ALDH1A1 (0.46) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL31323967 | 0.84 | ALDH1A1 (0.37) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL31323900 | 0.84 | ALDH1A1 (0.43) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL31323935 | 0.83 | ALDH1A1 (0.41) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL31323952 | 0.83 | ALDH1A1 (0.36) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL31323902 | 0.82 | TAAR1 (0.44) | ALDH1A1LMNAHTTMAPTNPC1 |
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-119285568-A | Preparation and application of isoxazoline disulfide derivative | 安徽农业大学 | 2025-01-10 | — | — | CN | disclosed |