Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CHKA | P35790 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | MET | P08581 | 3/20 | 0.46 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL11833 | 0.80 | ALDH1A1 (0.58) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL17888442 | 0.79 | ALDH1A1 (0.53) | ALDH1A1NPC1POLBRAB9AHTT | |
| Ammonia Solution, Strong SCHEMBL28864729 | 0.79 | ALDH1A1 (0.56) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL18583568 | 0.78 | ALDH1A1 (0.51) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL5528688 | 0.77 | ALDH1A1 (0.55) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL29903898 | 0.77 | ALDH1A1 (0.55) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL4375850 | 0.77 | NPC1 (0.57) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL19338490 | 0.77 | NPC1 (0.57) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL507149 | 0.77 | ALDH1A1 (0.58) | ALDH1A1NPC1POLBRAB9AHTT | |
| SCHEMBL21169605 | 0.77 | NPC1 (0.57) | ALDH1A1NPC1POLBRAB9AHTT |
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-118359656-A | Copper-catalyzed stannization reaction method for carbon-oxygen bond cleavage of aryl methanol | 天津师范大学 | 2024-07-19 | — | — | CN | disclosed |