Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | TYR | P14679 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2465881 | 0.77 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TYRCA2TSHR | |
| SCHEMBL29762702 | 0.77 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TYRCA2TSHR | |
| SCHEMBL17594923 | 0.75 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2TYRCA2POLB | |
| SCHEMBL3166363 | 0.73 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2TYRCA2POLB | |
| SCHEMBL381504 | 0.70 | TDP1 (0.46) | ALDH1A1SMN1; SMN2CYP1A2CYP2A6TDP1 | |
| SCHEMBL4457738 | 0.70 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2TYRCA2POLB | |
| SCHEMBL1690352 | 0.70 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2TYRCA2POLB | |
| SCHEMBL21692816 | 0.70 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2TYRCA2POLB | |
| SCHEMBL270433 | 0.70 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2TYRCA2POLB | |
| SCHEMBL4451465 | 0.70 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2TYRCA2POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022059959-A1 | ALDEHYDE PREPARATION METHOD AND ALDEHYDE PREPARATION APPARATUS | 주식회사 엘지화학 | 2022-03-24 | — | — | WO | disclosed |