Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.60 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.60 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | PRKCI | P41743 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | PLK1 | P53350 | 1/20 | 0.30 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.30 |
| ▸ | PLK3 | Q9H4B4 | 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 | |
|---|---|---|---|---|
| SCHEMBL9001526 | 1.00 | ALDH1A1 (0.60) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL10897896 | 1.00 | ALDH1A1 (0.60) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL7768937 | 0.96 | ALDH1A1 (0.56) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL4618953 | 0.96 | TRIM24 (0.57) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL23723124 | 0.92 | ALDH1A1 (0.60) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL7952580 | 0.92 | ALDH1A1 (0.60) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL9246687 | 0.92 | ALDH1A1 (0.60) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL4620698 | 0.92 | ALDH1A1 (0.60) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL4620542 | 0.88 | TRIM24 (0.57) | ALDH1A1TRIM24TRIM33MAOAMAOB | |
| SCHEMBL4620784 | 0.88 | TRIM24 (0.47) | ALDH1A1TRIM24TRIM33MAOAMAOB |
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-2023030319-A1 | OPIOID RECEPTOR AGONIST, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 天地恒一制药股份有限公司 | 2023-03-09 | — | — | WO | disclosed |