Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | ACP3 | P15309 | 1/20 | 0.41 |
| ▸ | USP1 | O94782 | 1/20 | 0.40 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14393517 | 1.00 | CYP26A1 (0.46) | CYP26A1HSD17B10ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL4597982 | 0.89 | CYP26A1 (0.50) | CYP26A1RIPK1AURKACDK2ROCK2 | |
| SCHEMBL23961270 | 0.86 | GPR139 (0.49) | CYP26A1HSD17B10RIPK1AURKACDK2 | |
| SCHEMBL29675785 | 0.84 | CYP26A1 (0.47) | CYP26A1ALDH1A1RIPK1AURKACDK2 | |
| SCHEMBL14338245 | 0.84 | KCNA5 (0.46) | CYP26A1RIPK1AURKACDK2ROCK2 | |
| SCHEMBL18765697 | 0.84 | CYP26A1 (0.47) | CYP26A1ALDH1A1RIPK1AURKACDK2 | |
| SCHEMBL14393701 | 0.84 | MAPK1 (0.47) | PAX8MAPK1 | |
| SCHEMBL29751805 | 0.84 | MAPK1 (0.47) | PAX8MAPK1 | |
| SCHEMBL14393694 | 0.83 | ROCK1 (0.52) | CYP26A1ROCK2MAPK1 | |
| SCHEMBL14393867 | 0.83 | ROCK1 (0.52) | CYP26A1ROCK2MAPK1 |
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-114948963-A | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-08-30 | — | — | CN | disclosed |