Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.37 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | BRS3 | P32247 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | CLPP | Q16740 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6907424 | 0.87 | ALDH1A1 (0.42) | ALDH1A1KDM4ELMNAACHESLC6A5 | |
| SCHEMBL2303664 | 0.86 | CLPP (0.44) | ALDH1A1KDM4EHRH3CLPP | |
| SCHEMBL6908503 | 0.84 | ACHE (0.48) | ALDH1A1KDM4EACHEBRS3SLC6A5 | |
| SCHEMBL2347851 | 0.81 | KDM4E (0.48) | ALDH1A1KDM4EHRH3SLC6A5CLPP | |
| SCHEMBL2302234 | 0.80 | AKR1C3 (0.43) | ALDH1A1KDM4EHRH3CLPP | |
| SCHEMBL2304795 | 0.77 | CLPP (0.43) | ALDH1A1KDM4ECLPP | |
| SCHEMBL2336354 | 0.76 | SMN1; SMN2 (0.55) | ALDH1A1KDM4EACHECLPP | |
| SCHEMBL2301297 | 0.75 | ACHE (0.54) | ALDH1A1KDM4EACHESLC6A5CLPP | |
| SCHEMBL2304453 | 0.74 | DRD4 (0.44) | ALDH1A1KDM4EACHECLPP | |
| SCHEMBL6908510 | 0.74 | ACHE (0.46) | ACHESLC6A5CLPP |
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-2011101804-A1 | PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS | GENKYOTEX SA (CH) | 2011-08-25 | — | — | WO | disclosed |