Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 13/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 10/20 | 0.40 |
| ▸ | HPGD | P15428 | 7/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | MAP2 | P11137 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29062680 | 0.79 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL29062731 | 0.78 | CTSB (0.44) | — | |
| SCHEMBL29062932 | 0.70 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL29613830 | 0.70 | ALDH1A1 (0.56) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL30149138 | 0.69 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL24021128 | 0.66 | MEN1 (0.57) | — | |
| SCHEMBL29063309 | 0.66 | MEN1 (0.57) | — | |
| SCHEMBL30310539 | 0.66 | MEN1 (0.57) | — | |
| SCHEMBL24189144 | 0.63 | KDM4E (0.53) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL24021127 | 0.62 | MEN1 (0.54) | — |
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-116685576-A | Cysteine protease inhibitors and methods of use thereof | 美商帕迪斯生物科学公司 | 2023-09-01 | — | — | CN | disclosed |