Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 15/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6800337 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MAPK1FFAR1MTNR1ATDP1 | |
| SCHEMBL30640308 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MAPK1FFAR1MTNR1ATDP1 | |
| SCHEMBL6794906 | 0.89 | MTNR1A (0.49) | ALDH1A1MAPK1FFAR1MTNR1A | |
| SCHEMBL30278166 | 0.88 | MTNR1A (0.51) | ALDH1A1MAPK1FFAR1MTNR1AALOX5 | |
| SCHEMBL24735866 | 0.88 | MTNR1A (0.51) | ALDH1A1MAPK1FFAR1MTNR1AALOX5 | |
| SCHEMBL5917897 | 0.85 | ALDH1A1 (0.53) | ALDH1A1MAPK1MTNR1ATDP1ALOX5 | |
| SCHEMBL5992714 | 0.84 | KDM4E (0.48) | ALDH1A1MAPK1MTNR1AALOX5 | |
| SCHEMBL5918015 | 0.83 | F2 (0.55) | FFAR1ALOX5 | |
| SCHEMBL5917872 | 0.83 | F2 (0.55) | FFAR1ALOX5 | |
| SCHEMBL16070939 | 0.83 | HPGD (0.47) | ALDH1A1MAPK1FFAR1MTNR1AALOX5 |
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-112079830-B | Inhibitor containing fused ring derivative, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-12-22 | — | — | CN | disclosed |