Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 7/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3840461 | 0.82 | ALDH1A1 (0.48) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL1208635 | 0.75 | ALDH1A1 (0.50) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL29790427 | 0.75 | HTR1B (0.46) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL194724 | 0.75 | HTR1B (0.46) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL29405949 | 0.75 | ALDH1A1 (0.50) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL4918884 | 0.73 | ALDH1A1 (0.49) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL28694633 | 0.73 | ALDH1A1 (0.49) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL28698285 | 0.73 | ALDH1A1 (0.49) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| SCHEMBL4438136 | 0.72 | CA1 (0.32) | GAAHPGD | |
| SCHEMBL21809379 | 0.72 | HPRT1 (0.56) | ALDH1A1HSD17B10PGRGAAPTGS1 |
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-114901646-A | Benzotriazine double oxide and pharmaceutical composition thereof | 杭州瑞臻医药有限公司 | 2022-08-12 | — | — | CN | disclosed |