Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | KLK7 | P49862 | 2/20 | 0.36 |
| ▸ | TSPO | P30536 | 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 | |
|---|---|---|---|---|
| SCHEMBL28896301 | 0.79 | HTT (0.40) | ALDH1A1HTTSMN1; SMN2TDP1KMT2A | |
| SCHEMBL28896669 | 0.78 | HTT (0.37) | ALDH1A1HTTSMN1; SMN2TDP1KMT2A | |
| SCHEMBL28896372 | 0.76 | ALDH1A1 (0.36) | ALDH1A1HTTSMN1; SMN2TDP1KMT2A | |
| SCHEMBL28896189 | 0.73 | HTT (0.42) | ALDH1A1HTTSMN1; SMN2TDP1KMT2A | |
| SCHEMBL11084824 | 0.66 | KMT2A (0.50) | ALDH1A1HTTSMN1; SMN2KMT2AGAA | |
| SCHEMBL22100485 | 0.66 | TBXAS1 (0.46) | ALDH1A1HTTSMN1; SMN2TDP1KMT2A | |
| SCHEMBL30622744 | 0.66 | ALDH1A1 (0.51) | ALDH1A1HTTSMN1; SMN2TDP1KMT2A | |
| SCHEMBL435444 | 0.65 | GAA (0.68) | ALDH1A1SMN1; SMN2TDP1KMT2AGAA | |
| SCHEMBL924496 | 0.65 | KMT2A (0.63) | ALDH1A1HTTTDP1KMT2AGAA | |
| SCHEMBL20574911 | 0.65 | ALDH1A1 (0.50) | ALDH1A1HTTSMN1; SMN2TDP1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115403584-B | 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115403584-A | 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-11-29 | — | — | CN | disclosed |