Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8072854 | 0.81 | CFD (0.47) | ALDH1A1HPGDPOLBMAPTRECQL | |
| SCHEMBL28781871 | 0.81 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL28455228 | 0.79 | ALOX15 (0.47) | HPGDPOLBMAPTGAAMEN1 | |
| SCHEMBL14448664 | 0.79 | HPGD (0.47) | ALDH1A1HPGDPOLBMAPTRECQL | |
| SCHEMBL27747876 | 0.78 | KMT2A (0.38) | HPGDMEN1KMT2ANPC1RAB9A | |
| SCHEMBL27689177 | 0.78 | DGAT1 (0.50) | ALDH1A1HPGDMAPTGAAMEN1 | |
| SCHEMBL28096890 | 0.76 | MAPT (0.47) | ALDH1A1HPGDMAPTGAAMEN1 | |
| SCHEMBL28426175 | 0.76 | ALOX15 (0.43) | ALDH1A1HPGDMAPTGAAMEN1 | |
| SCHEMBL5197975 | 0.74 | DGAT1 (0.55) | ALDH1A1HPGDPOLBMAPTGAA | |
| SCHEMBL6649495 | 0.74 | KMT2A (0.38) | ALDH1A1MEN1KMT2ASMN1; SMN2TSHR |
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 |