Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL28896262 | 0.88 | ATR (0.44) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL28896549 | 0.86 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL28896192 | 0.84 | KDM4E (0.39) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL28896248 | 0.81 | IGF1R (0.41) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL28896296 | 0.80 | KDM4E (0.37) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL28896497 | 0.80 | GRM1 (0.36) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL8183536 | 0.76 | CYP1A2 (0.43) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL8183538 | 0.76 | ALOX15 (0.38) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL18209663 | 0.74 | PDE4D (0.45) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL4393322 | 0.73 | KDM4E (0.41) | KDM4EALDH1A1HPGDLMNAHTT |
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 |