Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28896549 | 0.83 | KDM4E (0.40) | KDM4EALDH1A1HPGDMAPTNPSR1 | |
| SCHEMBL28896192 | 0.81 | KDM4E (0.39) | KDM4EALDH1A1HPGDMAPTNPSR1 | |
| SCHEMBL28896742 | 0.80 | KDM4E (0.42) | KDM4EALDH1A1HPGDMAPTNPSR1 | |
| SCHEMBL28896248 | 0.79 | IGF1R (0.41) | KDM4EALDH1A1HPGDMAPTNPSR1 | |
| SCHEMBL28896296 | 0.77 | KDM4E (0.37) | KDM4EALDH1A1HPGDMAPTNPSR1 | |
| SCHEMBL23234046 | 0.73 | GRM1 (0.43) | GRM1KDM4EALDH1A1HPGDNPSR1 | |
| SCHEMBL2573280 | 0.73 | GRM1 (0.43) | GRM1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL28896239 | 0.73 | TSHR (0.40) | GRM1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9096971 | 0.72 | MAPK8 (0.59) | KDM4EALDH1A1HPGDMAPTNPSR1 | |
| SCHEMBL14875387 | 0.71 | NPSR1 (0.46) | KDM4EALDH1A1HPGDMAPTNPSR1 |
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 |