Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | 0.80 | KDM4E (0.40) | MAPTNPSR1KDM4E | |
| SCHEMBL28896659 | 0.76 | TSHR (0.45) | MAPTKDM4EMEN1KMT2A | |
| SCHEMBL28896192 | 0.71 | KDM4E (0.39) | MAPTNPSR1KDM4E | |
| SCHEMBL13055393 | 0.71 | TDP1 (0.58) | NPSR1IDO1TDP1CA12CA1 | |
| SCHEMBL28896742 | 0.70 | KDM4E (0.42) | MAPTNPSR1KDM4EMEN1KMT2A | |
| SCHEMBL22997280 | 0.70 | TDP1 (0.50) | IDO1TDP1CA12CA1CA2 | |
| SCHEMBL25985418 | 0.70 | TDP1 (0.50) | IDO1TDP1CA12CA1CA2 | |
| SCHEMBL38650561 | 0.70 | TDP1 (0.50) | IDO1TDP1CA12CA1CA2 | |
| SCHEMBL14065889 | 0.70 | TDP1 (0.50) | IDO1TDP1CA12CA1CA2 | |
| SCHEMBL10073751 | 0.69 | TDP1 (0.53) | NPSR1IDO1TDP1CA12CA1 |
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 |