Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.37 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28896338 | 1.00 | AAK1 (0.37) | AAK1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL29211242 | 0.94 | AAK1 (0.38) | AAK1MAPTATMKDM4EMEN1 | |
| SCHEMBL29211271 | 0.78 | CA12 (0.31) | CA12CA1CA2CA9 | |
| SCHEMBL28896381 | 0.73 | KDM4E (0.33) | MAPTKDM4ENPSR1SYKTDP1 | |
| SCHEMBL28896526 | 0.73 | MAPT (0.30) | MAPTNPSR1 | |
| SCHEMBL28896379 | 0.73 | KDM4E (0.32) | MAPTKDM4ENPSR1SYKTDP1 | |
| SCHEMBL28896584 | 0.70 | AAK1 (0.45) | AAK1MAPTATMMEN1KMT2A | |
| SCHEMBL28896582 | 0.70 | AAK1 (0.45) | AAK1MAPTATMMEN1KMT2A | |
| SCHEMBL28896541 | 0.70 | AAK1 (0.45) | AAK1MAPTATMKDM4EMEN1 | |
| SCHEMBL28896542 | 0.70 | AAK1 (0.45) | AAK1MAPTATMKDM4EMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |