Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24248063 | 0.77 | LRRK2 (0.30) | — | |
| SCHEMBL25112225 | 0.77 | LRRK2 (0.34) | — | |
| SCHEMBL20689124 | 0.75 | KDM5A (0.42) | — | |
| SCHEMBL22532828 | 0.73 | CTSD (0.45) | KDM4E | |
| SCHEMBL12427508 | 0.71 | AADAT (0.37) | AADATALDH1A1ADORA2A | |
| SCHEMBL31729323 | 0.71 | PDE4D (0.32) | — | |
| SCHEMBL25337033 | 0.69 | EPHX2 (0.37) | AADATKDM4EALDH1A1 | |
| SCHEMBL27737569 | 0.69 | BTK (0.39) | AADATKDM4EALDH1A1KMT2A | |
| SCHEMBL28047375 | 0.69 | ADORA2A (0.37) | AADATKDM4EALDH1A1KMT2AADORA2A | |
| SCHEMBL31078355 | 0.68 | AADAT (0.36) | AADATADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023036140-A1 | 3CLPRO PROTEASE INHIBITOR | 上海齐鲁制药研究中心有限公司 | 2023-03-16 | — | — | WO | disclosed |