Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL31035721 | 0.80 | — | — | |
| SCHEMBL31035683 | 0.80 | ALDH1A1 (0.30) | — | |
| SCHEMBL31035835 | 0.78 | PTGS2 (0.33) | — | |
| SCHEMBL7939767 | 0.78 | DYRK1A (0.35) | ROCK1 | |
| SCHEMBL26093214 | 0.76 | — | — | |
| SCHEMBL31035649 | 0.76 | NOS3 (0.31) | — | |
| SCHEMBL871995 | 0.76 | NPC1 (0.50) | — | |
| SCHEMBL30832543 | 0.73 | KDM4E (0.31) | — | |
| SCHEMBL12778706 | 0.73 | — | — | |
| SCHEMBL21033713 | 0.73 | ALDH1A3 (0.39) | — |
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-118434744-A | Nitrogen-containing macrocyclic compound, and preparation method and medical application thereof | 中国医药研究开发中心有限公司 | 2024-08-02 | — | — | CN | disclosed |