Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL31035649 | 0.83 | NOS3 (0.31) | — | |
| SCHEMBL31035779 | 0.80 | ROCK1 (0.32) | — | |
| SCHEMBL10038834 | 0.76 | NOS3 (0.32) | ALDH1A1 | |
| SCHEMBL31035721 | 0.74 | — | — | |
| SCHEMBL31035835 | 0.73 | PTGS2 (0.33) | — | |
| SCHEMBL26093214 | 0.71 | — | — | |
| SCHEMBL12778706 | 0.68 | — | — | |
| SCHEMBL31035821 | 0.68 | PDCD1 (0.34) | — | |
| SCHEMBL26093938 | 0.67 | KDM4E (0.55) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL12489380 | 0.67 | MET (0.41) | SMN1; SMN2 |
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 |