Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL29804218 | 0.89 | HMGCR (0.36) | ALDH1A1 | |
| Acetic Acid SCHEMBL29804101 | 0.87 | HMGCR (0.34) | ALDH1A1 | |
| SCHEMBL29804277 | 0.87 | KDM4E (0.32) | — | |
| Methyl Carbamate SCHEMBL29804063 | 0.85 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL31009227 | 0.82 | HMGCR (0.35) | — | |
| SCHEMBL29804047 | 0.81 | EPHX1 (0.34) | — | |
| Methyl Carbamate SCHEMBL29833641 | 0.80 | TSHR (0.36) | — | |
| Carbamic Acid SCHEMBL18425403 | 0.77 | ACHE (0.37) | ALDH1A1 | |
| SCHEMBL29833657 | 0.74 | KDM4E (0.30) | — | |
| Acetic Acid SCHEMBL288009 | 0.72 | HMGCR (0.46) | ALDH1A1 |
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-114805365-A | Carrying non-aromatic P2 , Novel macrocyclic form of factor XIA | 百时美施贵宝公司 | 2022-07-29 | — | — | CN | disclosed |