Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL7266617 | 0.99 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL7329287 | 0.88 | ALDH1A1 (0.51) | ALDH1A1 | |
| Iodide SCHEMBL7266858 | 0.87 | ALDH1A1 (0.50) | ALDH1A1 | |
| SCHEMBL7268767 | 0.82 | HSD11B1 (0.50) | ALDH1A1 | |
| SCHEMBL7266507 | 0.81 | ALDH1A1 (0.53) | ALDH1A1 | |
| SCHEMBL7268323 | 0.80 | ALDH1A1 (0.52) | ALDH1A1 | |
| SCHEMBL7435424 | 0.79 | SPHK2 (0.51) | ALDH1A1 | |
| Oxalic Acid SCHEMBL7273813 | 0.78 | HSD11B1 (0.55) | — | |
| SCHEMBL7443611 | 0.77 | KCNH2 (0.52) | ALDH1A1 | |
| SCHEMBL23865235 | 0.76 | NR1H4 (0.53) | 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 |
|---|---|---|---|---|---|---|---|
| EP-0328200-B1 | Five-membered ring systems with bonded azacyclic ring substituents | MERCK SHARP & DOHME (GB) | 1993-12-08 | — | — | EP | claimed |