Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4203755 | 1.00 | ALDH1A1 (0.31) | ALDH1A1LMNAMAPT | |
| SCHEMBL12345838 | 0.69 | CREBBP (0.44) | ALDH1A1MAPT | |
| SCHEMBL6308518 | 0.69 | CREBBP (0.44) | ALDH1A1MAPT | |
| SCHEMBL38765 | 0.68 | BRPF1 (0.39) | ALDH1A1LMNAMAPT | |
| Hydrochloric Acid SCHEMBL2235061 | 0.68 | CREBBP (0.43) | ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL2235068 | 0.68 | CREBBP (0.43) | ALDH1A1MAPT | |
| SCHEMBL129351 | 0.67 | HTR2A (0.37) | — | |
| SCHEMBL1592807 | 0.66 | MEN1 (0.40) | ALDH1A1LMNAMAPT | |
| SCHEMBL8904356 | 0.66 | GAA (0.39) | ALDH1A1MAPT | |
| SCHEMBL3913695 | 0.64 | KDM1A (0.38) | LMNA |
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-2083014-A2 | Inhibitors of interleukin-1ß converting enzyme | Vertex Pharmceuticals Incorporated (US) | 2009-07-29 | — | — | EP | disclosed |