Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | PGR | P06401 | 10/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL145108 | 0.93 | ALDH1A1 (0.47) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL143747 | 0.93 | ALDH1A1 (0.48) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL6604612 | 0.93 | MAOB (0.49) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL6601851 | 0.93 | ALDH1A1 (0.48) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL6587589 | 0.91 | ALDH1A1 (0.52) | ALDH1A1POLBPGRMAOBCYP1A2 | |
| SCHEMBL6582201 | 0.91 | GAA (0.51) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL6226074 | 0.91 | ALDH1A1 (0.47) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL6562078 | 0.90 | PGR (0.46) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL6362435 | 0.90 | ALDH1A1 (0.46) | ALDH1A1POLBPGRGAAMAOB | |
| SCHEMBL6581784 | 0.90 | ALDH1A1 (0.55) | ALDH1A1POLBMAOBCYP1A2LMNA |
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-1124809-B1 | BENZOYLPYRIDAZINES | MERCK PATENT GMBH (DE) | 2004-03-24 | — | — | EP | claimed |