Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 13/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 3/20 | 0.33 |
| ▸ | FABP5 | Q01469 | 3/20 | 0.33 |
| ▸ | MME | P08473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4416357 | 1.00 | ECE1 (0.45) | ECE1ALDH1A1FABP4FABP5MME | |
| SCHEMBL5101577 | 0.79 | ALDH1A1 (0.36) | ALDH1A1FABP4FABP5 | |
| SCHEMBL1403838 | 0.79 | PYGL (0.33) | ECE1ALDH1A1FABP4FABP5 | |
| SCHEMBL3365638 | 0.79 | PYGL (0.33) | ECE1ALDH1A1FABP4FABP5 | |
| SCHEMBL1403840 | 0.79 | PYGL (0.33) | ECE1ALDH1A1FABP4FABP5 | |
| SCHEMBL9752273 | 0.78 | CYP1A2 (0.35) | ALDH1A1FABP4FABP5 | |
| SCHEMBL11603247 | 0.77 | MME (0.41) | MME | |
| SCHEMBL10062004 | 0.75 | MME (0.36) | ALDH1A1FABP4FABP5MME | |
| SCHEMBL10877742 | 0.74 | MME (0.36) | ALDH1A1FABP4FABP5MME | |
| SCHEMBL7972266 | 0.73 | ALDH1A1 (0.31) | ALDH1A1FABP4FABP5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009135526-A1 | ALPHA-MERCAPTO-AMIDES | NOVARTIS AG (CH) | 2009-11-12 | — | — | WO | disclosed |