Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | CES1 | P23141 | 5/20 | 0.58 |
| ▸ | FAAH | O00519 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL44801 | 0.80 | CYP2C19 (1.00) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL1929541 | 0.78 | CYP2C19 (0.54) | CYP2C19CES1HPGDALDH1A1LMNA | |
| SCHEMBL11537189 | 0.77 | CYP2C19 (0.68) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL4133539 | 0.77 | CYP2C19 (0.72) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL4050426 | 0.77 | CYP2C19 (0.72) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11260584 | 0.77 | CYP2C19 (0.72) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5935700 | 0.77 | CYP2C19 (0.72) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL724648 | 0.77 | CYP2C19 (0.72) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11535371 | 0.76 | CYP2C19 (0.66) | CYP2C19HPGDALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL1274684 | 0.76 | CES1 (0.73) | CES1FAAHALDH1A1CPA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4134918-A | ENZYME INHIBITORS, ANTIBODY INHIBITORS | MERRELL TORAUDE ET COMPAGNIE (FR) | 1979-01-16 | — | — | US | disclosed |