Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGD | P52209 | 2/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.32 |
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL15910175 | 0.79 | GABRR1 (0.46) | FOLH1NAALAD2GABRR1CYP1A2TP53 | |
| SCHEMBL22780951 | 0.76 | HSD17B10 (0.44) | FOLH1NAALAD2GABRR1CYP1A2TP53 | |
| SCHEMBL18822342 | 0.75 | PLA2G2C (0.40) | FOLH1NAALAD2GABRR1CYP1A2 | |
| SCHEMBL28976448 | 0.74 | GABRR1 (0.38) | FOLH1NAALAD2GABRR1CYP1A2TP53 | |
| SCHEMBL18327244 | 0.72 | FOLH1 (0.33) | FOLH1NAALAD2GABRR1CYP1A2 | |
| SCHEMBL499938 | 0.70 | GABRR1 (0.38) | FOLH1NAALAD2GABRR1CYP1A2TP53 | |
| SCHEMBL15866578 | 0.69 | — | — | |
| SCHEMBL15701348 | 0.69 | — | — | |
| SCHEMBL156205 | 0.69 | — | — | |
| SCHEMBL2908572 | 0.68 | GABRR1 (0.37) | FOLH1NAALAD2GABRR1CYP1A2TP53 |
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-3896056-A1 | AMINO ACID HAVING FUNCTIONAL GROUP CAPABLE OF INTERMOLECULAR HYDROGEN BONDING, PEPTIDE COMPOUND CONTAINING SAME AND METHOD FOR PRODUCTION THEREOF | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2021-10-20 | — | — | EP | disclosed |