Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.33 |
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.33 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9328436 | 0.80 | GABRR1 (0.48) | GABRR1CYP1A2FOLH1NAALAD2ENPEP | |
| SCHEMBL14763545 | 0.78 | — | — | |
| SCHEMBL9221088 | 0.77 | GABRR1 (0.34) | GABRR1CYP1A2FOLH1NAALAD2ENPEP | |
| SCHEMBL18052197 | 0.73 | GABRR1 (0.54) | GABRR1CYP1A2FOLH1NAALAD2ENPEP | |
| SCHEMBL1177351 | 0.73 | GABRR1 (0.54) | GABRR1CYP1A2FOLH1NAALAD2ENPEP | |
| SCHEMBL9736766 | 0.73 | TDP1 (0.45) | GABRR1CYP1A2FOLH1NAALAD2ENPEP | |
| SCHEMBL6905507 | 0.73 | CYP2C19 (0.46) | GABRR1CYP1A2RNPEPFOLH1NAALAD2 | |
| SCHEMBL162834 | 0.72 | — | — | |
| SCHEMBL2437225 | 0.72 | — | — | |
| SCHEMBL11923121 | 0.72 | — | — |
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-5225421-A | Leukotriene antagonists; cytoprotective agents | MERCK FROSST CANADA, INC. (CA) | 1993-07-06 | — | — | US | disclosed |