Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 2/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.32 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7590782 | 0.82 | GABRR1 (0.48) | GABRR1PMP22GABBR2GABBR1 | |
| SCHEMBL5540 | 0.82 | CA1 (0.39) | PMP22CA1CA2 | |
| Hydrochloric Acid SCHEMBL3354866 | 0.80 | CA1 (0.38) | PMP22CA1CA2 | |
| SCHEMBL2810383 | 0.78 | CA2 (0.50) | CA1CA2 | |
| SCHEMBL5503 | 0.76 | CA1 (0.37) | PMP22CA1CA2 | |
| SCHEMBL29211666 | 0.75 | TP53 (0.46) | CA1CA2 | |
| SCHEMBL11021093 | 0.74 | NOS2 (0.31) | — | |
| SCHEMBL20744255 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL8710294 | 0.74 | CA1 (0.35) | CA1CA2 | |
| SCHEMBL14167181 | 0.74 | KDM4E (0.33) | PMP22 |
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-0259092-A1 | Substituted hexahydroarylquinolizines | MERCK & CO. INC. (US) | 1988-03-09 | — | — | EP | disclosed |