Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 5/20 | 0.52 |
| ▸ | CCKAR | P32238 | 3/20 | 0.52 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.49 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.49 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.49 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.49 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3137800 | 0.82 | GABRA1 (0.72) | CCKBRCCKARTRPV1GABRA1GABRA5 | |
| SCHEMBL30752766 | 0.82 | TRPV1 (0.62) | TRPV1 | |
| SCHEMBL7718314 | 0.82 | GABRA1 (0.72) | CCKBRCCKARTRPV1GABRA1GABRA5 | |
| SCHEMBL9382324 | 0.82 | CHRM1 (0.54) | CCKBRCCKARTRPV1GABRA1GABRA5 | |
| SCHEMBL11265240 | 0.82 | GABRA1 (0.52) | CCKBRCCKARTRPV1GABRA1GABRA5 | |
| SCHEMBL9382340 | 0.82 | CHRM1 (0.54) | CCKBRCCKARTRPV1GABRA1GABRA5 | |
| SCHEMBL30056423 | 0.82 | GABRA1 (0.72) | CCKBRCCKARTRPV1GABRA1GABRA5 | |
| SCHEMBL7316649 | 0.82 | TRPV1 (0.62) | TRPV1 | |
| SCHEMBL1199478 | 0.82 | GABRA1 (0.72) | CCKBRCCKARTRPV1GABRA1GABRA5 | |
| SCHEMBL11262580 | 0.81 | CCNE2 (0.55) | CCKBRCCKARTRPV1GABRA1GABRA5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4327026-A | Benzodiazepine derivatives | HOFFMANN-LA ROCHE INC. (US) | 1982-04-27 | — | — | US | disclosed |
| EP-0045452-A2 | Benzodiazepine derivatives, intermediates and their preparation, and pharmaceutical compositions containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1982-02-10 | — | — | EP | disclosed |