Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 5/20 | 0.54 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.54 |
| ▸ | GABRA2 | P47869 | 5/20 | 0.54 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.54 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.54 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | BRD4 | O60885 | 5/20 | 0.52 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | CNR1 | P21554 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | PTAFR | P25105 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11080578 | 0.88 | GABRA1 (0.65) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11077402 | 0.87 | CHRM1 (0.45) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11087561 | 0.87 | CHRM1 (0.45) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11091497 | 0.86 | TDP1 (0.53) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11088141 | 0.86 | CHRM1 (0.44) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11085506 | 0.85 | GABRA1 (0.64) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11081366 | 0.84 | CHRM1 (0.45) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11087331 | 0.84 | CHRM1 (0.45) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL11088719 | 0.84 | CHRM1 (0.44) | GABRA1GABRA5GABRA2GABRA3OPRK1 | |
| SCHEMBL10923210 | 0.84 | CHRM1 (0.44) | GABRA1GABRA5GABRA2GABRA3OPRK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4464300-A | PSYCHOTROPIC, ANXIOLYTIC AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1984-08-07 | — | — | US | claimed |
| EP-0072029-A2 | Triazolobenzazepines, process and intermediates for their preparation and medicines containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1983-02-16 | — | — | EP | claimed |
| US-4464300-A | PSYCHOTROPIC, ANXIOLYTIC AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1984-08-07 | — | — | US | disclosed |
| EP-0072029-A2 | Triazolobenzazepines, process and intermediates for their preparation and medicines containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1983-02-16 | — | — | EP | disclosed |