Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTAFR | P25105 | 8/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.49 |
| ▸ | DRD3 | P35462 | 2/20 | 0.49 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.48 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.40 |
| ▸ | GHSR | Q92847 | 2/20 | 0.40 |
| ▸ | CCKBR | P32239 | 1/20 | 0.40 |
| ▸ | MC3R | P41968 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8933546 | 0.87 | CYP3A4 (0.49) | PTAFROPRK1CYP3A4PDE4DDRD3 | |
| SCHEMBL8933539 | 0.86 | GABRA1 (0.47) | OPRK1PDE4DGABRA1GABRA5GABRA2 | |
| Hydrochloric Acid SCHEMBL8933498 | 0.85 | GABRA1 (0.47) | OPRK1PDE4DGABRA1GABRA5GABRA2 | |
| SCHEMBL11833527 | 0.85 | PTAFR (0.55) | PTAFROPRK1CYP3A4PDE4DDRD3 | |
| SCHEMBL8933504 | 0.84 | PTAFR (0.50) | PTAFROPRK1CYP3A4PDE4DDRD3 | |
| SCHEMBL11836324 | 0.83 | GABRA1 (0.53) | PTAFROPRK1CYP3A4PDE4DDRD3 | |
| SCHEMBL11827030 | 0.83 | OPRK1 (0.70) | PTAFROPRK1CYP3A4PDE4DDRD3 | |
| Hydrochloric Acid SCHEMBL8933564 | 0.83 | PTAFR (0.49) | PTAFROPRK1CYP3A4PDE4DDRD3 | |
| SCHEMBL11826561 | 0.81 | PTAFR (0.52) | PTAFROPRK1CYP3A4PDE4DDRD3 | |
| SCHEMBL11829425 | 0.81 | PTAFR (0.52) | PTAFROPRK1CYP3A4PDE4DDRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996023790-A1 | ACETYLIMIDAZOBENZODIAZEPINES | F. HOFFMANN-LA ROCHE AG (CH) | 1996-08-08 | — | — | WO | claimed |
| WO-1996023790-A1 | ACETYLIMIDAZOBENZODIAZEPINES | F. HOFFMANN-LA ROCHE AG (CH) | 1996-08-08 | — | — | WO | disclosed |