Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTAFR | P25105 | 7/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | GHSR | Q92847 | 2/20 | 0.39 |
| ▸ | CCKBR | P32239 | 2/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | MC3R | P41968 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL8933595 | 0.92 | PTAFR (0.44) | PTAFRCYP3A4GABRA3GABRG2GABRB3 | |
| Hydrochloric Acid SCHEMBL8933629 | 0.91 | PTAFR (0.43) | PTAFRCYP3A4GABRA3GABRG2GABRB3 | |
| SCHEMBL8933497 | 0.91 | PTAFR (0.41) | PTAFRCYP3A4GABRA3GABRG2GABRB3 | |
| SCHEMBL8933412 | 0.88 | PTAFR (0.45) | PTAFRCYP3A4GABRA3GABRG2GABRB3 | |
| SCHEMBL8933554 | 0.85 | PTAFR (0.41) | PTAFRCYP3A4GABRA3GABRG2GABRB3 | |
| SCHEMBL32673218 | 0.84 | CYP3A4 (0.58) | CYP3A4GABRA3GABRG2GABRB3GABRA1 | |
| SCHEMBL7370687 | 0.84 | CYP3A4 (0.58) | CYP3A4GABRA3GABRG2GABRB3GABRA1 | |
| SCHEMBL7844186 | 0.84 | PTAFR (0.57) | PTAFRCYP3A4GABRA3GABRG2GABRB3 | |
| Hydrochloric Acid SCHEMBL8933404 | 0.82 | PTAFR (0.39) | PTAFRCYP3A4GABRA3GABRG2GABRB3 | |
| SCHEMBL8933423 | 0.82 | PTAFR (0.38) | PTAFRCYP3A4GABRA3GABRG2GABRB3 |
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 |