Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 10/20 | 0.57 |
| ▸ | ADRA1B | P35368 | 10/20 | 0.57 |
| ▸ | ADRA1D | P25100 | 9/20 | 0.57 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7830825 | 0.83 | ADRA1A (0.62) | ADRA1AADRA1BADRA1DDRD2DRD4 | |
| SCHEMBL7832834 | 0.83 | ADRA1A (0.62) | ADRA1AADRA1BADRA1DDRD2DRD4 | |
| SCHEMBL7835975 | 0.81 | RAB9A (0.46) | ADRA1AADRA1BADRA1DCYP3A4CYP2C9 | |
| SCHEMBL7831996 | 0.76 | ADRA1A (0.68) | ADRA1AADRA1BADRA1DDRD2DRD4 | |
| SCHEMBL24712880 | 0.74 | DRD2 (0.59) | ADRA1AADRA1BADRA1DDRD2DRD4 | |
| SCHEMBL24712881 | 0.71 | ADRA1A (0.49) | ADRA1AADRA1BADRA1DDRD2DRD4 | |
| SCHEMBL7835709 | 0.71 | ADRA1A (0.60) | ADRA1AADRA1BADRA1DDRD2DRD3 | |
| SCHEMBL6771682 | 0.71 | ADRA1A (0.60) | ADRA1AADRA1BADRA1DDRD2DRD3 | |
| SCHEMBL9028727 | 0.71 | ADRA1A (0.60) | ADRA1AADRA1BADRA1DDRD2DRD3 | |
| SCHEMBL5240191 | 0.70 | L3MBTL1 (0.49) | ADRA1AADRA1BADRA1DCYP3A4CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0748800-B1 | Pyrimidinedione, pyrimidinetrione, triazinedione derivatives as alpha-1-adrenergic receptor antagonists | HOFFMANN LA ROCHE (CH) | 2001-05-09 | — | — | EP | disclosed |
| US-5859014-A | USEFUL IN TREATMENT OF DISEASES INVOLVING DIRECTLY OR INDIRECTLY AN OBSTRUCTION OF THE LOWER URINARY TRACT, SUCH ASBENIGN PROSTATE HYPERPLASIA | SYNTEX (U.S.A.) INC. (US) | 1999-01-12 | — | — | US | disclosed |
| EP-0748800-A2 | Pyrimidinedione, pyrimidinetrione, triazinedione, tetrahydroquinazolinedione derivatives as alpha-1-adrenergic receptor antagonists | F. HOFFMANN-LA ROCHE AG (CH) | 1996-12-18 | — | — | EP | disclosed |