Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | DRD2 | P14416 | 2/20 | 0.59 |
| ▸ | DRD3 | P35462 | 2/20 | 0.59 |
| ▸ | HTR1A | P08908 | 7/20 | 0.59 |
| ▸ | HTR7 | P34969 | 7/20 | 0.59 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.58 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.57 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.57 |
| ▸ | HTR2A | P28223 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7832997 | 0.99 | MEN1 (0.59) | MEN1KMT2ADRD2DRD3HTR1A | |
| SCHEMBL7830329 | 0.86 | HTR1A (0.56) | MEN1KMT2ADRD2DRD3HTR1A | |
| Hydrochloric Acid SCHEMBL7833555 | 0.85 | ADRA1A (0.71) | CYP2C9CYP2C19ADRA1BCYP3A4ADRA1D | |
| Hydrochloric Acid SCHEMBL7821236 | 0.85 | HTR1A (0.55) | MEN1KMT2ADRD2DRD3HTR1A | |
| Hydrochloric Acid SCHEMBL7832683 | 0.83 | HTR1A (0.62) | MEN1KMT2ADRD2DRD3HTR1A | |
| SCHEMBL7834491 | 0.82 | HTR1A (0.56) | DRD2DRD3HTR1AHTR7ADRA2A | |
| SCHEMBL7836830 | 0.82 | ADRA1A (0.75) | MEN1KMT2ADRD2DRD3HTR1A | |
| Hydrochloric Acid SCHEMBL7834012 | 0.81 | HTR1A (0.55) | DRD2DRD3HTR1AHTR7ADRA2A | |
| Hydrochloric Acid SCHEMBL7830482 | 0.81 | ADRA1A (0.74) | MEN1KMT2ADRD2DRD3HTR1A | |
| SCHEMBL6526368 | 0.81 | DRD2 (0.85) | MEN1KMT2ADRD2DRD3HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0748800-B1 | Pyrimidinedione, pyrimidinetrione, triazinedione derivatives as alpha-1-adrenergic receptor antagonists | HOFFMANN LA ROCHE (CH) | 2001-05-09 | — | — | EP | 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 |