Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 8/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8065503 | 0.99 | NISCH (0.55) | NISCHMAOAMAOBHTR6ADRA1A | |
| SCHEMBL5200679 | 0.81 | TAAR1 (0.53) | HTR6ADRA1AADRA1DADRA1BADRA2A | |
| Hydrochloric Acid SCHEMBL5201826 | 0.81 | TAAR1 (0.52) | HTR6ADRA1AADRA1DADRA1BADRA2A | |
| SCHEMBL3163676 | 0.73 | NISCH (1.00) | NISCHMAOAMAOBADRA1AADRA1D | |
| Hydrochloric Acid SCHEMBL11253888 | 0.72 | NISCH (0.60) | NISCHMAOAMAOBADRA1AADRA1D | |
| SCHEMBL5204165 | 0.71 | HTR6 (0.46) | HTR6BACE1MEN1KMT2A | |
| SCHEMBL5206394 | 0.70 | ADRA1A (0.54) | NISCHMAOAMAOBADRA1AADRA1D | |
| Hydrochloric Acid SCHEMBL5201136 | 0.70 | ADRA1A (0.53) | NISCHMAOAMAOBADRA1AADRA1D | |
| SCHEMBL5201523 | 0.70 | NISCH (0.51) | NISCHMAOAMAOBADRA1AADRA1D | |
| SCHEMBL5200760 | 0.70 | NISCH (0.51) | NISCHMAOAMAOBADRA1AADRA1D |
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-0887346-B1 | N-Phenyl-alkylsulfonamide derivatives, their preparation and their use as alpha1A/1L adrenoceptor agonists | HOFFMANN LA ROCHE (CH) | 2007-12-12 | — | — | EP | disclosed |
| US-6057349-A | ALPHA.SUB.1A/1L AGONISTS USED IN THE TREATMENT OF VARIOUS DISEASE STATES SUCH AS URINARY INCONTINENCE, NASAL CONGESTION, PRIAPISM, DEPRESSION, ANXIETY, DEMENTIA, SENILITY, ALZHEIMER'S, DEFICIENCIES IN ATTENTIVENESS AND COGNITION, AND | F. HOFFMAN LA ROCHE AG (CH) | 2000-05-02 | — | — | US | disclosed |
| EP-0887346-A2 | Phenyl-and aminophenyl-alkylsulfonamide and urea derivatives, their preparation and their use as alpha1A/1L adrenoceptor agonists | F. HOFFMANN-LA ROCHE AG (CH) | 1998-12-30 | — | — | EP | disclosed |