Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.51 |
| ▸ | HTR7 | P34969 | 4/20 | 0.51 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5421867 | 0.97 | HTR1A (0.51) | HTR1AHTR7DRD2HTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL5422079 | 0.96 | HTR1A (0.50) | HTR1AHTR7DRD2HTR2AHTR6 | |
| SCHEMBL5424353 | 0.91 | HTR1A (0.53) | HTR1AHTR7DRD2HTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL5418538 | 0.90 | HTR1A (0.52) | HTR1AHTR7DRD2HTR2AHTR6 | |
| SCHEMBL5433120 | 0.90 | HTR1A (0.45) | HTR1AHTR7DRD2HTR2AHTR6 | |
| SCHEMBL5424281 | 0.90 | HTR1A (0.56) | HTR1AHTR7DRD2HTR2AHTR6 | |
| SCHEMBL5424943 | 0.89 | HTR1A (0.51) | HTR1AHTR7DRD2HTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL5424727 | 0.89 | HTR1A (0.45) | HTR1AHTR7DRD2HTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL5421894 | 0.89 | HTR1A (0.55) | HTR1AHTR7DRD2HTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL5420356 | 0.88 | HTR1A (0.51) | HTR1AHTR7DRD2HTR2AHTR6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005037281-A1 | 1-ALKYLPIPERAZINYL-PYRROLIDIN-2, 5-DIONE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONIST | RANBAXY LABORATORIES LIMITED (IN) | 2005-04-28 | — | — | WO | disclosed |