Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6825360 | 0.94 | HTR1A (0.37) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL30516327 | 0.91 | PYGL (0.34) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL7154241 | 0.88 | HTR1A (0.38) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL30516333 | 0.86 | PYGL (0.32) | PYGMPYGL | |
| SCHEMBL30516330 | 0.86 | PYGL (0.32) | PYGMPYGL | |
| SCHEMBL2365028 | 0.74 | TSHR (0.37) | TBXA2RADRA1ASLC6A3ABCB11ABCB1 | |
| SCHEMBL4757355 | 0.70 | PYGM (0.39) | PYGMPYGL | |
| SCHEMBL6679039 | 0.67 | PPARA (0.45) | — | |
| SCHEMBL7424308 | 0.66 | ALDH1A1 (0.38) | TBXA2RADRA1ASLC6A3ABCB11ABCB1 | |
| SCHEMBL7418565 | 0.65 | CYP2C9 (0.33) | TBXA2RADRA1ASLC6A3ABCB11ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111100064-B | Method for enriching, recovering and resolving alkaline chiral medicine amlodipine from waste liquid | 湖南理工学院 | 2024-01-02 | — | — | CN | disclosed |