Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | DRD1 | P21728 | 2/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 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 | |
|---|---|---|---|---|
| SCHEMBL30656597 | 0.88 | HTR1A (0.39) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL6825360 | 0.85 | HTR1A (0.37) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL30516327 | 0.78 | PYGL (0.34) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL30516330 | 0.74 | PYGL (0.32) | — | |
| SCHEMBL30516333 | 0.74 | PYGL (0.32) | — | |
| SCHEMBL3393583 | 0.71 | TSHR (0.40) | HTR1AADRA2AADRA1AADORA3DRD2 | |
| SCHEMBL3027396 | 0.70 | TSHR (0.43) | CYP3A4KDM4EGAACYP2C9ALOX12 | |
| SCHEMBL29136595 | 0.68 | HTR1A (0.35) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL19687545 | 0.67 | TBXA2R (0.66) | HTR1AADRA2ACHRM1DRD1TBXA2R | |
| SCHEMBL4757323 | 0.67 | SMN1; SMN2 (0.40) | SLC6A3KDM4ECYP2C9 |
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-2003101965-A1 | TWO CRYSTALLINE HYDRATE FORMS OF AMLODIPINE BENZENESULFONATE OF HIGH PURITY, PROCESSES FOR THEIR PREPARATION AND USE | LEK PHARMACEUTICALS D.D. (SI) | 2003-12-11 | — | — | WO | disclosed |