Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 7/20 | 0.66 |
| ▸ | ADRA1A | P35348 | 6/20 | 0.66 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.66 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6115061 | 0.85 | HRH1 (0.66) | HRH1ADRA1AHRH3ADRA1BGAA | |
| SCHEMBL7960611 | 0.85 | HRH1 (0.66) | HRH1ADRA1AHRH3ADRA1BGAA | |
| SCHEMBL7960273 | 0.75 | CMA1 (0.66) | HRH1ADRA1AHRH3ADRA1BTSHR | |
| SCHEMBL7965389 | 0.73 | CMA1 (0.45) | HRH1ADRA1AHRH3ADRA1BALDH1A1 | |
| SCHEMBL16363659 | 0.69 | TSHR (0.64) | HRH1ADRA1AHRH3ADRA1BALDH1A1 | |
| Talastine SCHEMBL30502 | 0.68 | ADRA1A (0.81) | HRH1ADRA1AHRH3ADRA1BTSHR | |
| Talastine SCHEMBL29350005 | 0.68 | ADRA1A (0.81) | HRH1ADRA1AHRH3ADRA1BTSHR | |
| SCHEMBL12877772 | 0.68 | TSHR (0.71) | HRH1ADRA1AHRH3ADRA1BALDH1A1 | |
| SCHEMBL417948 | 0.67 | TAAR1 (0.61) | HRH3 | |
| Talastine SCHEMBL1650995 | 0.66 | ADRA1A (0.78) | HRH1ADRA1AHRH3ADRA1BTSHR |
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-2010019417-A2 | CHYMASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-02-18 | — | — | WO | disclosed |