Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 3/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8142869 | 0.94 | HRH3 (0.39) | BCHEHRH3SMN1; SMN2ALDH1A1SLC6A4 | |
| SCHEMBL8135050 | 0.93 | SMN1; SMN2 (0.45) | BCHEHRH3SMN1; SMN2ALDH1A1SIGMAR1 | |
| SCHEMBL8134351 | 0.92 | BCHE (0.42) | BCHEHRH3SMN1; SMN2ALDH1A1SLC6A4 | |
| SCHEMBL2863951 | 0.91 | CACNA1F (0.39) | BCHEHRH3SMN1; SMN2ALDH1A1SIGMAR1 | |
| SCHEMBL8141265 | 0.89 | HRH3 (0.40) | BCHEHRH3SMN1; SMN2ALDH1A1SIGMAR1 | |
| SCHEMBL8142966 | 0.89 | HRH3 (0.39) | BCHEHRH3SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL8140012 | 0.89 | CACNA1C (0.47) | HRH3SMN1; SMN2ALDH1A1SLC6A4MEN1 | |
| SCHEMBL8134448 | 0.88 | SMN1; SMN2 (0.43) | BCHEHRH3SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL8147315 | 0.88 | SMN1; SMN2 (0.43) | BCHEHRH3SMN1; SMN2ALDH1A1HRH1 | |
| SCHEMBL8142969 | 0.88 | BCHE (0.45) | BCHEHRH3SMN1; SMN2ALDH1A1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6057332-A | Substituted 1,4-dihydropyrimidine-5-carboxylate compounds, their preparation and uses | ASTRA AKTIEBOLAG (SE) | 2000-05-02 | — | — | US | claimed |
| US-6057332-A | Substituted 1,4-dihydropyrimidine-5-carboxylate compounds, their preparation and uses | ASTRA AKTIEBOLAG (SE) | 2000-05-02 | — | — | US | disclosed |