Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 3/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7373567 | 0.89 | SMN1; SMN2 (0.62) | ALDH1A1SMN1; SMN2HRH3LTA4HSIGMAR1 | |
| SCHEMBL7906481 | 0.89 | SMN1; SMN2 (0.62) | ALDH1A1SMN1; SMN2HRH3LTA4HSIGMAR1 | |
| SCHEMBL7383210 | 0.88 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2HRH3L3MBTL1LTA4H | |
| SCHEMBL7383838 | 0.88 | CHRNA7 (0.49) | ALDH1A1SMN1; SMN2HRH3LTA4HSIGMAR1 | |
| SCHEMBL7370485 | 0.85 | MAPT (0.54) | ALDH1A1SMN1; SMN2HRH3LTA4HSLC6A2 | |
| SCHEMBL7368346 | 0.85 | HRH3 (0.60) | ALDH1A1SMN1; SMN2HRH3L3MBTL1HRH1 | |
| SCHEMBL7386195 | 0.82 | NAAA (0.45) | ALDH1A1SMN1; SMN2HRH3HRH1KCNH2 | |
| SCHEMBL7368858 | 0.82 | HRH3 (0.52) | ALDH1A1SMN1; SMN2HRH3LTA4HSIGMAR1 | |
| SCHEMBL7386801 | 0.81 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2HRH3L3MBTL1KCNH2 | |
| SCHEMBL7372574 | 0.81 | SIGMAR1 (0.48) | ALDH1A1TMEM97SIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6218538-B1 | ANTAGONISTS OF N-TYPE NEURONAL CALCIUM CHANNELS USEFUL IN THE TREATMENT OF CEREBROVASCULAR ISCHAEMIA AND PAIN. | ASTRA AKTIEBOLAG (SE) | 2001-04-17 | — | — | US | disclosed |
| EP-0993450-A1 | NEW COMPOUNDS | Astra Aktiebolag (publ) (SE) | 2000-04-19 | — | — | EP | disclosed |
| WO-1999001438-A1 | NEW COMPOUNDS | ASTRA AKTIEBOLAG (PUBL) (SE) | 1999-01-14 | — | — | WO | disclosed |