Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL7383210 | 0.91 | ALDH1A1 (0.64) | SIGMAR1ALDH1A1SMN1; SMN2MEN1POLB | |
| SCHEMBL7906481 | 0.90 | SMN1; SMN2 (0.62) | SIGMAR1ALDH1A1SMN1; SMN2MEN1POLB | |
| SCHEMBL7373567 | 0.90 | SMN1; SMN2 (0.62) | SIGMAR1ALDH1A1SMN1; SMN2MEN1POLB | |
| SCHEMBL7368346 | 0.86 | HRH3 (0.60) | SIGMAR1ALDH1A1SMN1; SMN2MEN1POLB | |
| SCHEMBL7368858 | 0.83 | HRH3 (0.52) | SIGMAR1ALDH1A1SMN1; SMN2HRH3RAB9A | |
| SCHEMBL7370485 | 0.80 | MAPT (0.54) | SIGMAR1ALDH1A1SMN1; SMN2POLBKMT2A | |
| SCHEMBL10966316 | 0.80 | ALDH1A1 (0.59) | SIGMAR1ALDH1A1SMN1; SMN2MEN1POLB | |
| SCHEMBL7385644 | 0.79 | ALDH1A1 (0.48) | SIGMAR1ALDH1A1SMN1; SMN2HRH3RAB9A | |
| SCHEMBL8143235 | 0.79 | TDP1 (0.50) | ALDH1A1SMN1; SMN2MEN1POLBKMT2A | |
| SCHEMBL7383838 | 0.78 | CHRNA7 (0.49) | SIGMAR1ALDH1A1SMN1; SMN2HRH3LTA4H |
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 |