Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 12/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TACR2 | P21452 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7372062 | 0.84 | SIGMAR1 (0.43) | SIGMAR1HRH3SLC6A4KCNH2CYP1A2 | |
| SCHEMBL7384215 | 0.84 | SIGMAR1 (0.45) | SIGMAR1HRH3SLC6A4KCNH2CYP1A2 | |
| SCHEMBL7385431 | 0.84 | SIGMAR1 (0.42) | SIGMAR1HRH3SLC6A4KCNH2CYP1A2 | |
| SCHEMBL7371832 | 0.82 | SIGMAR1 (0.40) | SIGMAR1HRH3SLC6A4KCNH2KDM4E | |
| SCHEMBL7366602 | 0.79 | SIGMAR1 (0.38) | SIGMAR1HRH3SLC6A4KCNH2CYP1A2 | |
| SCHEMBL7364843 | 0.76 | SIGMAR1 (0.42) | SIGMAR1HRH3SLC6A4KCNH2KDM4E | |
| SCHEMBL7372480 | 0.76 | BACE1 (0.45) | HRH3KCNH2 | |
| SCHEMBL7377888 | 0.73 | KCNH2 (0.36) | SIGMAR1HRH3SLC6A4KCNH2TSHR | |
| SCHEMBL7447534 | 0.73 | HRH3 (0.37) | SIGMAR1HRH3KCNH2 | |
| SCHEMBL7377488 | 0.71 | ALDH1A1 (0.36) | SIGMAR1HRH3KCNH2KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0994859-A1 | COMPOUNDS | Astra Aktiebolag (publ) (SE) | 2000-04-26 | — | — | EP | claimed |
| WO-1999001437-A1 | COMPOUNDS | ASTRA AKTIEBOLAG (PUBL) (SE) | 1999-01-14 | — | — | WO | claimed |
| EP-0994859-A1 | COMPOUNDS | Astra Aktiebolag (publ) (SE) | 2000-04-26 | — | — | EP | disclosed |
| WO-1999001437-A1 | COMPOUNDS | ASTRA AKTIEBOLAG (PUBL) (SE) | 1999-01-14 | — | — | WO | disclosed |