Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7385431 | 0.69 | SIGMAR1 (0.42) | SIGMAR1KCNH2KDM4ECYP1A2CYP2D6 | |
| SCHEMBL7377888 | 0.68 | KCNH2 (0.36) | SIGMAR1KCNH2TSHRHRH3LTA4H | |
| SCHEMBL7384215 | 0.68 | SIGMAR1 (0.45) | SIGMAR1KCNH2KDM4ECYP1A2CYP2D6 | |
| SCHEMBL7366605 | 0.67 | SIGMAR1 (0.44) | SIGMAR1KCNH2KDM4ECYP1A2CYP2D6 | |
| SCHEMBL7377488 | 0.66 | ALDH1A1 (0.36) | SIGMAR1KCNH2KDM4EHRH3LTA4H | |
| SCHEMBL7372062 | 0.66 | SIGMAR1 (0.43) | SIGMAR1KCNH2KDM4ECYP1A2CYP2D6 | |
| SCHEMBL7364843 | 0.66 | SIGMAR1 (0.42) | SIGMAR1KCNH2KDM4EHRH3POLB | |
| SCHEMBL7383331 | 0.64 | KDM4E (0.40) | SIGMAR1KCNH2KDM4ECYP1A2CYP2D6 | |
| SCHEMBL7371832 | 0.64 | SIGMAR1 (0.40) | SIGMAR1KCNH2KDM4EHRH3POLB | |
| SCHEMBL7366602 | 0.63 | SIGMAR1 (0.38) | SIGMAR1KCNH2KDM4ECYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |