Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2759515 | 0.96 | SMN1; SMN2 (0.41) | SMN1; SMN2HSD11B1HRH3CHRM5ADRA2C | |
| SCHEMBL178287 | 0.87 | SMN1; SMN2 (0.46) | SMN1; SMN2HSD11B1HRH3ACHEEPHX1 | |
| Fluoride SCHEMBL29252276 | 0.84 | SMN1; SMN2 (0.45) | SMN1; SMN2HSD11B1HRH3ACHEEPHX1 | |
| SCHEMBL26480956 | 0.83 | SMN1; SMN2 (0.41) | SMN1; SMN2HSD11B1HRH3EPHX1KMT2A | |
| SCHEMBL23594607 | 0.81 | CHRM5 (0.44) | SMN1; SMN2CHRM5ADRA2CACHE | |
| SCHEMBL7075929 | 0.81 | HSD11B1 (0.37) | SMN1; SMN2HSD11B1HRH3CHRM5ADRA2C | |
| SCHEMBL12018063 | 0.81 | HSD11B1 (0.37) | SMN1; SMN2HSD11B1HRH3CHRM5ADRA2C | |
| Butane SCHEMBL21084740 | 0.80 | SMN1; SMN2 (0.42) | SMN1; SMN2HSD11B1HRH3EPHX1EPHX2 | |
| Butane SCHEMBL21084742 | 0.80 | SMN1; SMN2 (0.42) | SMN1; SMN2HSD11B1HRH3EPHX1EPHX2 | |
| SCHEMBL11826729 | 0.79 | SMN1; SMN2 (0.38) | SMN1; SMN2HSD11B1HRH3CHRM5ADRA2C |
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-1465611-A2 | COMPOSITION, SYNTHESIS AND THERAPEUTIC APPLICATIONS OF POLYAMINES | Murphy, Michael A. (US) | 2004-10-13 | — | — | EP | disclosed |
| WO-2003051348-A2 | COMPOSITION, SYNTHESIS AND THERAPEUTIC APPLICATIONS OF POLYAMINES | MURPHY MICHAEL A (US) | 2003-06-26 | — | — | WO | disclosed |