Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 9/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | PTK6 | Q13882 | 2/20 | 0.44 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23652331 | 0.80 | ERN1 (0.51) | ERN1GAAKDM4EALDH1A1CA12 | |
| SCHEMBL13944216 | 0.80 | ERN1 (0.51) | ERN1GAAKDM4EALDH1A1CA12 | |
| SCHEMBL2314960 | 0.73 | GAA (0.63) | ERN1GAAKDM4EALDH1A1PTK6 | |
| SCHEMBL12768067 | 0.69 | ERN1 (1.00) | ERN1CA12MAPTKMT2A | |
| SCHEMBL455724 | 0.68 | ERN1 (1.00) | ERN1GAAKDM4EALDH1A1MAPT | |
| SCHEMBL30933727 | 0.68 | ERN1 (1.00) | ERN1GAAKDM4EALDH1A1MAPT | |
| SCHEMBL29229529 | 0.67 | CA12 (0.39) | ERN1GAAKDM4EALDH1A1CA12 | |
| SCHEMBL14669050 | 0.67 | ERN1 (0.56) | ERN1GAAALDH1A1CA12MAPT | |
| SCHEMBL1541991 | 0.66 | ERN1 (0.64) | ERN1GAAKDM4EALDH1A1CA12 | |
| SCHEMBL2222204 | 0.66 | CA12 (0.58) | ERN1GAAKDM4EALDH1A1CA12 |
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-2862581-B1 | Methods, compounds, compositions and vehicles for delivering 3-amino-1-propanesulfonic acid | BHI LP (CA) | 2021-08-11 | — | — | EP | disclosed |
| EP-3851447-A1 | METHODS, COMPOUNDS, COMPOSITIONS AND VEHICLES FOR DELIVERING 3-AMINO-1-PROPANESULFONIC ACID | BHI Limited Partnership (CA) | 2021-07-21 | — | — | EP | disclosed |