Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LGALS8 | O00214 | 2/20 | 0.40 |
| ▸ | LGALS3 | P17931 | 2/20 | 0.40 |
| ▸ | LGALS4 | P56470 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP7 | P09237 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | IGF2R | P11717 | 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 | |
|---|---|---|---|---|
| SCHEMBL22328414 | 1.00 | LGALS8 (0.40) | LGALS8LGALS3LGALS4MAPK1MMP13 | |
| SCHEMBL13944872 | 1.00 | LGALS8 (0.40) | LGALS8LGALS3LGALS4MAPK1MMP13 | |
| SCHEMBL23652175 | 0.90 | MAPK1 (0.39) | LGALS8LGALS3LGALS4MAPK1MMP13 | |
| SCHEMBL13944866 | 0.87 | LGALS8 (0.38) | LGALS8LGALS3LGALS4MAPK1MMP13 | |
| SCHEMBL13944648 | 0.85 | LGALS8 (0.41) | LGALS8LGALS3LGALS4MAPK1MMP13 | |
| SCHEMBL16377897 | 0.85 | LGALS8 (0.41) | LGALS8LGALS3LGALS4MAPK1MMP13 | |
| SCHEMBL23652153 | 0.85 | LGALS8 (0.41) | LGALS8LGALS3LGALS4MAPK1MMP13 | |
| SCHEMBL14179238 | 0.83 | IGF2R (0.49) | LGALS8LGALS3LGALS4MAPK1GAA | |
| SCHEMBL13944870 | 0.81 | PYGB (0.39) | LGALS8CA12CA1CA2CA9 | |
| SCHEMBL23652112 | 0.80 | GAA (0.40) | CA12CA1CA2CA9GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2862581-A2 | Methods, compounds, compositions and vehicles for delivering 3-amino-1-propanesulfonic acid | BHI Limited Partnership (CA) | 2015-04-22 | — | — | EP | disclosed |