Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TGM2 | P21980 | 1/20 | 0.30 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22341325 | 0.82 | DPP4 (0.31) | — | |
| SCHEMBL2054066 | 0.81 | GRIN2B (0.35) | SMN1; SMN2EPHX1 | |
| SCHEMBL338048 | 0.79 | ALDH1A1 (0.30) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL337878 | 0.79 | ALDH1A1 (0.30) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL22341282 | 0.77 | — | — | |
| SCHEMBL4256166 | 0.73 | DPP4 (0.32) | — | |
| SCHEMBL19947945 | 0.73 | DPP4 (0.32) | — | |
| SCHEMBL19947946 | 0.73 | DPP4 (0.32) | — | |
| SCHEMBL2041523 | 0.72 | DPP4 (0.34) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL30067725 | 0.72 | DPP4 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011075699-A2 | COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2011-06-23 | — | — | WO | disclosed |