Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARG | Q86W56 | 2/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.41 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.36 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | BRD1 | O95696 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10145950 | 0.86 | MAPK14 (0.53) | MAPK14GRM2METAP2CHEK1ALDH1A1 | |
| SCHEMBL10146326 | 0.85 | PIK3CA (0.42) | MAPK14ALDH1A1HSD17B10MAPTSMN1; SMN2 | |
| SCHEMBL14993164 | 0.81 | PARG (0.43) | PARGPGRMAPK14GRM2ALDH1A1 | |
| SCHEMBL10145948 | 0.77 | GRM2 (0.49) | MAPK14GRM2METAP2CHEK1CYP1A2 | |
| SCHEMBL10145941 | 0.75 | GRM2 (0.47) | PGRMAPK14GRM2METAP2CHEK1 | |
| SCHEMBL10146676 | 0.75 | GRM2 (0.47) | PARGMAPK14GRM2METAP2CHEK1 | |
| SCHEMBL10146668 | 0.75 | GRM2 (0.70) | PARGGRM2METAP2 | |
| SCHEMBL15396477 | 0.75 | PARG (0.43) | PARGPGRMAPK14GRM2GSK3B | |
| SCHEMBL15396697 | 0.75 | PGR (0.50) | PARGPGRMAPK14GRM2GSK3B | |
| SCHEMBL6362809 | 0.74 | PGR (0.68) | PARGPGRGSK3BGSK3AALDH1A1 |
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-2012021382-A1 | POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 | MERCK SHARP & DOHME CORP. (US) | 2012-02-16 | — | — | WO | disclosed |