Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 13/20 | 0.78 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | ULK1 | O75385 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12830294 | 0.91 | GRM5 (0.66) | GRM5KDM4EALDH1A1PTGS1ULK1 | |
| SCHEMBL6926593 | 0.89 | GRM5 (0.63) | GRM5KDM4EALDH1A1MAPTGFER | |
| SCHEMBL12416421 | 0.88 | GRM5 (0.80) | GRM5 | |
| SCHEMBL6925013 | 0.88 | GRM5 (1.00) | GRM5ALDH1A1MAPT | |
| SCHEMBL6927321 | 0.87 | GRM5 (1.00) | GRM5 | |
| SCHEMBL6926675 | 0.85 | GRM5 (0.76) | GRM5BCAT2PTGS1 | |
| SCHEMBL12416423 | 0.84 | GRM5 (0.81) | GRM5BCAT2 | |
| SCHEMBL6928047 | 0.84 | GRM5 (1.00) | GRM5 | |
| SCHEMBL12830491 | 0.82 | GRM5 (0.53) | GRM5ALDH1A1MAPTGFERNPSR1 | |
| SCHEMBL12830501 | 0.79 | GRM5 (0.62) | GRM5PTGS1ULK1 |
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-2011035174-A1 | SUBSTITUTED HETEROARYLAMINE CARBOXAMIDE ANALOGS AS MGLUR5 NEGATIVE ALLOSTERIC MODULATORS AND METHODS OF MAKING AND USING THE SAME | VANDERBILT UNIVERSITY (US) | 2011-03-24 | — | — | WO | disclosed |