Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 9/20 | 0.58 |
| ▸ | CCNK | O75909 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2829267 | 0.88 | GRM5 (0.55) | GRM5CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL2829877 | 0.87 | GRM5 (0.45) | GRM5CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL2830049 | 0.82 | GRM5 (0.60) | GRM5 | |
| SCHEMBL2828771 | 0.81 | GRM5 (0.55) | GRM5NTRK1 | |
| SCHEMBL2830257 | 0.81 | GRM5 (0.50) | GRM5CYP1A2NTRK1 | |
| SCHEMBL2826292 | 0.79 | GRM5 (0.44) | GRM5NTRK1 | |
| SCHEMBL2824785 | 0.78 | GRM5 (0.70) | GRM5 | |
| SCHEMBL2828398 | 0.78 | GRM5 (0.47) | GRM5 | |
| SCHEMBL2827806 | 0.78 | GRM5 (0.44) | GRM5NTRK1 | |
| SCHEMBL2826336 | 0.78 | GRM5 (0.70) | GRM5CYP1A2CYP2C9CYP3A4 |
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-1844044-B1 | THIAZOLE-4-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-07-21 | — | — | EP | claimed |