Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 14/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | TSPO | P30536 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | HPD | P32754 | 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 | |
|---|---|---|---|---|
| SCHEMBL981736 | 0.95 | GRM5 (0.42) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL983162 | 0.92 | GRM5 (0.44) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL979792 | 0.87 | GRM5 (0.40) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL981320 | 0.85 | GRM5 (0.40) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL980683 | 0.85 | GRM5 (0.39) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL978638 | 0.82 | GRM5 (0.42) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL981743 | 0.81 | GRM5 (0.61) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL978610 | 0.80 | GRM5 (0.47) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL978950 | 0.77 | GRM5 (0.43) | GRM5KCNH2ADRB3TSPOTMEM97 | |
| SCHEMBL980933 | 0.77 | GRM5 (0.65) | GRM5KCNH2ADRB3TSPOTMEM97 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2456765-A1 | IMIDAZOLE DERIVATIVES AS MGLUR5 ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2012-05-30 | — | — | EP | claimed |
| WO-2011006910-A1 | IMIDAZOLE DERIVATIVES AS MGLUR5 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-01-20 | — | — | WO | claimed |
| EP-2456765-A1 | IMIDAZOLE DERIVATIVES AS MGLUR5 ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2012-05-30 | — | — | EP | disclosed |
| WO-2011006910-A1 | IMIDAZOLE DERIVATIVES AS MGLUR5 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-01-20 | — | — | WO | disclosed |