Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL14843988 | 0.83 | CHRNB2 (0.43) | GRM5MMP13 | |
| SCHEMBL2560942 | 0.77 | KDM4E (0.37) | GRM5 | |
| SCHEMBL3785201 | 0.72 | AR (0.55) | — | |
| SCHEMBL6224475 | 0.72 | MMP13 (0.40) | GRM5MMP13 | |
| SCHEMBL8306096 | 0.70 | MAPT (0.42) | — | |
| SCHEMBL14840216 | 0.70 | GRM5 (0.44) | GRM5 | |
| SCHEMBL2559283 | 0.70 | GRM5 (0.32) | GRM5 | |
| SCHEMBL16702384 | 0.69 | DDB1 (0.42) | GRM5 | |
| SCHEMBL2560735 | 0.67 | GRM5 (0.40) | GRM5 | |
| SCHEMBL16701737 | 0.67 | SIRT6 (0.46) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2763977-A1 | ETHYNYL DERIVATIVES AS MGLUR5 ALLOSTERIC MODULATORS | F.HOFFMANN-LA ROCHE AG (CH) | 2014-08-13 | — | — | EP | disclosed |
| WO-2013050454-A1 | ETHYNYL DERIVATIVES AS MGLUR5 ALLOSTERIC MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-04-11 | — | — | WO | disclosed |