Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9938744 | 0.79 | GRM5 (0.42) | GRM5TDP1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL9900894 | 0.78 | GRM5 (0.39) | GRM5TDP1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL9977671 | 0.73 | GRM5 (0.41) | GRM5TDP1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL12076839 | 0.73 | GRM5 (0.41) | GRM5TDP1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL9900560 | 0.73 | ADORA3 (0.41) | GRM5TDP1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL9938273 | 0.73 | SMN1; SMN2 (0.46) | GRM5TDP1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL17340791 | 0.72 | SYK (0.44) | GRM5MAPTTSHRMAPK10 | |
| SCHEMBL6419868 | 0.70 | LMNA (0.51) | SMN1; SMN2POLBMAPTKMT2A | |
| SCHEMBL9900649 | 0.66 | GRM5 (0.41) | GRM5TDP1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL12076833 | 0.66 | GRM5 (0.37) | GRM5TDP1L3MBTL1SMN1; SMN2POLB |
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-2648723-A1 | BICYCLIC PYRAZOLE COMPOUNDS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | Vanderbilt University (US) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012078817-A1 | BICYCLIC PYRAZOLE COMPOUNDS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | VANDERBILT UNIVERSITY (US) | 2012-06-14 | — | — | WO | disclosed |