Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | NMT1 | P30419 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9900894 | 0.87 | GRM5 (0.39) | GRM5SMN1; SMN2POLBMAPTTDP1 | |
| SCHEMBL9900560 | 0.80 | ADORA3 (0.41) | GRM5SMN1; SMN2POLBMAPTTDP1 | |
| SCHEMBL17340791 | 0.79 | SYK (0.44) | GRM5MAPTCYP1A2CYP3A4GABRA1 | |
| SCHEMBL9900896 | 0.79 | GRM5 (0.38) | GRM5SMN1; SMN2POLBMAPTTDP1 | |
| SCHEMBL12076839 | 0.78 | GRM5 (0.41) | GRM5SMN1; SMN2POLBMAPTTDP1 | |
| SCHEMBL9977671 | 0.78 | GRM5 (0.41) | GRM5SMN1; SMN2POLBMAPTTDP1 | |
| SCHEMBL9938273 | 0.78 | SMN1; SMN2 (0.46) | GRM5SMN1; SMN2POLBMAPTTDP1 | |
| SCHEMBL6419868 | 0.75 | LMNA (0.51) | SMN1; SMN2POLBMAPTLMNAALDH1A1 | |
| SCHEMBL12076833 | 0.74 | GRM5 (0.37) | GRM5SMN1; SMN2POLBMAPTTDP1 | |
| SCHEMBL12076841 | 0.74 | GRM5 (0.37) | GRM5SMN1; SMN2POLBMAPTTDP1 |
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-2651222-A1 | BICYCLIC TRIAZOLE AND PYRAZOLE LACTAMS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | Vanderbilt University (US) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012083224-A1 | BICYCLIC TRIAZOLE AND PYRAZOLE LACTAMS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | VANDERBILT UNIVERSITY (US) | 2012-06-21 | — | — | WO | disclosed |