Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRB2 | P47870 | 2/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | AGER | Q15109 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL15046472 | 0.95 | ABCB1 (0.49) | GABRB2GABRA2MAPTABCB1PTGS1 | |
| SCHEMBL15046476 | 0.92 | MAPT (0.52) | GABRB2GABRA2MAPTAGERSMN1; SMN2 | |
| SCHEMBL15046477 | 0.88 | GRM5 (0.43) | GABRB2GABRA2MAPTABCB1PTGS1 | |
| SCHEMBL15033978 | 0.87 | GABRA2 (0.43) | GABRB2GABRA2MAPTPTGS1AGER | |
| SCHEMBL15019885 | 0.86 | GABRA2 (0.42) | GABRB2GABRA2MAPTPTGS1AGER | |
| SCHEMBL15046461 | 0.86 | GABRA2 (0.42) | GABRB2GABRA2MAPTPTGS1AGER | |
| Lithium Ion SCHEMBL15019886 | 0.85 | GABRB2 (0.41) | GABRB2GABRA2MAPTABCB1PTGS1 | |
| SCHEMBL15034001 | 0.84 | MAPT (0.51) | GABRB2GABRA2MAPTABCB1PTGS1 | |
| SCHEMBL15020142 | 0.83 | GABRA2 (0.55) | GABRB2GABRA2MAPTSMN1; SMN2LMNA | |
| SCHEMBL15033980 | 0.81 | MAPT (0.52) | GABRB2GABRA2MAPTAGERSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013087807-A1 | 4-ARYL IMIDAZOLE DERIVATIVES AS MGLU5 POSITIVE ALLESTERIC MODIULATORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-06-20 | — | — | WO | disclosed |
| WO-2013087806-A1 | PIPERAZINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLU5 RECEPTORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-06-20 | — | — | WO | disclosed |