Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | MTOR | P42345 | 2/20 | 0.37 |
| ▸ | GRM5 | P41594 | 2/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | GCK | P35557 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15663798 | 0.86 | NPC1 (0.44) | NOTUMNPC1RAB9APIK3CAMTOR | |
| SCHEMBL15663956 | 0.85 | PDE10A (0.38) | NOTUMNPC1RAB9APIK3CAMTOR | |
| SCHEMBL15663618 | 0.83 | PDE10A (0.43) | NOTUMNPC1RAB9APIK3CAMTOR | |
| SCHEMBL15663440 | 0.83 | GRM5 (0.49) | NOTUMNPC1RAB9APIK3CAMTOR | |
| SCHEMBL5201513 | 0.82 | PDE10A (0.53) | PDE4BPDE4DNOTUMNPC1RAB9A | |
| SCHEMBL15663415 | 0.82 | HPGDS (0.38) | NOTUMNPC1RAB9AGRM5PDE10A | |
| SCHEMBL15663961 | 0.82 | PDE10A (0.39) | NOTUMNPC1RAB9APIK3CAMTOR | |
| SCHEMBL15664200 | 0.81 | LPAR1 (0.34) | NPC1RAB9AGRM5HTTMAPT | |
| SCHEMBL15663513 | 0.81 | NPC1 (0.38) | NOTUMNPC1RAB9APIK3CAMTOR | |
| SCHEMBL15663526 | 0.80 | GRM5 (0.40) | PDE4DGRM5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1858854-B1 | PYRIDINE-2-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2014-05-07 | — | — | EP | claimed |