Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 12/20 | 0.45 |
| ▸ | GRM5 | P41594 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5202197 | 0.78 | PDE10A (0.46) | PDE10AGRM5ALDH1A1 | |
| SCHEMBL4905280 | 0.74 | PDE10A (0.36) | PDE10A | |
| SCHEMBL15663562 | 0.70 | GRM5 (0.43) | PDE10AGRM5SMN1; SMN2TAS1R3TAS1R1 | |
| SCHEMBL4897692 | 0.68 | METAP1 (0.47) | GRM5SMN1; SMN2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL4907660 | 0.68 | PDE10A (0.57) | PDE10AGRM5 | |
| SCHEMBL15663669 | 0.67 | GRM5 (0.44) | GRM5SMN1; SMN2KDM4ENPC1MAPT | |
| SCHEMBL1386262 | 0.66 | PDE10A (0.52) | PDE10AGRM5KDM4ENPC1MAPT | |
| SCHEMBL2160799 | 0.65 | PDE10A (0.49) | PDE10AGRM5SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL1386509 | 0.64 | NPC1 (0.58) | GRM5SMN1; SMN2KDM4ENPC1MAPT | |
| SCHEMBL15663871 | 0.64 | PDE10A (0.36) | PDE10AGRM5LMNAMAPTNPSR1 |
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-1858854-A1 | PYRIDINE-2-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2007-11-28 | — | — | EP | disclosed |
| WO-2006094639-A1 | PYRIDINE-2-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | F.HOFFMANN-LA ROCHE AG (CH) | 2006-09-14 | — | — | WO | disclosed |