Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SCD | O00767 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL15663450 | 0.92 | GRM5 (0.41) | GRM5NPC1POLBTSHRMAPK1 | |
| SCHEMBL15663669 | 0.89 | GRM5 (0.44) | GRM5NPC1POLBTSHRMAPK1 | |
| SCHEMBL15663871 | 0.82 | PDE10A (0.36) | GRM5TSHRMAPK1PDE10ACYP3A4 | |
| SCHEMBL15664204 | 0.81 | PDE10A (0.41) | GRM5NPC1KMT2ATSHRMAPK1 | |
| SCHEMBL15663528 | 0.78 | GRM5 (0.48) | GRM5NPC1KMT2APOLBTSHR | |
| SCHEMBL15663949 | 0.78 | RAB9A (0.41) | GRM5NPC1KMT2APOLBTSHR | |
| SCHEMBL15663562 | 0.78 | GRM5 (0.43) | GRM5NPC1KMT2APOLBMAPK1 | |
| SCHEMBL17685477 | 0.77 | NPC1 (0.49) | GRM5NPC1CYP3A4MAPTDRD3 | |
| SCHEMBL17685493 | 0.77 | GRM5 (0.45) | GRM5NPC1POLBCYP3A4MAPT | |
| SCHEMBL15664037 | 0.77 | PDE10A (0.45) | NPC1HSD17B10PDE10AMAPTRAB9A |
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 |