Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 10/20 | 0.43 |
| ▸ | RAB9A | P51151 | 10/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GCK | P35557 | 1/20 | 0.40 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4911124 | 0.84 | METAP1 (0.47) | METAP1NPC1RAB9APOLBMAPT | |
| SCHEMBL1691027 | 0.75 | MAPT (0.55) | NPC1RAB9APOLBMAPTALDH1A1 | |
| SCHEMBL4905818 | 0.74 | METAP1 (0.45) | METAP1NPC1RAB9AMAPTKMT2A | |
| SCHEMBL4897692 | 0.74 | METAP1 (0.47) | METAP1NPC1RAB9AMAPTKMT2A | |
| SCHEMBL4905472 | 0.73 | ADORA1 (0.51) | METAP1NPC1RAB9AMAPTKMT2A | |
| SCHEMBL5207905 | 0.71 | NPC1 (0.47) | NPC1RAB9AMAPTKMT2AALDH1A1 | |
| SCHEMBL4909182 | 0.69 | METAP1 (0.45) | METAP1GRM5PI4KB | |
| SCHEMBL7935269 | 0.69 | HDAC1 (0.51) | NPC1RAB9APOLBMAPTALDH1A1 | |
| SCHEMBL27323009 | 0.68 | MAPK1 (0.62) | NPC1RAB9APOLBMAPTALDH1A1 | |
| SCHEMBL27321055 | 0.67 | GAA (0.49) | NPC1RAB9APOLBMAPTALDH1A1 |
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 |