Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | CASP7 | P55210 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL4002552 | 0.84 | NPC1 (0.46) | KDM4EMAPK1ALDH1A1LMNATSHR | |
| SCHEMBL4002555 | 0.84 | NPC1 (0.43) | KDM4EMAPK1ALDH1A1LMNATSHR | |
| SCHEMBL3997966 | 0.80 | SSTR5 (0.44) | KDM4EALDH1A1HSD17B10RAB9AMAPT | |
| SCHEMBL1873052 | 0.79 | KDM4E (0.48) | KDM4EMAPK1ALDH1A1LMNATSHR | |
| SCHEMBL1874888 | 0.78 | SSTR5 (0.46) | KDM4EALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL3996771 | 0.77 | SSTR5 (0.43) | KDM4EMAPK1ALDH1A1LMNATSHR | |
| SCHEMBL3998044 | 0.74 | SSTR5 (0.45) | KDM4EMAPK1ALDH1A1HSD17B10RAB9A | |
| SCHEMBL4000500 | 0.73 | APP (0.40) | KDM4EMAPK1ALDH1A1LMNATSHR | |
| SCHEMBL3999698 | 0.72 | SSTR5 (0.45) | KDM4EMAPK1ALDH1A1LMNATSHR | |
| SCHEMBL4002214 | 0.72 | SSTR5 (0.50) | KDM4EALDH1A1SSTR5MEN1KMT2A |
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-2066658-A1 | PYRIDINE- AND QUINOLINE-PYRIMIDINE-DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2009-06-10 | — | — | EP | disclosed |
| WO-2008031735-A1 | PYRIDINE- AND QUINOLINE-PYRIMIDINE-DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-03-20 | — | — | WO | disclosed |