Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | P4HB | P07237 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4731198 | 0.84 | HTT (0.54) | HTTRAB9ANPC1ALDH1A1KMT2A | |
| SCHEMBL4783039 | 0.81 | RAB9A (0.54) | RAB9ANPC1ALDH1A1HSD17B3POLB | |
| SCHEMBL4599537 | 0.75 | TYR (0.37) | HTTPDGFRBKDRALDH1A1KMT2A | |
| SCHEMBL4783529 | 0.72 | PDE4B (0.54) | HTTRAB9ANPC1ALDH1A1KMT2A | |
| SCHEMBL10065555 | 0.70 | FOLH1 (0.37) | LMNATSHRSMN1; SMN2 | |
| SCHEMBL5042822 | 0.69 | KDR (0.33) | NPC1PDGFRBKDRALDH1A1KMT2A | |
| SCHEMBL8019351 | 0.69 | HTT (0.64) | HTTRAB9ANPC1ALDH1A1KMT2A | |
| SCHEMBL27502289 | 0.69 | HTT (0.46) | HTTRAB9ANPC1ALDH1A1KMT2A | |
| SCHEMBL4606260 | 0.68 | PDGFRB (0.33) | PDGFRBKDRHSD17B3 | |
| SCHEMBL5440246 | 0.68 | TBXAS1 (0.42) | LMNATSHRMAPK1HSD17B10SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008034579-A1 | 2-HETEROCYCLYL-5-PHENOXYMETHYLPYRIDINE DERIVATIVES AS ANTICANCER AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-03-27 | — | — | WO | disclosed |