Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NAMPT | P43490 | 4/20 | 0.49 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.48 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.48 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | TMPRSS2 | O15393 | 2/20 | 0.48 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SYK | P43405 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20536803 | 0.84 | NPC1 (0.50) | NPC1RAB9AKMT2ANAMPTPDE4B | |
| SCHEMBL2639196 | 0.81 | HSD17B3 (0.68) | HSD17B3NPC1RAB9AKMT2AGRIN2D | |
| SCHEMBL8241175 | 0.78 | GAA (0.72) | KMT2ANAMPTPDE4BGAAL3MBTL1 | |
| SCHEMBL6974860 | 0.78 | GAA (0.55) | HSD17B3NPC1RAB9AKMT2ANAMPT | |
| SCHEMBL31018393 | 0.78 | NPC1 (0.49) | NPC1RAB9AKMT2ANAMPTPDE4B | |
| SCHEMBL20536418 | 0.78 | HSD17B3 (0.57) | HSD17B3NPC1RAB9AKMT2ANAMPT | |
| SCHEMBL20537078 | 0.77 | HSD17B3 (0.53) | HSD17B3NPC1RAB9AKMT2AGRIN2D | |
| SCHEMBL1948827 | 0.76 | ESR2 (0.60) | HSD17B3NPC1RAB9ANAMPTTMPRSS2 | |
| SCHEMBL1722472 | 0.75 | NAMPT (0.65) | NPC1RAB9AKMT2ANAMPTSLC6A7 | |
| SCHEMBL14871708 | 0.75 | KDM4E (0.62) | HSD17B3NPC1RAB9AKMT2ATMPRSS2 |
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-2438055-B1 | DIHYDROINDOLE AND TETRAHYDROISOQUINOLINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL INHIBITORS | JAPAN TOBACCO INC (JP) | 2018-10-24 | — | — | EP | claimed |