Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CPS1 | P31327 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20157894 | 0.92 | CES2 (0.50) | HTTCES2CES1 | |
| SCHEMBL21351893 | 0.89 | RAB9A (0.43) | NPC1MAPTSMN1; SMN2RAB9ATP53 | |
| SCHEMBL9726681 | 0.89 | CSNK2A1 (0.47) | NPC1MAPTMAPK1HTTDGAT1 | |
| SCHEMBL27774516 | 0.89 | MAPT (0.44) | NPC1MAPTMAPK1HTTCSNK2A1 | |
| SCHEMBL20157772 | 0.86 | LOXL2 (0.38) | NPC1MAPTMAPK1HTTDGAT1 | |
| SCHEMBL20157805 | 0.86 | NPC1 (0.35) | NPC1MAPTMAPK1HTTDGAT1 | |
| SCHEMBL21550069 | 0.81 | CES2 (0.38) | NPC1MAPTMAPK1HTTDGAT1 | |
| SCHEMBL20158071 | 0.81 | KMT2A (0.36) | NPC1MAPTMAPK1HTTLOXL2 | |
| SCHEMBL20157825 | 0.80 | HPGD (0.45) | NPC1MAPTHTTCSNK2A1CES2 | |
| SCHEMBL11755563 | 0.80 | CES2 (0.50) | NPC1MAPTHTTHDAC7CES2 |
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-2018086605-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |