Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL20157430 | 0.85 | MAPT (0.60) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL20157554 | 0.80 | MAPT (0.54) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL21362630 | 0.78 | HPGD (0.38) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL4900360 | 0.78 | ALDH1A1 (0.67) | MAPTHTTALDH1A1LMNAAKR1C3 | |
| SCHEMBL27992485 | 0.78 | MAPT (0.49) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL24199841 | 0.77 | MAPT (0.51) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL11746063 | 0.77 | MAPT (0.38) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL8063796 | 0.76 | MAPT (0.71) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL20157891 | 0.72 | KDM1A (0.43) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL38133 | 0.72 | ALDH1A1 (0.58) | MAPTHTTMAPK1ALDH1A1LMNA |
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-3539960-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) | 2019-09-18 | — | — | EP | disclosed |