Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | MEN1 | O00255 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 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 | |
|---|---|---|---|---|
| SCHEMBL29720842 | 0.84 | MAPT (0.46) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL29720937 | 0.83 | NOTUM (0.49) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL28876470 | 0.71 | TDP1 (0.37) | MAPTMAPK1HTTLMNAKDM4E | |
| SCHEMBL23148032 | 0.70 | KDM4E (0.50) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL2459873 | 0.69 | KMT2A (0.52) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL3231306 | 0.69 | MAPK1 (0.56) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL23146829 | 0.68 | POLB (0.49) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL23147647 | 0.68 | KDM4E (0.50) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL23146885 | 0.67 | MEN1 (0.47) | MAPTMAPK1HTTLMNAHSP90AA1 | |
| SCHEMBL28672072 | 0.67 | NOTUM (0.51) | MAPTLMNAKDM4EL3MBTL1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-110627796-B | Nitrogenous heterocyclic derivative and application thereof in medicine | 北京越之康泰生物医药科技有限公司 | 2022-07-12 | — | — | CN | disclosed |