Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28291731 | 0.79 | SMN1; SMN2 (0.46) | SMN1; SMN2NPC1RAB9AALDH1A1L3MBTL1 | |
| SCHEMBL20890612 | 0.75 | NPC1 (0.42) | SMN1; SMN2NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL28808607 | 0.74 | UHRF1 (0.41) | SMN1; SMN2NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL28291727 | 0.74 | LMNA (0.36) | SMN1; SMN2NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL31312593 | 0.72 | ALDH1A1 (0.42) | SMN1; SMN2NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL24405150 | 0.72 | EGLN1 (0.49) | SMN1; SMN2ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL28291722 | 0.72 | KMT2A (0.41) | SMN1; SMN2NPC1RAB9AKDM4EMEN1 | |
| SCHEMBL129055 | 0.71 | UHRF1 (0.48) | SMN1; SMN2NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL29608524 | 0.71 | UHRF1 (0.48) | SMN1; SMN2NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL14556108 | 0.70 | ALDH1A1 (0.46) | SMN1; SMN2NPC1RAB9AALDH1A1MAPK10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109608390-B | Synthesis method of chiral quaternary carbon pyridine beta-hydroxy ester compound | 温州大学 | 2022-03-25 | — | — | CN | disclosed |
| CN-109608390-A | A kind of synthetic method of chirality quaternary carbon pyridines β hydroxyl esters compound | 温州大学 | 2019-04-12 | — | — | CN | disclosed |