Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | FNTA | P49354 | 1/20 | 0.40 |
| ▸ | FNTB | P49356 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 6/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.38 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL28710574 | 0.96 | NPC1 (0.40) | NPC1RAB9AFNTAFNTBALDH1A1 | |
| SCHEMBL28714867 | 0.96 | NPC1 (0.45) | NPC1RAB9AFNTAFNTBALDH1A1 | |
| SCHEMBL28699449 | 0.92 | EPHX2 (0.40) | NPC1RAB9AFNTAFNTBGAA | |
| SCHEMBL28714848 | 0.88 | LMNA (0.45) | NPC1RAB9AALDH1A1GAAKMT2A | |
| SCHEMBL28718835 | 0.88 | KDM4E (0.44) | FNTAFNTBGAASLC6A9KMT2A | |
| SCHEMBL28708573 | 0.88 | LMNA (0.43) | NPC1RAB9AFNTAFNTBALDH1A1 | |
| SCHEMBL28714844 | 0.86 | NPC1 (0.45) | NPC1RAB9AFNTAFNTBKCNK3 | |
| SCHEMBL28711974 | 0.85 | GAA (0.46) | NPC1RAB9AFNTAFNTBALDH1A1 | |
| SCHEMBL29120862 | 0.85 | SMN1; SMN2 (0.46) | NPC1RAB9AFNTAFNTBALDH1A1 | |
| SCHEMBL28710492 | 0.84 | LMNA (0.43) | NPC1RAB9AFNTAFNTBALDH1A1 |
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-113444005-B | Method for synthesizing novel glutaric acid compound from diaryl substituted non-activated olefin | 四川大学 | 2023-03-03 | — | — | CN | disclosed |
| CN-113444005-A | Method for synthesizing novel glutaric acid compound from diaryl substituted non-activated olefin | 四川大学 | 2021-09-28 | — | — | CN | disclosed |