Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | EDNRA | P25101 | 2/20 | 0.37 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28368631 | 0.94 | LTA4H (0.40) | LTA4HCA4ALDH1A1KDM4ELMNA | |
| SCHEMBL11213027 | 0.81 | CA1 (0.52) | ALDH1A1KDM4ENPSR1TDP1L3MBTL1 | |
| SCHEMBL11569712 | 0.79 | CA1 (0.50) | ALDH1A1KDM4ENPSR1TDP1L3MBTL1 | |
| SCHEMBL11203843 | 0.76 | CA1 (0.46) | ALDH1A1KDM4ELMNANPSR1TDP1 | |
| SCHEMBL28156449 | 0.72 | LTA4H (0.52) | LTA4HCA4ALDH1A1KDM4ELMNA | |
| SCHEMBL11309190 | 0.71 | CA4 (0.50) | LTA4HCA4ALDH1A1KDM4ELMNA | |
| Pyridine SCHEMBL11569873 | 0.70 | CYP17A1 (0.39) | LTA4HALDH1A1KDM4ELMNANPSR1 | |
| SCHEMBL17529695 | 0.69 | LTA4H (0.57) | LTA4HCA4ALDH1A1NPSR1CES2 | |
| SCHEMBL231466 | 0.69 | CYP3A4 (0.45) | ALDH1A1KDM4ELMNATDP1L3MBTL1 | |
| SCHEMBL29598351 | 0.67 | CYP3A4 (0.43) | ALDH1A1KDM4ELMNATDP1L3MBTL1 |
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-110922427-A | Process for preparing diester of large steric hindrance alkyl substituted phosphonite | 温州大学 | 2020-03-27 | — | — | CN | disclosed |