Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13910328 | 0.85 | HPGD (0.38) | ALDH1A1MAPTTP53HPGDTDP1 | |
| SCHEMBL28174459 | 0.83 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL28174457 | 0.82 | CRHBP (0.37) | ALDH1A1LMNAMEN1KMT2AMAPK1 | |
| SCHEMBL518384 | 0.79 | TSHR (0.47) | ALDH1A1NPC1RAB9AMAPTHPGD | |
| SCHEMBL6626633 | 0.77 | TSHR (0.45) | ALDH1A1NPC1RAB9AMAPTNPSR1 | |
| SCHEMBL1204500 | 0.75 | TDP1 (0.42) | ALDH1A1MAPTGAALMNANPSR1 | |
| SCHEMBL7823987 | 0.72 | PTPN1 (0.41) | ALDH1A1NPC1RAB9AMAPTGAA | |
| SCHEMBL14072818 | 0.71 | ACHE (0.39) | NPC1RAB9AMAPTSMN1; SMN2NPSR1 | |
| SCHEMBL9001542 | 0.71 | TDP1 (0.42) | ALDH1A1GAALMNATP53HPGD | |
| SCHEMBL25797515 | 0.69 | POLB (0.50) | ALDH1A1NPC1RAB9AMAPTGAA |
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-107226827-A | A kind of preparation method of chiral phosphorus fluorenes oxide | 杭州师范大学 | 2017-10-03 | — | — | CN | disclosed |