Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | MAPT | P10636 | 3/20 | 0.65 |
| ▸ | NPC1 | O15118 | 2/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | POLB | P06746 | 2/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.58 |
| ▸ | MCL1 | Q07820 | 6/20 | 0.55 |
| ▸ | BAD | Q92934 | 3/20 | 0.49 |
| ▸ | TERT | O14746 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL31542001 | 0.85 | TDP1 (1.00) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL20816055 | 0.79 | POLB (0.70) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL28396356 | 0.78 | TDP1 (0.64) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL1518274 | 0.78 | POLB (0.71) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL28398678 | 0.77 | POLB (0.67) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL13490857 | 0.76 | POLB (0.66) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL14519061 | 0.74 | ALDH1A1 (0.71) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL6802019 | 0.74 | ALDH1A1 (0.70) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL28398729 | 0.74 | POLB (0.63) | TDP1ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL16222983 | 0.74 | POLB (0.60) | TDP1ALDH1A1MAPTNPC1RAB9A |
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-111039929-A | Antitumor compound NY and series derivatives thereof | 中国人民解放军北部战区总医院 | 2020-04-21 | — | — | CN | disclosed |