Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 3/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | XBP1 | P17861 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20816055 | 0.80 | POLB (0.70) | TDP1POLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL31542001 | 0.78 | TDP1 (1.00) | TDP1POLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL28397126 | 0.78 | TDP1 (0.73) | TDP1POLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL27728902 | 0.77 | ALDH1A1 (0.77) | TDP1ALDH1A1MAPTLMNAHTT | |
| SCHEMBL28399269 | 0.75 | MEN1 (0.65) | TDP1POLBALDH1A1NPC1RAB9A | |
| SCHEMBL1518274 | 0.74 | POLB (0.71) | TDP1POLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL16027004 | 0.73 | ALDH1A1 (0.55) | TDP1POLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL28398678 | 0.73 | POLB (0.67) | TDP1POLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL6646033 | 0.73 | ALDH1A1 (0.70) | TDP1POLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL27552085 | 0.72 | ALDH1A1 (0.61) | TDP1POLBL3MBTL1ALDH1A1NPC1 |
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 |