Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 2/20 | 0.43 |
| ▸ | BPTF | Q12830 | 1/20 | 0.41 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.41 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 4/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.37 |
| ▸ | MOK | Q9UQ07 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28549342 | 0.87 | ACHE (0.48) | ACHEADORA2ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL2202919 | 0.84 | AURKB (0.53) | RETADORA2AJAK2HDAC6MOK | |
| SCHEMBL28557357 | 0.83 | AURKB (0.49) | BPTFADORA2ASMN1; SMN2ALDH1A1ADORA3 | |
| SCHEMBL28022063 | 0.80 | SMN1; SMN2 (0.42) | LMNASMN1; SMN2ALDH1A1TP53MAPT | |
| SCHEMBL28565368 | 0.79 | AURKB (0.44) | BPTFLMNASMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL28556178 | 0.77 | AURKA (0.39) | SMN1; SMN2ALDH1A1TP53MAPT | |
| SCHEMBL28021591 | 0.76 | AURKB (0.51) | ADORA2ALMNAALDH1A1ADORA3MAPT | |
| SCHEMBL28022078 | 0.75 | PKM (0.44) | LMNAALDH1A1MAPT | |
| SCHEMBL28021607 | 0.75 | SLC2A1 (0.44) | ACHELMNASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28022048 | 0.75 | AURKA (0.46) | ALDH1A1MAPT |
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-112755193-A | Method of treating malignancies with anti-tyrosine kinase inhibitors using dianhydrogalactitol or a derivative thereof | 德玛医药 | 2021-05-07 | — | — | CN | disclosed |