Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TAS2R38 | P59533 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14868313 | 0.77 | TAS2R38 (0.45) | KMT2AHSD17B10ALDH1A1TAS2R38TP53 | |
| SCHEMBL7787793 | 0.74 | KMT2A (0.65) | KDM4EL3MBTL1KMT2AMEN1NPC1 | |
| SCHEMBL28960082 | 0.72 | ALDH1A1 (0.41) | KDM4EL3MBTL1KMT2ANPC1RAB9A | |
| SCHEMBL1740828 | 0.71 | ALDH1A1 (0.44) | KMT2AMEN1NPC1RAB9ANOX1 | |
| SCHEMBL2001630 | 0.71 | TAS2R38 (0.46) | KMT2AMEN1NPC1RAB9ANOX1 | |
| Hydrochloric Acid SCHEMBL31696764 | 0.70 | ALDH1A1 (0.42) | KMT2AMEN1HSD17B10ALDH1A1TAS2R38 | |
| SCHEMBL11668516 | 0.69 | ALDH1A1 (0.45) | KDM4EKMT2AMEN1HSD17B10ALDH1A1 | |
| Phenylguanidine SCHEMBL256023 | 0.68 | ALDH1A1 (0.58) | KMT2AMEN1NPC1RAB9ANOX1 | |
| SCHEMBL28899642 | 0.68 | ALDH1A1 (0.41) | KDM4EL3MBTL1HSD17B10ALDH1A1TAS2R38 | |
| SCHEMBL4097943 | 0.68 | KMT2A (0.53) | KDM4EL3MBTL1KMT2AMEN1NPC1 |
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-115414480-A | Dianhydrogalactitol in combination with radiation for treatment of non-small cell lung cancer and glioblastoma multiforme | 德玛医药 | 2022-12-02 | — | — | CN | disclosed |