Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.73 |
| ▸ | MAPT | P10636 | 6/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.73 |
| ▸ | MEN1 | O00255 | 5/20 | 0.73 |
| ▸ | HPGD | P15428 | 4/20 | 0.73 |
| ▸ | NPC1 | O15118 | 3/20 | 0.73 |
| ▸ | RAB9A | P51151 | 3/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.73 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.73 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.73 |
| ▸ | RELA | Q04206 | 1/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.63 |
| ▸ | LMNA | P02545 | 4/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.63 |
| ▸ | PKM | P14618 | 2/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL13727538 | 1.00 | ALDH1A1 (0.73) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL13727541 | 1.00 | ALDH1A1 (0.73) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL13723443 | 0.85 | MAPT (0.79) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL30090669 | 0.85 | MAPT (0.79) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL13723439 | 0.85 | MAPT (0.79) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL30090660 | 0.85 | MAPT (1.00) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL30734355 | 0.85 | MAPT (1.00) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL656595 | 0.85 | MAPT (1.00) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL656596 | 0.85 | MAPT (1.00) | ALDH1A1MAPTKMT2AMEN1HPGD | |
| SCHEMBL16210969 | 0.83 | MEN1 (0.91) | ALDH1A1MAPTKMT2AMEN1HPGD |
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 |