Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.70 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.56 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | ENPP3 | O14638 | 3/20 | 0.50 |
| ▸ | ENPP1 | P22413 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30362697 | 0.83 | CYP2C9 (0.67) | ALDH1A1L3MBTL1CYP2D6GAAMEN1 | |
| SCHEMBL7397808 | 0.76 | ALDH1A1 (0.52) | ALDH1A1GAAMEN1KMT2AHPGD | |
| SCHEMBL8098178 | 0.76 | KMT2A (0.60) | ALDH1A1GAAMEN1KMT2AHPGD | |
| SCHEMBL7644248 | 0.75 | BCAT1 (0.67) | BCAT1KAT6AGAAMEN1KMT2A | |
| SCHEMBL11532705 | 0.75 | BCAT1 (0.71) | ALDH1A1BCAT1KAT6AGAAMEN1 | |
| SCHEMBL8098185 | 0.75 | USP30 (0.56) | ALDH1A1ENPP3ENPP1 | |
| SCHEMBL4632757 | 0.74 | BCAT1 (0.60) | ALDH1A1BCAT1KAT6AGAAMEN1 | |
| SCHEMBL20268099 | 0.73 | HPGD (0.66) | ALDH1A1GAAMEN1KMT2AHPGD | |
| SCHEMBL4613052 | 0.72 | MAPT (0.54) | ALDH1A1GAAENPP3ENPP1HPGD | |
| SCHEMBL2361900 | 0.72 | BCAT1 (0.67) | BCAT1KAT6AGAAMEN1KMT2A |
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-105801582-A | Novel dihydro pteridinone derivative, preparing method thereof and application to medicine | 合肥工业大学 | 2016-07-27 | — | — | CN | disclosed |