Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.43 |
| ▸ | CCR6 | P51684 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9839029 | 0.81 | TDP1 (0.72) | TDP1ALDH1A1MAPTNCOA1NCOA3 | |
| SCHEMBL9839023 | 0.81 | TDP1 (0.72) | TDP1ALDH1A1MAPTNCOA1NCOA3 | |
| SCHEMBL25822355 | 0.74 | ALDH1A1 (0.43) | TDP1ALDH1A1LMNAMAPTHPGD | |
| SCHEMBL1394957 | 0.73 | TDP1 (0.69) | TDP1ALDH1A1LMNAMAPTNCOA1 | |
| SCHEMBL57166 | 0.72 | TDP1 (1.00) | TDP1ALDH1A1NCOA1NCOA3GAA | |
| SCHEMBL29475175 | 0.72 | TDP1 (1.00) | TDP1ALDH1A1NCOA1NCOA3GAA | |
| SCHEMBL1516611 | 0.71 | NPC1 (0.40) | ALDH1A1MAPTMCL1NPC1RAB9A | |
| SCHEMBL1516612 | 0.71 | NPC1 (0.40) | ALDH1A1MAPTMCL1NPC1RAB9A | |
| SCHEMBL22120893 | 0.71 | PTGS2 (0.34) | TDP1ALDH1A1LMNAMAPTHPGD | |
| SCHEMBL34471249 | 0.70 | KMT2A (0.50) | TDP1ALDH1A1LMNAMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125989-A1 | QUINAZOLINE COMPOUND AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |