Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8158831 | 0.87 | — | — | |
| SCHEMBL23158171 | 0.84 | HRH3 (0.33) | HRH3CYP2D6 | |
| SCHEMBL8266529 | 0.81 | HRH3 (0.38) | ALDH1A1L3MBTL3L3MBTL1TLR9TLR7 | |
| SCHEMBL23269640 | 0.77 | L3MBTL1 (0.44) | ALDH1A1L3MBTL3L3MBTL1HRH3NCF1 | |
| SCHEMBL14307143 | 0.77 | L3MBTL1 (0.44) | ALDH1A1L3MBTL3L3MBTL1HRH3NCF1 | |
| SCHEMBL26577467 | 0.77 | L3MBTL3 (0.44) | ALDH1A1L3MBTL3L3MBTL1HRH3CYP2D6 | |
| SCHEMBL26042916 | 0.77 | L3MBTL3 (0.47) | ALDH1A1L3MBTL3L3MBTL1NCF1 | |
| SCHEMBL1158533 | 0.76 | CHRM1 (0.37) | ALDH1A1L3MBTL3L3MBTL1TLR9TLR7 | |
| SCHEMBL1106428 | 0.76 | ALDH1A1 (0.34) | ALDH1A1L3MBTL3L3MBTL1TLR9TLR7 | |
| SCHEMBL25470943 | 0.76 | ALDH1A1 (0.39) | ALDH1A1L3MBTL3L3MBTL1TLR9TLR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4129996-A1 | NOVEL AMINOPYRIMIDINE EGFR INHIBITOR | QILU PHARMACEUTICAL CO., LTD. (CN) | 2023-02-08 | — | — | EP | disclosed |