Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 19/20 | 0.58 |
| ▸ | INSR | P06213 | 15/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.53 |
| ▸ | NPM1 | P06748 | 7/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | RET | P07949 | 1/20 | 0.45 |
| ▸ | IGF1R | P08069 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 1/20 | 0.45 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL25449320 | 0.96 | ALK (0.57) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL24179116 | 0.94 | EGFR (0.51) | ALKINSRKCNH2EGFRRET | |
| SCHEMBL24178914 | 0.92 | ALK (0.49) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL24178969 | 0.88 | ALK (0.59) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL24179117 | 0.86 | ALK (0.59) | ALKINSRKCNH2NPM1EGFR | |
| SCHEMBL24178916 | 0.86 | EGFR (0.48) | ALKINSREGFRRETIGF1R | |
| SCHEMBL24178970 | 0.83 | ALK (0.58) | ALKINSRKCNH2NPM1CYP3A4 | |
| SCHEMBL24178983 | 0.82 | EGFR (0.58) | ALKINSREGFRRETIGF1R | |
| SCHEMBL24178966 | 0.81 | EGFR (0.60) | ALKINSREGFRABL1ERBB2 | |
| SCHEMBL25449097 | 0.81 | EGFR (0.67) | ALKINSREGFRRETIGF1R |
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-4177258-A1 | ARYLPHOSPHINE OXIDE COMPOUNDS AND USE THEREOF | Chengdu Di'Ao Jiuhong Pharmaceutical Factory (CN) | 2023-05-10 | — | — | EP | disclosed |