Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 14/20 | 0.63 |
| ▸ | EGFR | P00533 | 2/20 | 0.51 |
| ▸ | IGF1R | P08069 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | TTK | P33981 | 1/20 | 0.48 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.48 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.48 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.48 |
| ▸ | INSR | P06213 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28053990 | 0.88 | ALK (0.59) | ALKEGFRIGF1RTTKINSR | |
| SCHEMBL28053893 | 0.87 | ALK (0.63) | ALKEGFRIGF1RKCNH2TTK | |
| SCHEMBL16752907 | 0.83 | ALK (0.80) | ALK | |
| SCHEMBL2060725 | 0.83 | ALK (0.82) | ALKEGFRIGF1RKCNH2LRRK2 | |
| SCHEMBL28053885 | 0.83 | ALK (0.54) | ALKIGF1RTTKLRRK2INSR | |
| SCHEMBL28053862 | 0.83 | EGFR (0.54) | ALKEGFRIGF1RKCNH2TTK | |
| SCHEMBL28053876 | 0.80 | ALK (0.64) | ALKEGFR | |
| SCHEMBL16752958 | 0.77 | ALK (1.00) | ALKEGFRLRRK2INSR | |
| SCHEMBL4820325 | 0.76 | GAA (0.62) | EGFR | |
| SCHEMBL30502344 | 0.76 | ALK (0.87) | ALKEGFRIGF1RKCNH2LRRK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105384694-B | Substituted aminopyrimidine derivative and preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2020-09-04 | — | — | CN | disclosed |
| CN-105384694-A | Substituted aminopyrimidine derivative, preparation method therefor and pharmaceutical application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-03-09 | — | — | CN | disclosed |