Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 13/20 | 0.83 |
| ▸ | INSR | P06213 | 2/20 | 0.72 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.72 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.68 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.68 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.68 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.67 |
| ▸ | CDC7 | O00311 | 1/20 | 0.67 |
| ▸ | PLK4 | O00444 | 1/20 | 0.67 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.67 |
| ▸ | AURKA | O14965 | 1/20 | 0.67 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.67 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.67 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.67 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.67 |
| ▸ | JAK2 | O60674 | 1/20 | 0.67 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.67 |
| ▸ | PAK4 | O96013 | 1/20 | 0.67 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.67 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28053870 | 0.99 | EGFR (0.82) | EGFRINSRALKMAPK8MAPK9 | |
| SCHEMBL28445838 | 0.92 | EGFR (0.80) | EGFRINSRALKMAPK8MAPK9 | |
| SCHEMBL28053891 | 0.92 | JAK3 (0.77) | EGFRALKPLK4JAK2FLT3 | |
| SCHEMBL2722635 | 0.91 | EGFR (1.00) | EGFRINSRALKPLK4JAK2 | |
| SCHEMBL28579656 | 0.90 | EGFR (0.83) | EGFRALKMAPK3 | |
| SCHEMBL28589279 | 0.89 | ALK (0.71) | EGFRINSRALKAURKAIGF1R | |
| SCHEMBL28053991 | 0.89 | JAK3 (0.73) | EGFRALKPLK4JAK2FLT3 | |
| SCHEMBL28053871 | 0.89 | EGFR (0.75) | EGFRINSRALKMAPK8MAPK9 | |
| Hydrochloric Acid SCHEMBL28053993 | 0.88 | EGFR (0.74) | EGFRINSRALKMAPK8MAPK9 | |
| SCHEMBL28447722 | 0.87 | EGFR (0.78) | EGFRALKJAK3 |
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 |