Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.63 |
| ▸ | IGF1R | P08069 | 3/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.54 |
| ▸ | JAK1 | P23458 | 2/20 | 0.53 |
| ▸ | JAK2 | O60674 | 1/20 | 0.53 |
| ▸ | TNK2 | Q07912 | 3/20 | 0.47 |
| ▸ | CDK2 | P24941 | 2/20 | 0.46 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.45 |
| ▸ | CCNK | O75909 | 1/20 | 0.45 |
| ▸ | CDK7 | P50613 | 1/20 | 0.45 |
| ▸ | CDK9 | P50750 | 1/20 | 0.45 |
| ▸ | CCNH | P51946 | 1/20 | 0.45 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.45 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | JUN | P05412 | 1/20 | 0.45 |
| ▸ | MAPK8 | P45983 | 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 | |
|---|---|---|---|---|
| SCHEMBL14663383 | 1.00 | EGFR (0.63) | EGFRIGF1RKCNH2ALKJAK1 | |
| SCHEMBL23294110 | 0.94 | EGFR (0.61) | EGFRIGF1RKCNH2ALKJAK1 | |
| SCHEMBL29232072 | 0.91 | ALK (0.57) | EGFRIGF1RKCNH2ALKJAK1 | |
| SCHEMBL30956842 | 0.91 | ALK (0.57) | EGFRIGF1RKCNH2ALKJAK1 | |
| SCHEMBL29974570 | 0.91 | EGFR (0.74) | EGFRIGF1RKCNH2ALKCDK2 | |
| SCHEMBL14663439 | 0.91 | EGFR (0.74) | EGFRIGF1RKCNH2ALKCDK2 | |
| SCHEMBL14663329 | 0.89 | EGFR (0.60) | EGFRIGF1RKCNH2ALKTNK2 | |
| SCHEMBL14718523 | 0.87 | EGFR (0.61) | EGFRIGF1RKCNH2ALKJAK1 | |
| SCHEMBL517589 | 0.86 | EGFR (0.69) | EGFRIGF1RKCNH2ALKJAK1 | |
| SCHEMBL14719022 | 0.85 | EGFR (0.74) | EGFRIGF1RKCNH2CDK2DYRK1B |
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-4086246-A1 | 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS AS EGFR MODULATORS | AstraZeneca AB (SE) | 2022-11-09 | — | — | EP | disclosed |