Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.59 |
| ▸ | CCNK | O75909 | 2/20 | 0.58 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.58 |
| ▸ | CDK2 | P24941 | 2/20 | 0.58 |
| ▸ | CCND3 | P30281 | 2/20 | 0.58 |
| ▸ | CDK9 | P50750 | 2/20 | 0.58 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.58 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.55 |
| ▸ | MAP3K7 | O43318 | 4/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.53 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.53 |
| ▸ | SRC | P12931 | 1/20 | 0.53 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.53 |
| ▸ | AXL | P30530 | 1/20 | 0.51 |
| ▸ | NEK2 | P51955 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 3/20 | 0.51 |
| ▸ | FLT3 | P36888 | 1/20 | 0.51 |
| ▸ | BTK | Q06187 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL30948600 | 0.90 | EGFR (0.49) | EGFRCCNKCCNA2CDK2CCND3 | |
| SCHEMBL29253729 | 0.84 | EGFR (0.81) | EGFRALK | |
| SCHEMBL30948623 | 0.84 | EGFR (0.50) | EGFRCCNKCCNA2CDK2CCND3 | |
| SCHEMBL30948584 | 0.83 | EGFR (0.53) | EGFRALKAXL | |
| SCHEMBL30948583 | 0.83 | EGFR (0.53) | EGFRALKAXL | |
| SCHEMBL22520206 | 0.83 | EGFR (0.57) | EGFRALKBRD4 | |
| SCHEMBL30833650 | 0.81 | LRRK2 (0.48) | CCNKCCNA2CDK2CCND3CDK9 | |
| SCHEMBL29190653 | 0.81 | LRRK2 (0.48) | CCNKCCNA2CDK2CCND3CDK9 | |
| SCHEMBL30948582 | 0.81 | EGFR (0.50) | EGFRCCNA2CDK2ALKMAPK1 | |
| SCHEMBL22246172 | 0.81 | MAPK9 (0.54) | EGFRCCNKCCNA2CDK2CCND3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113677680-B | EGFR inhibitor, composition and application thereof | 贝达药业股份有限公司 | 2024-05-10 | — | — | CN | disclosed |