Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 8/20 | 0.41 |
| ▸ | EGFR | P00533 | 4/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.37 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29253659 | 1.00 | CDK1 (0.41) | CDK1EGFRABCG2ZAP70MEN1 | |
| SCHEMBL28650588 | 0.90 | BRD4 (0.40) | ABCG2MEN1CYP1A2CYP3A4MAPT | |
| SCHEMBL30948628 | 0.90 | BRD4 (0.40) | ABCG2MEN1CYP1A2CYP3A4MAPT | |
| SCHEMBL28650090 | 0.86 | EGFR (0.48) | EGFR | |
| SCHEMBL30948581 | 0.81 | EGFR (0.40) | EGFR | |
| SCHEMBL30948586 | 0.79 | EGFR (0.44) | EGFR | |
| SCHEMBL30948609 | 0.79 | ABCG2 (0.41) | ABCG2ZAP70CDK2STK17A | |
| SCHEMBL30626557 | 0.78 | EGFR (0.45) | EGFRZAP70MEN1MAPTKMT2A | |
| SCHEMBL28531353 | 0.78 | EGFR (0.45) | EGFRZAP70MEN1MAPTKMT2A | |
| SCHEMBL25002512 | 0.77 | IGF1R (0.39) | CDK1EGFRZAP70 |
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 |