Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.33 |
| ▸ | CDK2 | P24941 | 3/20 | 0.33 |
| ▸ | CCNK | O75909 | 2/20 | 0.33 |
| ▸ | CCND3 | P30281 | 2/20 | 0.33 |
| ▸ | CDK9 | P50750 | 2/20 | 0.33 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.33 |
| ▸ | INSR | P06213 | 2/20 | 0.32 |
| ▸ | IGF1R | P08069 | 2/20 | 0.32 |
| ▸ | BCL6 | P41182 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22595435 | 1.00 | EGFR (0.40) | EGFRADRA2AADRA2CADRA2BADRA1D | |
| SCHEMBL30018868 | 0.88 | EGFR (0.40) | EGFRIGF1RMEN1KMT2A | |
| SCHEMBL22588492 | 0.88 | EGFR (0.40) | EGFRIGF1RMEN1KMT2A | |
| SCHEMBL29757745 | 0.88 | EGFR (0.49) | EGFRCDK9ALKINSRIGF1R | |
| SCHEMBL22025609 | 0.88 | EGFR (0.49) | EGFRCDK9ALKINSRIGF1R | |
| SCHEMBL27076009 | 0.79 | BCL6 (0.38) | EGFRADRA2AADRA2CADRA2BADRA1D | |
| SCHEMBL22025610 | 0.78 | CCNA2 (0.34) | EGFRADRA2AADRA2CADRA2BADRA1D | |
| SCHEMBL30741198 | 0.78 | CCNA2 (0.34) | EGFRADRA2AADRA2CADRA2BADRA1D | |
| SCHEMBL31284251 | 0.78 | EGFR (0.34) | EGFRADRA2AADRA2CADRA2BADRA1D | |
| SCHEMBL22026203 | 0.78 | EGFR (0.45) | EGFR |
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-113166103-B | EGFR inhibitor and application thereof | 江苏先声药业有限公司 | 2022-12-16 | — | — | CN | disclosed |