Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 19/20 | 0.65 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.65 |
| ▸ | BRAF | P15056 | 2/20 | 0.65 |
| ▸ | CIT | O14578 | 2/20 | 0.65 |
| ▸ | GAK | O14976 | 2/20 | 0.65 |
| ▸ | EPHB6 | O15197 | 2/20 | 0.65 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.65 |
| ▸ | STK17B | O94768 | 2/20 | 0.65 |
| ▸ | STK10 | O94804 | 2/20 | 0.65 |
| ▸ | ABL1 | P00519 | 2/20 | 0.65 |
| ▸ | LCK | P06239 | 2/20 | 0.65 |
| ▸ | LYN | P07948 | 2/20 | 0.65 |
| ▸ | RET | P07949 | 2/20 | 0.65 |
| ▸ | MET | P08581 | 2/20 | 0.65 |
| ▸ | HCK | P08631 | 2/20 | 0.65 |
| ▸ | FGR | P09769 | 2/20 | 0.65 |
| ▸ | KIT | P10721 | 2/20 | 0.65 |
| ▸ | SRC | P12931 | 2/20 | 0.65 |
| ▸ | EPHA1 | P21709 | 2/20 | 0.65 |
| ▸ | ERBB3 | P21860 | 2/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL12474212 | 0.84 | EGFR (0.64) | EGFRERBB2BRAFCITGAK | |
| SCHEMBL5040071 | 0.81 | EGFR (0.61) | EGFRERBB2BRAFCITGAK | |
| Gefitinib SCHEMBL29351046 | 0.79 | EGFR (1.00) | EGFRERBB2BRAFCITGAK | |
| SCHEMBL1734701 | 0.79 | EGFR (1.00) | EGFRERBB2BRAFCITGAK | |
| Gefitinib SCHEMBL7866 | 0.79 | EGFR (1.00) | EGFRERBB2BRAFCITGAK | |
| Gefitinib SCHEMBL29351336 | 0.79 | EGFR (1.00) | EGFRERBB2BRAFCITGAK | |
| Gefitinib SCHEMBL465143 | 0.79 | EGFR (1.00) | EGFRERBB2BRAFCITGAK | |
| SCHEMBL27595565 | 0.79 | RAF1 (0.46) | EGFRERBB2BRAFERBB3KDR | |
| SCHEMBL2163611 | 0.78 | EGFR (0.81) | EGFRERBB2BRAFCITGAK | |
| Gefitinib SCHEMBL2770155 | 0.78 | EGFR (0.98) | EGFRERBB2BRAFCITGAK |
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-1521595-B1 | NOVEL DRUG COMPOSITIONS BASED ON NOVEL ANTICHOLINERGICS AND INHIBITORS OF EGFR-KINASE | BOEHRINGER INGELHEIM PHARMA (DE) | 2006-03-15 | — | — | EP | claimed |