Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 13/20 | 0.64 |
| ▸ | ERBB2 | P04626 | 10/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.60 |
| ▸ | SRC | P12931 | 3/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5474458 | 0.99 | EGFR (0.64) | EGFRERBB2KCNH2SRCKDR | |
| SCHEMBL4028921 | 0.92 | EGFR (0.66) | EGFRERBB2KCNH2SRC | |
| Hydrochloric Acid SCHEMBL5478352 | 0.92 | EGFR (0.65) | EGFRERBB2KCNH2SRC | |
| SCHEMBL4027687 | 0.91 | EGFR (0.70) | EGFRERBB2KCNH2SRCKDR | |
| Hydrochloric Acid SCHEMBL4037450 | 0.89 | EGFR (0.64) | EGFRERBB2KCNH2SRCKDR | |
| SCHEMBL4028668 | 0.89 | EGFR (0.68) | EGFRERBB2KCNH2SRC | |
| SCHEMBL4029145 | 0.89 | EGFR (0.67) | EGFRERBB2KCNH2SRC | |
| SCHEMBL4031385 | 0.88 | EGFR (0.78) | EGFRERBB2KCNH2SRC | |
| SCHEMBL4029413 | 0.88 | EGFR (0.79) | EGFRERBB2KCNH2SRC | |
| Hydrochloric Acid SCHEMBL5472240 | 0.87 | EGFR (0.78) | EGFRERBB2KCNH2SRC |
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-1444210-B1 | QUNAZOLINE DERIVATIVES AS ANTITUMOR AGENTS | ASTRAZENECA AB (SE) | 2009-02-18 | — | — | EP | disclosed |