Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 18/20 | 0.66 |
| ▸ | EGFR | P00533 | 13/20 | 0.66 |
| ▸ | LCK | P06239 | 1/20 | 0.66 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.64 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.64 |
| ▸ | AURKA | O14965 | 1/20 | 0.60 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6980188 | 0.88 | ERBB2 (0.73) | ERBB2EGFRLCKERBB3ERBB4 | |
| SCHEMBL30125866 | 0.84 | ERBB2 (0.73) | ERBB2EGFRLCKERBB3ERBB4 | |
| SCHEMBL9973619 | 0.84 | ERBB2 (0.73) | ERBB2EGFRLCKERBB3ERBB4 | |
| SCHEMBL5568971 | 0.84 | ERBB2 (0.76) | ERBB2EGFRLCKERBB3ERBB4 | |
| SCHEMBL17845956 | 0.84 | ERBB2 (0.73) | ERBB2EGFRLCKERBB3ERBB4 | |
| SCHEMBL2989878 | 0.84 | ERBB2 (0.73) | ERBB2EGFRLCKERBB3ERBB4 | |
| Hydrochloric Acid SCHEMBL17845945 | 0.83 | ERBB2 (0.72) | ERBB2EGFRLCKERBB3ERBB4 | |
| Hydrochloric Acid SCHEMBL29793455 | 0.83 | ERBB2 (0.72) | ERBB2EGFRLCKERBB3ERBB4 | |
| SCHEMBL27751265 | 0.83 | ERBB2 (0.72) | ERBB2EGFRLCKERBB3ERBB4 | |
| SCHEMBL4858939 | 0.83 | AURKA (0.57) | ERBB2EGFRLCKERBB3ERBB4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1844022-A1 | QUINAZOLINE DERIVATIVES FOR INHIBITING CANCER CELL GROWTH AND METHOD FOR THE PREPARATION THEREOF | Hanmi Pharm. Co., Ltd. (KR) | 2007-10-17 | — | — | EP | disclosed |
| WO-2006071017-A1 | QUINAZOLINE DERIVATIVES FOR INHIBITING CANCER CELL GROWTH AND METHOD FOR THE PREPARATION THEREOF | HANMI PHARM. CO., LTD. (KR) | 2006-07-06 | — | — | WO | disclosed |