Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 17/20 | 0.63 |
| ▸ | KDR | P35968 | 12/20 | 0.63 |
| ▸ | BRAF | P15056 | 3/20 | 0.63 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL12694354 | 0.93 | KDR (0.64) | EGFRKDRAURKA | |
| SCHEMBL12694382 | 0.90 | EGFR (0.79) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694308 | 0.83 | EGFR (0.72) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694304 | 0.81 | EGFR (0.69) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694350 | 0.81 | EGFR (0.72) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694351 | 0.80 | EGFR (0.67) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694363 | 0.79 | EGFR (0.80) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694392 | 0.78 | EGFR (1.00) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694370 | 0.77 | EGFR (0.85) | EGFRKDRBRAFAURKA | |
| SCHEMBL12694376 | 0.76 | EGFR (0.78) | EGFRKDRBRAFAURKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012089137-A1 | ARYLUREA COMPOUND, INTERMEDIATE AND USE THEREOF | 上海医药工业研究院 (CN) | 2012-07-05 | — | — | WO | disclosed |