Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 18/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.43 |
| ▸ | KDR | P35968 | 2/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | FLT4 | P35916 | 1/20 | 0.43 |
| ▸ | CLK1 | P49759 | 1/20 | 0.43 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.43 |
| ▸ | TEK | Q02763 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19089676 | 0.91 | EGFR (0.43) | EGFRERBB2PDGFRBKDRAURKA | |
| SCHEMBL19089341 | 0.89 | EGFR (0.41) | EGFREPHB4ERBB3 | |
| SCHEMBL19089633 | 0.88 | EGFR (0.39) | EGFRERBB2EPHB4ERBB3 | |
| SCHEMBL19089671 | 0.84 | EGFR (0.46) | EGFRERBB2 | |
| SCHEMBL19089359 | 0.83 | EGFR (0.36) | EGFRERBB2EPHB4ERBB3 | |
| SCHEMBL35210335 | 0.83 | EGFR (0.58) | EGFRERBB3 | |
| SCHEMBL20548919 | 0.83 | EGFR (0.58) | EGFRERBB3 | |
| SCHEMBL19089627 | 0.82 | EPHA2 (0.39) | EGFRERBB2KDREPHB4ERBB3 | |
| SCHEMBL19089358 | 0.82 | EGFR (0.39) | EGFRFBP1ERBB3 | |
| SCHEMBL19089567 | 0.82 | CDK4 (0.49) | EGFRKDRTEKERBB3 |
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-2017114500-A1 | ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY | 恩瑞生物医药科技（上海）有限公司 | 2017-07-06 | — | — | WO | disclosed |