Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | APAF1 | O14727 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.31 |
| ▸ | MMP14 | P50281 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SULT1A1 | P50225 | 1/20 | 0.31 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.30 |
| ▸ | SLC18A1 | P54219 | 1/20 | 0.30 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21320132 | 0.77 | ERN1 (0.42) | MEN1POLBBLMKMT2AALDH1A1 | |
| SCHEMBL17969655 | 0.75 | EGFR (0.36) | EGFRKDM1AARAPPMAPT | |
| SCHEMBL12260013 | 0.73 | EGFR (0.42) | EGFRKDM1AMEN1APAF1NPC1 | |
| SCHEMBL7672985 | 0.71 | EGFR (0.38) | EGFRMEN1APAF1NPC1POLB | |
| SCHEMBL2766868 | 0.71 | ALDH1A1 (0.45) | EGFRMEN1APAF1NPC1POLB | |
| SCHEMBL20593802 | 0.70 | ERN1 (0.41) | EGFRMEN1NPC1KMT2AAR | |
| SCHEMBL23048251 | 0.69 | TYR (0.52) | EGFRALDH1A1APP | |
| SCHEMBL15982261 | 0.69 | EGFR (0.37) | EGFRMEN1APAF1NPC1POLB | |
| SCHEMBL29953761 | 0.69 | TYR (0.52) | EGFRALDH1A1APP | |
| SCHEMBL4697903 | 0.69 | TDP1 (0.55) | EGFRMEN1NPC1POLBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105037202-A | Cyanide receptor compound based on 2-cyano-3-(6-N, N-dimethylamino-2-naphthyl) acrylonitrile, preparation method and application | UNIV NANJING SCIENCE & TECH | 2015-11-11 | — | — | CN | disclosed |