Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | NOX1 | Q9Y5S8 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6141824 | 0.94 | MAPT (0.55) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL7664793 | 0.91 | ADRA2A (0.58) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL11171615 | 0.83 | ADRA2A (0.51) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL9514595 | 0.83 | NPC1 (0.68) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL11729511 | 0.83 | MAPT (0.54) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL141889 | 0.83 | NPC1 (0.68) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL22415842 | 0.82 | ALDH1A1 (0.49) | EGFRMAPTMEN1KMT2ARAB9A | |
| SCHEMBL6440382 | 0.82 | MAPT (0.50) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL15145185 | 0.82 | VCP (0.58) | EGFRADRA2AADRA2BADRA2CMAPT | |
| SCHEMBL10949857 | 0.82 | ALDH1A1 (0.76) | EGFRADRA2AADRA2BADRA2CMAPT |
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-2010494-B1 | SPECIFIC MONOCATIONIC MONOCHROMOPHORIC COMPOUNDS OF HYDRAZONE TYPE COMPRISING A 2-, 4-PYRIDINIUM OR 2-, 4-QUINOLINIUM UNIT, SYNTHESIS THEREOF, DYE COMPOSITIONS CONTAINING THEM, AND METHOD FOR DYEING KERATIN FIBRES | OREAL (FR) | 2012-02-01 | — | — | EP | disclosed |