Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.44 |
| ▸ | WNT3A | P56704 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29779889 | 0.91 | ALDH1A1 (0.59) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| SCHEMBL1427156 | 0.91 | ALDH1A1 (0.59) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| SCHEMBL29593208 | 0.84 | CES2 (0.65) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| SCHEMBL13461 | 0.84 | CES2 (0.65) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| Hydrochloric Acid SCHEMBL7418290 | 0.82 | CES2 (0.62) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| SCHEMBL29169247 | 0.79 | CES2 (0.58) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| Fluorobenzene SCHEMBL28799844 | 0.77 | CES2 (0.56) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| Isopropyl Alcohol SCHEMBL29078917 | 0.77 | CES2 (0.56) | ALDH1A1PTPN1ERCC5FEN1ALOX15 | |
| SCHEMBL11737575 | 0.76 | ALDH1A1 (0.61) | ALDH1A1ERCC5FEN1ALOX15CES2 | |
| SCHEMBL8585700 | 0.76 | PTPN1 (0.44) | ALDH1A1PTPN1ERCC5FEN1ALOX15 |
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-1998035560-A1 | HERBICIDAL COMPOSITION FOR USE IN RICE CROP | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1998-08-20 | — | — | WO | disclosed |