Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.76 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.76 |
| ▸ | CES2 | O00748 | 3/20 | 0.56 |
| ▸ | CES1 | P23141 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31574193 | 0.89 | CES2 (0.68) | ALDH1A1ALOX15CES2CES1GAA | |
| SCHEMBL27185988 | 0.89 | CES2 (0.68) | ALDH1A1ALOX15CES2CES1GAA | |
| SCHEMBL30733529 | 0.87 | ALDH1A1 (1.00) | ALDH1A1ALOX15CES2CES1GAA | |
| SCHEMBL60101 | 0.87 | ALDH1A1 (1.00) | ALDH1A1ALOX15CES2CES1GAA | |
| SCHEMBL30293901 | 0.87 | CES2 (0.71) | ALDH1A1ALOX15CES2CES1GAA | |
| SCHEMBL250099 | 0.87 | CES2 (0.71) | ALDH1A1ALOX15CES2CES1GAA | |
| SCHEMBL9375700 | 0.87 | ALDH1A1 (0.58) | ALDH1A1ALOX15CES2CES1GAA | |
| Hydrochloric Acid SCHEMBL27733532 | 0.84 | CES2 (0.68) | ALDH1A1ALOX15CES2CES1GAA | |
| Hydrochloric Acid SCHEMBL8177437 | 0.84 | ALDH1A1 (0.54) | ALDH1A1ALOX15CES2CES1GAA | |
| Methylene Chloride SCHEMBL27984894 | 0.81 | ALDH1A1 (0.87) | ALDH1A1ALOX15CES2CES1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5117057-A | Insecticidal N' substituted-N-N'-disubstituted-hydrazines | ROHM AND HAAS COMPANY (US) | 1992-05-26 | — | — | US | disclosed |