Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 4/20 | 0.53 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| P-Xylene SCHEMBL6845696 | 0.92 | ALDH1A1 (0.60) | ALDH1A1RECQLL3MBTL1NR1I2DRD2 | |
| SCHEMBL82830 | 0.92 | ALDH1A1 (0.60) | ALDH1A1RECQLL3MBTL1NR1I2DRD2 | |
| SCHEMBL10703376 | 0.90 | ACHE (0.59) | LTA4HNR5A1ACHEL3MBTL1DRD2 | |
| SCHEMBL274829 | 0.89 | ALDH1A1 (0.62) | LTA4HNR5A1CYP19A1ALDH1A1RECQL | |
| Propane SCHEMBL8652904 | 0.88 | LTA4H (0.62) | LTA4HNR5A1CYP19A1ALDH1A1RECQL | |
| Propane SCHEMBL11670801 | 0.88 | LTA4H (0.62) | LTA4HNR5A1CYP19A1ALDH1A1RECQL | |
| SCHEMBL18644007 | 0.88 | ALDH1A1 (0.56) | ALDH1A1RECQLL3MBTL1NR1I2DRD2 | |
| Alcohol SCHEMBL10789814 | 0.88 | NR1I2 (0.60) | ALDH1A1RECQLL3MBTL1NR1I2DRD2 | |
| SCHEMBL22005158 | 0.88 | LTA4H (0.62) | LTA4HNR5A1ACHEL3MBTL1DRD2 | |
| SCHEMBL2924048 | 0.85 | ALDH1A1 (0.58) | LTA4HNR5A1CYP19A1ALDH1A1RECQL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1153085-A2 | DISAZO DYES AND INKS CONTAINING THEM | Avecia Limited (GB) | 2001-11-14 | — | — | EP | disclosed |
| WO-2000043453-A2 | DISAZO DYES AND INKS CONTAINING THEM | AVECIA LIMITED (GB) | 2000-07-27 | — | — | WO | disclosed |