Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.49 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | EDNRB | P24530 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MC4R | P32245 | 1/20 | 0.42 |
| ▸ | MC3R | P41968 | 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 | |
|---|---|---|---|---|
| SCHEMBL15614666 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| SCHEMBL28088769 | 0.90 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| SCHEMBL21359025 | 0.87 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| SCHEMBL28642990 | 0.85 | GABBR2 (0.47) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL2292396 | 0.85 | GABBR2 (0.61) | CYP1A2CYP2D6GABBR2GABBR1CYP2C19 | |
| SCHEMBL28346014 | 0.85 | GABBR2 (0.61) | CYP1A2CYP2D6GABBR2GABBR1CYP2C19 | |
| SCHEMBL186239 | 0.85 | ALDH1A1 (0.56) | ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| SCHEMBL186231 | 0.85 | ALDH1A1 (0.56) | ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| SCHEMBL186417 | 0.85 | ALDH1A1 (0.56) | ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| SCHEMBL9105247 | 0.85 | ALDH1A1 (0.63) | ALDH1A1CYP1A2CYP2D6PKMSMN1; SMN2 |
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-2401260-A1 | DIOXO-IMIDAZOLIDINE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM | Galderma Research & Development (FR) | 2012-01-04 | — | — | EP | disclosed |
| WO-2010097465-A1 | DIOXO-IMIDAZOLIDINE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM | GALDERMA RESEARCH & DEVELOPMENT (FR) | 2010-09-02 | — | — | WO | disclosed |