Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 11/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.33 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9586039 | 0.77 | ALDH1A1 (0.48) | ERN1ALDH1A1GAAKDM4ETSHR | |
| SCHEMBL30705516 | 0.76 | ALDH1A1 (0.39) | ERN1ALDH1A1GAAKDM4ETSHR | |
| SCHEMBL9681854 | 0.76 | ALDH1A1 (0.39) | ERN1ALDH1A1GAAKDM4ETSHR | |
| SCHEMBL9267418 | 0.72 | ALDH1A1 (0.39) | ERN1ALDH1A1GAAKDM4ETSHR | |
| SCHEMBL9846110 | 0.72 | GAA (0.55) | ALDH1A1GAAKDM4E | |
| SCHEMBL12090841 | 0.69 | ALDH1A1 (0.39) | ERN1ALDH1A1GAAKDM4ETSHR | |
| SCHEMBL30701222 | 0.69 | ERN1 (0.46) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL19330163 | 0.69 | ERN1 (0.46) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL9846251 | 0.69 | GRM1 (0.37) | ERN1ALDH1A1GAAKDM4ETSHR | |
| SCHEMBL9828231 | 0.67 | ALDH1A1 (0.55) | ERN1ALDH1A1GAAKDM4ETSHR |
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-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |