Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1A | P07327 | 5/20 | 0.43 |
| ▸ | ADH1C | P00326 | 4/20 | 0.43 |
| ▸ | ADH1B | P00325 | 1/20 | 0.43 |
| ▸ | SHBG | P04278 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4570869 | 1.00 | ADH1A (0.43) | ADH1AADH1CADH1BSHBGMEN1 | |
| SCHEMBL104547 | 0.98 | ADH1A (0.40) | ADH1AADH1CADH1BSHBGMEN1 | |
| SCHEMBL12890106 | 0.95 | ADH1A (0.37) | ADH1AADH1CADH1B | |
| SCHEMBL12744952 | 0.87 | — | — | |
| SCHEMBL20445569 | 0.84 | — | — | |
| SCHEMBL13301673 | 0.83 | ADH1A (0.45) | ADH1AADH1CADH1BSHBGMEN1 | |
| SCHEMBL17914492 | 0.82 | ADH1A (0.41) | ADH1AADH1CADH1BSHBGMEN1 | |
| SCHEMBL6337808 | 0.82 | ADH1A (0.41) | ADH1AADH1CADH1BSHBGMEN1 | |
| SCHEMBL17914487 | 0.82 | ADH1A (0.47) | ADH1AADH1CADH1BSHBGMEN1 | |
| SCHEMBL13503186 | 0.80 | SLC6A2 (0.42) | — |
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-7667052-B2 | Bioactive substance | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-02-23 | — | — | US | disclosed |