Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | APEX1 | P27695 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.33 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7059432 | 1.00 | TSHR (0.51) | TSHRALOX15APEX1LMNAMAPK1 | |
| SCHEMBL2088825 | 0.82 | TSHR (0.50) | TSHRALOX15APEX1LMNAMAPK1 | |
| SCHEMBL10999062 | 0.80 | STAT3 (0.35) | TSHRALOX15APEX1LMNATDP1 | |
| SCHEMBL7057351 | 0.80 | AOC3 (0.38) | TSHRALOX15APEX1AOC3GABBR2 | |
| SCHEMBL7057353 | 0.80 | AOC3 (0.38) | TSHRALOX15APEX1AOC3GABBR2 | |
| SCHEMBL10999065 | 0.80 | STAT3 (0.35) | TSHRALOX15APEX1LMNATDP1 | |
| SCHEMBL11001286 | 0.79 | LMNA (0.40) | TSHRLMNAMAPK1AOC3SLC6A4 | |
| SCHEMBL11001287 | 0.79 | LMNA (0.40) | TSHRLMNAMAPK1AOC3SLC6A4 | |
| SCHEMBL16070721 | 0.76 | HDAC8 (0.31) | TSHRALOX15APEX1 | |
| SCHEMBL2091742 | 0.75 | TSHR (0.55) | TSHRALOX15APEX1LMNAMAPK1 |
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-1053218-B1 | DIOL COMPOUNDS AS INTERMEDIATES FOR PREPARING ANTIMYCOTIC COMPOUNDS | ZAMBON SPA (IT) | 2003-05-07 | — | — | EP | disclosed |