Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | TDO2 | P48775 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | GABBR2 | O75899 | 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 | |
|---|---|---|---|---|
| SCHEMBL7057351 | 1.00 | AOC3 (0.38) | AOC3MRGPRX1KDM4EIDO1TDO2 | |
| SCHEMBL10999062 | 0.80 | STAT3 (0.35) | ALOX15TSHRAPEX1 | |
| SCHEMBL7059435 | 0.80 | TSHR (0.51) | AOC3HDAC4HDAC7HDAC5ALOX15 | |
| SCHEMBL7059432 | 0.80 | TSHR (0.51) | AOC3HDAC4HDAC7HDAC5ALOX15 | |
| SCHEMBL10999065 | 0.80 | STAT3 (0.35) | ALOX15TSHRAPEX1 | |
| SCHEMBL11001287 | 0.79 | LMNA (0.40) | AOC3KDM4ETSHRTRPA1 | |
| SCHEMBL11001286 | 0.79 | LMNA (0.40) | AOC3KDM4ETSHRTRPA1 | |
| SCHEMBL10671874 | 0.78 | AOC3 (0.45) | AOC3KDM4E | |
| SCHEMBL10671870 | 0.78 | AOC3 (0.45) | AOC3KDM4E | |
| SCHEMBL16070721 | 0.76 | HDAC8 (0.31) | HDAC8ALOX15TSHRAPEX1 |
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 |