Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29752747 | 0.87 | TSHR (0.61) | CYP2C9TSHRALDH1A1HPGDMAPT | |
| SCHEMBL7768552 | 0.85 | CYP2C9 (0.42) | CYP2C9TSHRMAPTHTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8899736 | 0.81 | APP (0.48) | CYP2C9TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL978754 | 0.81 | LMNA (0.55) | TSHRALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL668899 | 0.79 | KMT2A (0.48) | CYP2C9TSHRALDH1A1MAPTHTT | |
| SCHEMBL15861779 | 0.78 | CYP1A2 (0.51) | CYP2C9MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8811629 | 0.78 | AR (0.56) | TSHRALDH1A1HPGDMAPTHTT | |
| SCHEMBL1698976 | 0.78 | ALDH1A1 (0.43) | CYP2C9TSHRALDH1A1HPGDMAPT | |
| SCHEMBL7089770 | 0.76 | CYP2C9 (0.43) | CYP2C9TSHRALDH1A1HPGDMAPT | |
| SCHEMBL7768977 | 0.75 | RARB (0.54) | TSHRMAPTMAPK1LMNAPKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0663391-B1 | Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls | HOFFMANN LA ROCHE (CH) | 1997-04-09 | — | — | EP | disclosed |
| US-5521160-A | COMPOUNDS FOR TREATMENT OF ATHERIOSCLEROSIS IN BLOOD VESSELS AND PREVENTION OF RESTENOSIS AFTER ANGIOPLASTY | HOFFMANN-LA ROCHE INC. (US) | 1996-05-28 | — | — | US | disclosed |
| EP-0663391-A1 | Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls | F. HOFFMANN-LA ROCHE AG (CH) | 1995-07-19 | — | — | EP | disclosed |