Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 3/20 | 0.42 |
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8171401 | 0.98 | HRH3 (0.55) | HRH3KDM4EGAAHIF1AEPAS1 | |
| SCHEMBL8183430 | 0.84 | AOC3 (0.45) | HRH3KDM4EGAAALDH1A1MAPT | |
| SCHEMBL8178308 | 0.83 | HRH3 (0.58) | HRH3KDM4EGAAHIF1AEPAS1 | |
| SCHEMBL3592586 | 0.82 | HRH3 (0.57) | HRH3KDM4EHIF1AEPAS1ALDH1A1 | |
| SCHEMBL6580820 | 0.81 | HRH3 (0.56) | HRH3KDM4EHIF1AEPAS1ALDH1A1 | |
| SCHEMBL8184741 | 0.79 | HRH3 (0.61) | HRH3KDM4EALDH1A1MAPTL3MBTL1 | |
| SCHEMBL8179534 | 0.79 | HRH3 (0.58) | HRH3KDM4EHIF1AEPAS1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8176778 | 0.79 | HRH3 (0.58) | HRH3KDM4EHIF1AEPAS1ALDH1A1 | |
| SCHEMBL8176935 | 0.76 | HRH3 (0.51) | HRH3KDM4EGAAHIF1AEPAS1 | |
| SCHEMBL10648005 | 0.76 | HRH3 (0.51) | HRH3KDM4EHIF1AEPAS1ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1070708-B1 | Triazole derivatives | HOFFMANN LA ROCHE (CH) | 2004-01-14 | — | — | EP | disclosed |
| US-6265426-B1 | CENTRAL NERVOUS SYSTEM DISORDERS | HOFFMANN-LA ROCHE INC. | 2001-07-24 | — | — | US | disclosed |
| EP-1070708-A1 | Triazole and imidazole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 2001-01-24 | — | — | EP | disclosed |
| US-6090804-A | PSYCHOLOGICAL DISORDERS; SCHIZOPHRENIA THERAPY | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 2000-07-18 | — | — | US | disclosed |
| EP-0921123-A1 | NOVEL THIOPHENE DERIVATIVES AND DRUG COMPOSITIONS CONTAINING THE SAME | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1999-06-09 | — | — | EP | disclosed |