Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.68 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.68 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.59 |
| ▸ | ACHE | P22303 | 2/20 | 0.55 |
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.44 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13679680 | 0.93 | HDAC8 (0.60) | HDAC8HDAC6HRH3ACHECES2 | |
| SCHEMBL540981 | 0.86 | HRH3 (0.71) | HDAC8HDAC6HRH3ACHEBCHE | |
| SCHEMBL4289838 | 0.86 | HDAC8 (0.66) | HDAC8HDAC6HRH3ACHEBCHE | |
| Hydrochloric Acid SCHEMBL6297059 | 0.84 | HDAC8 (0.64) | HDAC8HDAC6HRH3ACHEBCHE | |
| SCHEMBL7809399 | 0.84 | HDAC8 (0.64) | HDAC8HDAC6HRH3ACHEBCHE | |
| SCHEMBL5393101 | 0.84 | HDAC8 (0.64) | HDAC8HDAC6HRH3ACHEBCHE | |
| Hydrochloric Acid SCHEMBL9837835 | 0.82 | HDAC8 (0.62) | HDAC8HDAC6HRH3ACHEBCHE | |
| SCHEMBL7768079 | 0.82 | HRH3 (0.84) | HDAC8HDAC6HRH3 | |
| SCHEMBL5068516 | 0.81 | HDAC8 (0.65) | HDAC8HDAC6HRH3ACHEBCHE | |
| SCHEMBL16187980 | 0.81 | ACHE (0.63) | HDAC8HDAC6HRH3ACHEBCHE |
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-0999835-B1 | IMIDAZOLE DERIVATIVES AS MDR MODULATORS | TAIJI BIOMEDICAL INC (US) | 2009-09-09 | — | — | EP | disclosed |