Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16573271 | 0.92 | POLB (0.49) | ALDH1A1AOC3HDAC3HDAC4HDAC1 | |
| SCHEMBL7688792 | 0.90 | ALDH1A1 (0.47) | ALDH1A1LMNAAOC3HDAC3HDAC4 | |
| SCHEMBL30779193 | 0.86 | AOC3 (0.60) | ALDH1A1LMNAAOC3HDAC3HDAC4 | |
| SCHEMBL20459167 | 0.82 | PEPD (0.53) | ALDH1A1LMNAAOC3HDAC3HDAC4 | |
| SCHEMBL16573306 | 0.82 | HDAC1 (0.51) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL10760567 | 0.79 | ALDH1A1 (0.53) | ALDH1A1LMNAAOC3HDAC3HDAC4 | |
| SCHEMBL987285 | 0.79 | HDAC3 (0.72) | ALDH1A1LMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL7328828 | 0.78 | POLB (0.53) | ALDH1A1TAS2R38POLBFFAR1NR1H4 | |
| SCHEMBL4512426 | 0.78 | EPHX2 (0.52) | ALDH1A1MAPTSMN1; SMN2HTT | |
| SCHEMBL16573272 | 0.76 | EPHX2 (0.55) | ALDH1A1POLBMAPTSMN1; SMN2HTT |
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-2444085-B1 | Diarylhydantoin compounds as androgen receptor antagonists for treatment of cancer | UNIV CALIFORNIA (US) | 2015-03-18 | — | — | EP | disclosed |