Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.54 |
| ▸ | CYP4A11 | Q02928 | 4/20 | 0.49 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.49 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31683130 | 1.00 | HDAC6 (0.54) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL5031812 | 0.93 | HDAC6 (0.54) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL5034750 | 0.92 | CYP4A11 (0.52) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL5030987 | 0.90 | HDAC6 (0.51) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL5030400 | 0.90 | HDAC6 (0.51) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL10290842 | 0.89 | HDAC6 (0.50) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL5031390 | 0.89 | HDAC6 (0.50) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL31683272 | 0.88 | HDAC6 (0.68) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 | |
| SCHEMBL5674694 | 0.86 | HDAC6 (0.48) | HDAC6PSMB8HDAC1HDAC3HDAC2 | |
| SCHEMBL5028015 | 0.85 | HDAC6 (0.47) | HDAC6CYP4A11CYP4F2PSMB8HDAC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1476448-A2 | AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE | PHARMACIA & UPJOHN COMPANY (US) | 2004-11-17 | — | — | EP | disclosed |
| WO-2003070731-A2 | AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE | PHARMACIA & UPJOHN COMPANY (US) | 2003-08-28 | — | — | WO | disclosed |