Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | TOP2A | P11388 | 1/20 | 0.46 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL101223 | 0.93 | HDAC1 (0.51) | AKR1C3AKR1C2MAPTHDAC3HDAC4 | |
| SCHEMBL101623 | 0.92 | HDAC2 (0.48) | MAPTHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL99629 | 0.90 | MAPT (0.50) | AKR1C3AKR1C2MAPTHTTHCAR2 | |
| SCHEMBL99215 | 0.90 | AKR1C3 (0.49) | AKR1C3AKR1C2MAPTHTTHCAR2 | |
| SCHEMBL15821963 | 0.89 | AKR1C3 (0.50) | AKR1C3AKR1C2MAPTHTTHCAR2 | |
| SCHEMBL100326 | 0.87 | HCAR2 (0.46) | AKR1C3AKR1C2MAPTHTTHCAR2 | |
| SCHEMBL100288 | 0.86 | PTGDR2 (0.46) | AKR1C3AKR1C2MAPTHTTHCAR2 | |
| SCHEMBL100587 | 0.86 | RORC (0.46) | AKR1C3AKR1C2MAPTHCAR2HDAC3 | |
| SCHEMBL101142 | 0.85 | AKR1C3 (0.53) | AKR1C3AKR1C2MAPTHTTHCAR2 | |
| SCHEMBL99615 | 0.84 | RAB9A (0.55) | AKR1C3AKR1C2HCAR2GAARORC |
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-2426121-A1 | QUATERNARY AMMONIUM SALT COMPOUND | Teijin Pharma Limited (JP) | 2012-03-07 | — | — | EP | claimed |