Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | CD38 | P28907 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.46 |
| ▸ | RET | P07949 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.45 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.44 |
| ▸ | CDC7 | O00311 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | CFD | P00746 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL3698515 | 0.85 | PARP1 (0.44) | RETSHMT1MKNK2BAZ2BBAZ2A | |
| SCHEMBL3704899 | 0.82 | PARP1 (0.42) | RETHDAC8SHMT1BAZ2BBAZ2A | |
| SCHEMBL3708765 | 0.81 | FAAH (0.43) | KDM4EALDH1A1HPGDSHMT1FYN | |
| SCHEMBL16438662 | 0.76 | ALDH1A1 (0.49) | ALDH1A1HPGDCDC7ROCK2GSK3B | |
| SCHEMBL6432991 | 0.75 | NR1H4 (0.45) | PLA2G2AROCK2 | |
| SCHEMBL3714028 | 0.74 | ALDH1A1 (0.46) | ARCD38KDM4EALDH1A1HPGD | |
| SCHEMBL3135455 | 0.74 | PARP1 (0.53) | FYNBAZ2BBAZ2A | |
| SCHEMBL5307077 | 0.73 | PARP1 (0.56) | PLA2G2ACDC7ROCK2GSK3BCLK4 | |
| SCHEMBL12497396 | 0.73 | APP (0.65) | ALDH1A1CDC7ROCK2MAP4K4GSK3B | |
| Hydrochloric Acid SCHEMBL29287827 | 0.73 | PARP1 (0.51) | BAZ2BBAZ2A |
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-2197835-A1 | BICYCLIC ARYL AND HETEROARYL RECEPTOR MODULATORS | Prosidion Limited (GB) | 2010-06-23 | — | — | EP | disclosed |
| WO-2009030962-A1 | BICYCLIC ARYL AND HETEROARYL RECEPTOR MODULATORS | PROSIDION LIMITED (GB) | 2009-03-12 | — | — | WO | disclosed |