Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13680803 | 0.87 | CNR1 (0.44) | AOC3ALDH1A1FFAR1PIP4K2APIP4K2B | |
| SCHEMBL13680802 | 0.87 | MGLL (0.45) | AOC3SMN1; SMN2MAPTHPGDFFAR1 | |
| SCHEMBL13680800 | 0.86 | KIF11 (0.52) | AOC3MAPTFFAR1 | |
| SCHEMBL13680807 | 0.86 | AOC3 (0.61) | AOC3 | |
| SCHEMBL13680788 | 0.82 | MAPT (0.50) | AOC3SMN1; SMN2MAPTLMNAHSD17B1 | |
| SCHEMBL13060852 | 0.81 | AOC3 (0.62) | AOC3SMN1; SMN2HTTL3MBTL1CYP17A1 | |
| SCHEMBL2833160 | 0.81 | AOC3 (0.53) | AOC3SMN1; SMN2HTTL3MBTL1MEN1 | |
| SCHEMBL13680791 | 0.78 | GAA (0.55) | SMN1; SMN2MEN1KMT2AMAPTHPGD | |
| SCHEMBL13680804 | 0.78 | HSD17B1 (0.47) | SMN1; SMN2HTTALDH1A1HPGDKDM4E | |
| SCHEMBL13680789 | 0.78 | ERN1 (0.50) | MEN1KMT2AALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |