Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | KDM5A | P29375 | 1/20 | 0.44 |
| ▸ | JMJD1C | Q15652 | 1/20 | 0.44 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.44 |
| ▸ | ACVRL1 | P37023 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | TYK2 | P29597 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2714790 | 0.85 | KDM4E (0.61) | ADORA1ADORA2AADORA3LMNAKDM4E | |
| SCHEMBL30449743 | 0.84 | GSK3B (0.56) | ADORA1ADORA2AADORA3LMNAKDM4E | |
| SCHEMBL22186405 | 0.80 | KDM4E (0.58) | ADORA1ADORA2AADORA3LMNAKDM4E | |
| SCHEMBL2715477 | 0.79 | JAK1 (0.47) | ADORA1ADORA2AADORA3LMNAKDM4E | |
| SCHEMBL4550822 | 0.77 | ADORA1 (0.47) | ADORA1ADORA2AADORA3KDM4EHPGD | |
| SCHEMBL29155745 | 0.75 | POLB (0.64) | ADORA1ADORA2AADORA3LMNAKDM4E | |
| SCHEMBL22809469 | 0.72 | HPGD (0.46) | ADORA1ADORA2AADORA3LMNAACVRL1 | |
| SCHEMBL18906054 | 0.72 | ADORA1 (0.50) | ADORA1ADORA2AADORA3LMNAKDM4E | |
| SCHEMBL22809643 | 0.71 | HPGD (0.45) | ADORA1ADORA2AADORA3LMNAACVRL1 | |
| SCHEMBL18266119 | 0.71 | KDM4E (0.58) | ADORA1ADORA2AADORA3LMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012053186-A1 | ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC. (JP) | 2012-04-26 | — | — | WO | disclosed |