Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 10/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 9/20 | 0.47 |
| ▸ | CALCA | P06881 | 3/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4068934 | 0.87 | CALCA (0.44) | ADORA2AADORA1CALCAADORA3ADORA2B | |
| SCHEMBL4059925 | 0.80 | CALCA (0.38) | CALCAEGLN1 | |
| SCHEMBL4063494 | 0.68 | EGLN1 (0.47) | ADORA2AADORA1CALCAEGLN1L3MBTL1 | |
| SCHEMBL7687034 | 0.68 | EGLN1 (0.66) | ADORA2AADORA1EGLN1ALDH1A1 | |
| SCHEMBL14007368 | 0.67 | EGLN1 (0.59) | ADORA2AADORA1CALCAADORA3ADORA2B | |
| SCHEMBL4061526 | 0.67 | ADORA2A (0.53) | ADORA2AADORA1CALCAADORA3ADORA2B | |
| SCHEMBL4057517 | 0.67 | ADORA2A (0.53) | ADORA2AADORA1ADORA3ADORA2BEGLN1 | |
| SCHEMBL4062087 | 0.67 | EGLN1 (0.58) | CALCAEGLN1MAPT | |
| SCHEMBL4060173 | 0.67 | LMNA (0.52) | CALCAEGLN1L3MBTL1LMNA | |
| SCHEMBL4066709 | 0.66 | EGLN1 (0.43) | ADORA2AADORA1CALCAEGLN1L3MBTL1 |
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-1326865-B1 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2009-05-06 | — | — | EP | claimed |