Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 12/20 | 0.45 |
| ▸ | PTAFR | P25105 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | ITK | Q08881 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6869813 | 0.86 | ADORA2A (0.44) | NPC1RAB9AADORA2APOLBMEN1 | |
| SCHEMBL6863074 | 0.86 | ADORA2A (0.62) | ADORA2APTAFRPOLBMEN1MAPT | |
| SCHEMBL6869714 | 0.83 | ADORA2A (0.43) | NPC1RAB9AADORA2APTAFRPOLB | |
| SCHEMBL6871451 | 0.82 | ADORA2A (0.66) | ADORA2A | |
| SCHEMBL6863095 | 0.81 | ADORA2A (0.67) | ADORA2A | |
| SCHEMBL6863742 | 0.81 | ADORA2A (0.52) | ADORA2APOLBMEN1MAPTHPGD | |
| SCHEMBL6870495 | 0.80 | POLB (0.42) | NPC1RAB9AADORA2APOLBMEN1 | |
| SCHEMBL6868095 | 0.79 | KDM4E (0.53) | NPC1RAB9AADORA2AMEN1MAPT | |
| SCHEMBL6870143 | 0.78 | ADORA2A (0.65) | NPC1RAB9AADORA2AMEN1MAPT | |
| SCHEMBL6872164 | 0.78 | ADORA2A (0.59) | ADORA2AMEN1MAPTHPGDKMT2A |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |