Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.47 |
| ▸ | ROS1 | P08922 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 6/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 6/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 6/20 | 0.42 |
| ▸ | DGAT2 | Q96PD7 | 3/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 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 | |
|---|---|---|---|---|
| SCHEMBL17769005 | 0.88 | ROS1 (0.44) | ADORA2AROS1RPS6KB1ADORA1MAPK8 | |
| SCHEMBL17768730 | 0.82 | ADORA2A (0.55) | ADORA2AADORA1 | |
| SCHEMBL17768814 | 0.80 | ADORA2A (0.52) | ADORA2AADORA1DGAT2 | |
| SCHEMBL17768942 | 0.77 | ADORA2A (0.66) | ADORA2AADORA1 | |
| SCHEMBL17778124 | 0.76 | ADORA2A (0.55) | ADORA2AADORA1PIK3CD | |
| SCHEMBL17768871 | 0.75 | TP53 (0.49) | — | |
| SCHEMBL17769000 | 0.74 | ADORA2A (0.52) | ADORA2AADORA1 | |
| SCHEMBL17768815 | 0.72 | ADORA2A (0.54) | ADORA2AADORA1 | |
| SCHEMBL17768864 | 0.71 | ADORA2A (0.48) | ADORA2AADORA1 | |
| SCHEMBL17768994 | 0.71 | ADORA2A (0.50) | ADORA2AADORA1MAPK8MAPK9MAPK10 |
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-2016081290-A1 | AMINOPYRAZINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME CORP. (US) | 2016-05-26 | — | — | WO | disclosed |