Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 11/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 6/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25912717 | 0.91 | P2RX3 (0.36) | ADORA2AADORA1BRAFACACBMAP3K12 | |
| SCHEMBL25911492 | 0.87 | TLR7 (0.34) | ADORA2AADORA1ACACBCSF1RPDGFRB | |
| SCHEMBL25910282 | 0.87 | TLR7 (0.34) | ADORA2AADORA1ACACBCSF1RPDGFRB | |
| SCHEMBL25910285 | 0.84 | PDGFRB (0.45) | BRAFCSF1RPDGFRBPDGFRA | |
| SCHEMBL25910828 | 0.84 | BRAF (0.45) | BRAFCSF1RPDGFRBPDGFRA | |
| SCHEMBL25911473 | 0.84 | CSF1R (0.48) | CSF1RPDGFRBPDGFRA | |
| SCHEMBL25909902 | 0.84 | CSF1R (0.48) | CSF1RPDGFRBPDGFRA | |
| SCHEMBL25910414 | 0.84 | PDGFRB (0.45) | BRAFCSF1RPDGFRBPDGFRA | |
| SCHEMBL25910548 | 0.82 | BRAF (0.41) | BRAFCSF1RPDGFRBPDGFRA | |
| SCHEMBL25911490 | 0.81 | KCNH2 (0.37) | ADORA2AADORA1 |
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-2023125812-A1 | SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF | 上海海雁医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |